#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 0.49 -0.25 1.61 2.88 -1.26 -4.75 113.62 112.35 2doe n SER 778 Ca 0.00 0.43 0.06 0.00 -1.33 0.00 0.00 58.87 58.03 2doe n SER 778 Cb 0.00 -0.72 0.18 0.00 -0.75 0.00 0.00 64.21 62.92 2doe n SER 778 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2doe h SER 779 N 7.82 -0.10 -5.00 -3.46 0.87 -2.06 -3.48 113.55 108.15 2doe h SER 779 Ca -0.07 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2doe h SER 779 Cb 1.10 0.25 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 2doe h SER 779 CO 0.93 -0.09 0.00 0.61 -0.53 0.00 0.00 176.83 177.75 2doe n GLY 780 N -1.37 1.48 3.79 5.77 0.00 -1.26 -4.94 105.19 108.66 2doe n GLY 780 Ca 0.14 -2.19 -0.30 0.00 0.00 0.00 0.00 46.02 43.67 2doe n GLY 780 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2doe s SER 781 N 0.00 4.54 -1.74 1.61 0.15 -1.26 -3.70 113.70 113.30 2doe s SER 781 Ca 0.00 1.43 -0.18 0.00 0.70 0.00 0.00 55.95 57.90 2doe s SER 781 Cb 0.00 -2.18 0.16 0.00 -1.71 0.00 0.00 66.02 62.29 2doe s SER 781 CO 0.00 -1.95 0.63 -0.24 1.20 0.00 0.00 173.24 172.87 2doe n SER 782 N -3.43 -2.20 0.00 5.45 2.88 -1.26 -4.89 113.62 110.16 2doe n SER 782 Ca 0.07 -1.12 0.00 0.00 -1.33 0.00 0.00 58.87 56.49 2doe n SER 782 Cb 0.55 -2.27 0.00 0.00 -0.75 0.00 0.00 64.21 61.75 2doe n SER 782 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2doe n GLY 783 N -1.42 1.37 2.25 0.46 0.00 -1.24 -4.85 105.19 101.76 2doe n GLY 783 Ca 0.03 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 2doe n GLY 783 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2doe n GLU 784 N 0.00 3.13 -1.65 1.61 2.13 -1.26 -5.08 120.64 119.51 2doe n GLU 784 Ca 0.00 -4.02 -0.39 0.00 0.66 0.00 0.00 57.16 53.41 2doe n GLU 784 Cb 0.00 -2.10 0.04 0.00 0.27 0.00 0.00 31.44 29.64 2doe n GLU 784 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2doe n LYS 785 N -0.66 1.25 -2.24 5.31 3.00 -1.26 -4.83 118.16 118.73 2doe n LYS 785 Ca 0.35 0.47 -0.33 0.00 -0.00 0.00 0.00 58.31 58.80 2doe n LYS 785 Cb 0.91 -2.25 -0.04 0.00 0.00 0.00 0.00 35.03 33.65 2doe n LYS 785 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2doe s GLU 786 N -2.59 2.98 -0.30 1.64 2.12 -1.26 -4.92 118.70 116.37 2doe s GLU 786 Ca 0.71 -0.92 -0.03 0.00 0.36 0.00 0.00 54.97 55.09 2doe s GLU 786 Cb -0.45 -5.24 0.04 0.00 0.26 0.00 0.00 34.13 28.74 2doe s GLU 786 CO 0.50 -3.10 0.01 -0.51 -0.54 0.00 0.00 175.26 171.63 2doe s ASP 787 N 6.44 4.90 -0.87 -1.70 1.01 -1.26 -5.05 116.67 120.14 2doe s ASP 787 Ca 0.62 -1.17 -0.23 0.00 0.71 0.00 0.00 52.55 52.47 2doe s ASP 787 Cb -0.02 -1.74 0.06 0.00 1.01 0.00 0.00 42.92 42.23 2doe s ASP 787 CO 0.02 -0.25 1.27 -0.44 0.21 0.00 0.00 175.17 175.97 2doe s SER 788 N 1.30 6.37 -0.25 0.27 0.01 -1.26 -4.76 113.70 115.38 2doe s SER 788 Ca -0.04 -1.18 -0.06 0.00 1.31 0.00 0.00 55.95 55.98 2doe s SER 788 Cb -0.19 -2.51 -0.13 0.00 0.21 0.00 0.00 66.02 63.39 2doe s SER 788 CO -0.01 -1.52 -0.28 0.29 0.41 0.00 0.00 173.24 172.13 2doe n LYS 789 N 8.46 0.57 -1.90 12.44 5.02 -1.26 -4.58 118.16 136.92 2doe n LYS 789 Ca 0.17 0.20 -0.38 0.00 -2.02 0.00 0.00 58.31 56.27 2doe n LYS 789 Cb 0.49 -1.45 0.04 0.00 -0.02 0.00 0.00 35.03 34.10 2doe n LYS 789 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2doe n THR 790 N -3.73 3.48 -0.88 -0.18 -1.04 -1.26 -4.77 114.28 105.89 2doe n THR 790 Ca -0.47 -4.18 -0.11 0.00 -2.04 0.00 0.00 64.05 57.24 2doe n THR 790 Cb 0.90 -1.23 -0.04 0.00 -1.82 0.00 0.00 70.33 68.14 2doe n THR 790 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2doe n ARG 791 N -0.59 1.68 -0.02 -2.82 1.85 -1.26 -4.23 116.66 111.27 2doe n ARG 791 Ca 0.54 -1.02 -0.22 0.00 -1.00 0.00 0.00 57.85 56.15 2doe n ARG 791 Cb 0.34 -1.59 -0.13 0.00 -1.05 0.00 0.00 32.46 30.03 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 3.52 0.24 0.51 2.89 0.00 -1.98 -3.36 103.07 104.88 2doe h GLY 792 Ca 0.18 -0.61 0.05 0.00 0.00 0.00 0.00 47.33 46.95 2doe h GLY 792 CO 0.39 0.54 -0.06 0.83 0.00 0.00 0.00 176.54 178.24 2doe h GLU 793 N -0.24 0.00 -0.50 4.80 4.39 -2.00 -1.99 114.58 119.04 2doe h GLU 793 Ca -0.38 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 59.41 2doe h GLU 793 Cb 1.82 -0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 30.37 2doe h GLU 793 CO 0.02 0.00 -0.37 -0.22 -1.16 0.00 0.00 179.01 177.28 2doe h LYS 794 N 0.00 -0.22 -0.32 2.33 1.63 -1.88 0.23 116.57 118.34 2doe h LYS 794 Ca 0.12 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.98 2doe h LYS 794 Cb 0.18 0.05 -0.05 0.00 -0.60 0.00 0.00 32.23 31.81 2doe h LYS 794 CO -0.25 -0.15 0.04 0.82 -3.45 0.00 0.00 179.45 176.46 2doe h ILE 795 N -0.23 0.81 -0.64 2.00 2.04 -1.62 -1.52 117.51 118.36 2doe h ILE 795 Ca 0.19 -0.05 0.06 0.00 1.00 0.00 0.00 64.86 66.06 2doe h ILE 795 Cb 0.56 0.66 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 2doe h ILE 795 CO -0.62 0.03 0.34 0.50 0.00 0.00 0.00 178.15 178.39 2doe h LYS 796 N 0.14 0.62 -0.44 2.37 3.64 -0.42 -0.38 116.57 122.09 2doe h LYS 796 Ca 0.15 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.51 2doe h LYS 796 Cb 0.18 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 2doe h LYS 796 CO -0.22 0.41 0.26 1.03 -2.27 0.00 0.00 179.45 178.66 2doe h SER 797 N 0.64 0.42 -0.18 4.20 0.87 0.03 -1.88 113.55 117.65 2doe h SER 797 Ca 0.29 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.84 2doe h SER 797 Cb 0.19 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 2doe h SER 797 CO -0.19 0.30 0.08 0.44 -0.53 0.00 0.00 176.83 176.94 2doe h ASP 798 N 0.52 0.24 -0.04 6.23 3.32 -0.70 -2.01 116.42 123.99 2doe h ASP 798 Ca 0.18 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 57.13 2doe h ASP 798 Cb 0.01 -0.06 -0.06 0.00 0.22 0.00 0.00 39.33 39.44 2doe h ASP 798 CO -0.08 0.31 -0.35 0.15 -1.72 0.00 0.00 179.24 177.55 2doe h PHE 799 N 0.16 -0.96 -0.23 4.55 3.57 -0.81 -2.26 116.94 120.96 2doe h PHE 799 Ca 0.06 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.65 2doe h PHE 799 Cb 0.14 0.43 -0.05 0.00 2.79 0.00 0.00 35.95 39.25 2doe h PHE 799 CO -0.02 -0.43 -0.11 0.74 -2.23 0.00 0.00 178.31 176.26 2doe h PHE 800 N -0.48 -0.26 -0.70 0.41 0.04 -1.30 -2.21 116.94 112.44 2doe h PHE 800 Ca 0.07 0.03 0.12 0.00 2.80 0.00 0.00 57.97 60.98 2doe h PHE 800 Cb 0.58 0.15 -0.13 0.00 2.20 0.00 0.00 35.95 38.76 2doe h PHE 800 CO -0.38 -0.17 -0.34 0.93 -0.60 0.00 0.00 178.31 177.75 2doe h GLU 801 N -0.08 -0.11 0.42 1.51 4.39 -0.87 0.95 114.58 120.78 2doe h GLU 801 Ca 0.12 0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 2doe h GLU 801 Cb 0.27 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2doe h GLU 801 CO -0.28 -0.07 -0.29 1.25 -1.16 0.00 0.00 179.01 178.45 2doe h LEU 802 N -0.11 -0.76 -0.74 1.33 5.85 -0.95 0.25 115.31 120.18 2doe h LEU 802 Ca 0.27 0.05 0.07 0.00 0.84 0.00 0.00 57.88 59.11 2doe h LEU 802 Cb 0.56 0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.72 2doe h LEU 802 CO -0.76 -0.43 -0.57 -0.07 -0.34 0.00 0.00 178.44 176.27 2doe h LEU 803 N -0.68 -2.00 -0.86 2.25 3.38 -0.85 0.28 115.31 116.83 2doe h LEU 803 Ca -0.06 0.29 0.14 0.00 0.09 0.00 0.00 57.88 58.35 2doe h LEU 803 Cb 0.56 0.86 -0.09 0.00 0.09 0.00 0.00 40.66 42.07 2doe h LEU 803 CO 0.03 -0.30 0.45 0.77 0.09 0.00 0.00 178.44 179.48 2doe h SER 804 N -0.17 0.55 -0.07 -0.43 4.64 -0.79 0.31 113.55 117.60 2doe h SER 804 Ca 0.12 0.09 0.02 0.00 -0.47 0.00 0.00 61.79 61.55 2doe h SER 804 Cb 0.48 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2doe h SER 804 CO -0.78 0.24 0.07 0.78 -0.87 0.00 0.00 176.83 176.27 2doe h ASN 805 N 0.64 0.00 -0.11 4.97 2.35 0.17 -1.97 115.58 121.64 2doe h ASN 805 Ca 0.46 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.15 2doe h ASN 805 Cb 0.65 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.98 2doe h ASN 805 CO -0.36 0.00 0.08 1.41 -1.65 0.00 0.00 177.43 176.92 2doe n HIS 806 N -3.88 0.34 -3.84 1.19 8.25 0.11 -4.82 115.22 112.56 2doe n HIS 806 Ca -0.01 -0.94 -0.26 0.00 -0.26 0.00 0.00 57.72 56.24 2doe n HIS 806 Cb 0.17 -0.47 -0.03 0.00 1.12 0.00 0.00 29.99 30.78 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 0.80 -0.87 -1.07 4.41 8.25 -0.74 -4.76 115.22 121.23 2doe n HIS 807 Ca 0.07 0.22 -0.36 0.00 -0.26 0.00 0.00 57.72 57.38 2doe n HIS 807 Cb 0.57 -1.84 0.05 0.00 1.12 0.00 0.00 29.99 29.89 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 -3.55 -3.13 -4.22 2.41 4.77 -1.25 -5.01 117.00 107.02 2doe n LEU 808 Ca -0.15 0.39 -0.13 0.00 -0.03 0.00 0.00 56.01 56.10 2doe n LEU 808 Cb 0.42 -0.95 -0.10 0.00 -2.33 0.00 0.00 43.42 40.46 2doe n LEU 808 CO 0.53 -4.77 -0.28 -1.81 -1.33 0.00 0.00 177.39 169.74 2doe s ASP 809 N -1.27 0.62 0.01 -1.43 1.01 -1.26 -5.02 116.67 109.33 2doe s ASP 809 Ca 0.52 -1.29 0.15 0.00 0.71 0.00 0.00 52.55 52.63 2doe s ASP 809 Cb -0.29 0.26 0.62 0.00 1.01 0.00 0.00 42.92 44.53 2doe s ASP 809 CO 0.72 -0.73 1.47 -1.54 0.21 0.00 0.00 175.17 175.29 2doe n SER 810 N -0.25 0.03 -0.75 0.27 3.41 -1.26 -2.23 113.62 112.85 2doe n SER 810 Ca -0.02 0.51 0.03 0.00 -0.26 0.00 0.00 58.87 59.13 2doe n SER 810 Cb 0.65 -0.52 0.21 0.00 -0.26 0.00 0.00 64.21 64.29 2doe n SER 810 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2doe n GLN 811 N -1.54 1.65 -2.55 4.33 6.02 -1.26 -4.94 117.38 119.09 2doe n GLN 811 Ca 0.03 -3.27 -0.42 0.00 -0.01 0.00 0.00 57.00 53.33 2doe n GLN 811 Cb 0.17 -1.67 -0.03 0.00 1.02 0.00 0.00 30.24 29.73 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 -3.05 7.16 -0.24 1.08 0.01 -0.94 -5.02 113.70 112.69 2doe s SER 812 Ca 0.40 1.77 -0.09 0.00 1.31 0.00 0.00 55.95 59.33 2doe s SER 812 Cb 0.38 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 64.00 2doe s SER 812 CO -0.05 -0.47 0.11 -0.13 0.41 0.00 0.00 173.24 173.11 2doe s ARG 813 N 1.72 3.88 0.02 12.44 1.81 -1.26 -5.01 118.95 132.55 2doe s ARG 813 Ca 0.54 -0.37 -0.04 0.00 -1.72 0.00 0.00 55.73 54.14 2doe s ARG 813 Cb -0.24 -3.42 -0.01 0.00 -0.45 0.00 0.00 34.95 30.83 2doe s ARG 813 CO 0.24 -0.02 1.07 2.35 -0.68 0.00 0.00 175.30 178.25 2doe h TRP 814 N 7.75 -0.21 -0.74 -0.53 -0.00 -1.98 0.10 115.95 120.34 2doe h TRP 814 Ca -0.37 0.01 0.28 0.00 -0.00 0.00 0.00 58.89 58.81 2doe h TRP 814 Cb 1.18 0.10 -0.13 0.00 -0.00 0.00 0.00 29.16 30.30 2doe h TRP 814 CO 0.67 -0.06 0.29 -1.13 -0.00 0.00 0.00 178.44 178.20 2doe n SER 815 N -3.04 0.16 0.15 2.65 3.41 -1.26 0.19 113.62 115.88 2doe n SER 815 Ca -0.00 1.24 -0.07 0.00 -0.26 0.00 0.00 58.87 59.78 2doe n SER 815 Cb 0.04 -0.56 -0.03 0.00 -0.26 0.00 0.00 64.21 63.40 2doe n SER 815 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2doe h LYS 816 N 0.00 -0.41 -0.84 4.33 1.79 -1.42 -2.38 116.57 117.63 2doe h LYS 816 Ca 0.58 0.03 0.24 0.00 -2.18 0.00 0.00 60.65 59.32 2doe h LYS 816 Cb 1.45 0.09 -0.03 0.00 -1.58 0.00 0.00 32.23 32.15 2doe h LYS 816 CO -0.61 -0.27 0.73 -0.24 -1.08 0.00 0.00 179.45 177.98 2doe h VAL 817 N -0.78 0.35 0.06 0.50 3.04 0.17 0.46 116.25 120.04 2doe h VAL 817 Ca -0.04 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.64 2doe h VAL 817 Cb 0.33 0.45 0.00 0.00 -2.01 0.00 0.00 31.29 30.06 2doe h VAL 817 CO 0.07 0.00 -0.03 0.50 -1.01 0.00 0.00 177.57 177.10 2doe h LYS 818 N 0.00 -0.07 0.00 4.17 3.64 -0.24 -0.62 116.57 123.45 2doe h LYS 818 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.79 2doe h LYS 818 Cb 1.86 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 33.70 2doe h LYS 818 CO -0.00 0.50 0.00 -3.47 -2.27 0.00 0.00 179.45 174.20 2doe n ASP 819 N -4.83 0.66 -0.02 4.20 2.03 0.00 -0.41 116.55 118.18 2doe n ASP 819 Ca -0.08 0.71 -0.21 0.00 0.52 0.00 0.00 54.79 55.72 2doe n ASP 819 Cb 0.30 -0.83 -0.13 0.00 -0.72 0.00 0.00 41.12 39.73 2doe n ASP 819 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2doe n LYS 820 N -2.28 0.72 0.09 -0.67 3.00 -0.31 -4.27 118.16 114.45 2doe n LYS 820 Ca 0.01 0.30 -0.05 0.00 -0.00 0.00 0.00 58.31 58.56 2doe n LYS 820 Cb 0.16 -1.70 -0.02 0.00 0.00 0.00 0.00 35.03 33.47 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 -0.09 1.59 -1.18 3.15 -1.51 -0.79 -3.27 116.25 114.15 2doe h VAL 821 Ca -0.43 -2.95 0.34 0.00 -1.23 0.00 0.00 66.70 62.43 2doe h VAL 821 Cb 1.92 2.60 -0.05 0.00 -2.13 0.00 0.00 31.29 33.64 2doe h VAL 821 CO 0.03 0.84 1.20 -1.84 -1.23 0.00 0.00 177.57 176.56 2doe n GLU 822 N -3.49 0.01 -0.18 5.19 0.28 0.45 0.24 120.64 123.14 2doe n GLU 822 Ca -0.00 0.97 -0.01 0.00 -0.16 0.00 0.00 57.16 57.96 2doe n GLU 822 Cb 0.83 -2.38 0.06 0.00 1.43 0.00 0.00 31.44 31.37 2doe n GLU 822 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2doe n SER 823 N -3.28 2.38 -4.02 -1.84 7.64 -1.23 -4.78 113.62 108.48 2doe n SER 823 Ca 0.27 -2.21 -0.19 0.00 1.01 0.00 0.00 58.87 57.75 2doe n SER 823 Cb 1.55 -0.54 -0.15 0.00 -1.01 0.00 0.00 64.21 64.06 2doe n SER 823 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2doe s ASP 824 N 0.16 1.06 0.29 6.43 -1.08 0.67 -5.04 116.67 119.17 2doe s ASP 824 Ca 0.10 -0.16 0.08 0.00 -0.52 0.00 0.00 52.55 52.04 2doe s ASP 824 Cb 0.08 -0.12 0.44 0.00 -1.46 0.00 0.00 42.92 41.86 2doe s ASP 824 CO 0.02 0.11 1.68 1.55 0.52 0.00 0.00 175.17 179.06 2doe h PRO 825 N 5.92 0.17 -0.75 4.34 0.13 -1.86 -3.07 132.00 136.89 2doe h PRO 825 Ca -0.31 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 64.73 2doe h PRO 825 Cb 1.18 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 2doe h PRO 825 CO 0.50 0.61 0.43 0.00 -0.23 0.00 0.00 178.00 179.30 2doe h ARG 826 N 0.14 1.02 0.00 0.86 3.08 -1.96 -1.32 114.38 116.20 2doe h ARG 826 Ca 0.01 -0.10 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 2doe h ARG 826 Cb 0.88 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.72 2doe h ARG 826 CO 0.07 0.73 -0.06 -0.92 -1.07 0.00 0.00 179.97 178.72 2doe h TYR 827 N 1.03 0.00 0.00 3.04 5.03 -1.83 -1.14 116.97 123.10 2doe h TYR 827 Ca 0.27 0.00 -0.12 0.00 2.58 0.00 0.00 58.73 61.46 2doe h TYR 827 Cb -0.01 0.00 -0.02 0.00 1.55 0.00 0.00 36.73 38.25 2doe h TYR 827 CO 0.01 0.06 -0.56 0.87 -1.32 0.00 0.00 178.16 177.22 2doe h LYS 828 N 0.00 0.00 -0.36 1.82 1.57 -1.34 -3.30 116.57 114.96 2doe h LYS 828 Ca -0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.85 2doe h LYS 828 Cb 0.17 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.39 2doe h LYS 828 CO 0.01 0.56 -0.31 0.00 -0.57 0.00 0.00 179.45 179.14 2doe h ALA 829 N 1.44 -0.17 -1.76 3.86 0.00 -1.10 -3.36 119.26 118.16 2doe h ALA 829 Ca -0.01 0.10 -0.56 0.00 0.00 0.00 0.00 54.91 54.44 2doe h ALA 829 Cb 1.26 0.66 -0.04 0.00 0.00 0.00 0.00 17.79 19.67 2doe h ALA 829 CO 0.07 -0.71 1.22 0.08 0.00 0.00 0.00 179.25 179.91 2doe s VAL 830 N -6.02 3.60 -0.03 0.00 1.01 -1.25 -4.86 120.40 112.85 2doe s VAL 830 Ca -0.15 0.57 -0.19 0.00 0.00 0.00 0.00 61.98 62.21 2doe s VAL 830 Cb 0.13 -3.91 -0.32 0.00 0.00 0.00 0.00 36.38 32.28 2doe s VAL 830 CO 0.68 -0.65 0.88 0.44 0.00 0.00 0.00 175.10 176.44 2doe h ASP 831 N 12.46 0.57 -2.78 3.32 5.19 -1.89 -3.44 116.42 129.85 2doe h ASP 831 Ca -0.30 -0.93 -0.56 0.00 -0.62 0.00 0.00 57.03 54.62 2doe h ASP 831 Cb 1.14 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 40.44 2doe h ASP 831 CO 1.09 1.52 1.01 -0.44 -3.12 0.00 0.00 179.24 179.30 2doe s SER 832 N -7.16 6.73 0.09 6.45 0.01 -1.26 -4.91 113.70 113.64 2doe s SER 832 Ca -0.13 1.87 -0.22 0.00 1.31 0.00 0.00 55.95 58.77 2doe s SER 832 Cb 0.02 -2.54 -0.14 0.00 0.21 0.00 0.00 66.02 63.58 2doe s SER 832 CO 0.86 -0.92 1.70 -1.28 0.41 0.00 0.00 173.24 174.00 2doe h SER 833 N 9.18 0.06 -0.97 2.44 0.87 -2.01 -2.67 113.55 120.45 2doe h SER 833 Ca -0.33 -0.05 0.30 0.00 -1.23 0.00 0.00 61.79 60.49 2doe h SER 833 Cb 1.14 -0.01 -0.15 0.00 -0.44 0.00 0.00 62.40 62.93 2doe h SER 833 CO 0.97 0.10 0.43 0.28 -0.53 0.00 0.00 176.83 178.08 2doe h SER 834 N 0.02 0.28 -0.12 6.23 0.02 -1.99 0.32 113.55 118.31 2doe h SER 834 Ca 0.02 0.21 0.01 0.00 -0.84 0.00 0.00 61.79 61.18 2doe h SER 834 Cb 0.05 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 2doe h SER 834 CO -0.00 -0.19 0.05 0.24 -1.14 0.00 0.00 176.83 175.78 2doe h MET 835 N 0.23 0.10 0.63 3.45 2.07 -1.88 0.25 114.93 119.78 2doe h MET 835 Ca 0.69 -0.01 -0.03 0.00 -2.07 0.00 0.00 59.70 58.28 2doe h MET 835 Cb 1.55 -0.02 0.01 0.00 -1.87 0.00 0.00 31.60 31.26 2doe h MET 835 CO -0.66 0.07 -0.30 0.00 1.07 0.00 0.00 176.91 177.09 2doe h ARG 836 N 0.11 -0.81 0.14 1.72 3.08 -0.39 0.30 114.38 118.53 2doe h ARG 836 Ca 0.05 0.06 0.01 0.00 0.07 0.00 0.00 59.98 60.17 2doe h ARG 836 Cb 0.02 0.18 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2doe h ARG 836 CO -0.05 -0.53 -0.26 0.93 -1.07 0.00 0.00 179.97 179.00 2doe h GLU 837 N -0.87 -0.46 0.35 0.04 5.08 -1.12 0.10 114.58 117.71 2doe h GLU 837 Ca -0.09 0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2doe h GLU 837 Cb 0.65 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 2doe h GLU 837 CO 0.14 -0.31 -0.22 0.22 -1.00 0.00 0.00 179.01 177.85 2doe h ASP 838 N -0.48 -0.55 -0.69 1.42 1.82 -0.48 0.73 116.42 118.19 2doe h ASP 838 Ca 0.02 0.03 0.11 0.00 -0.39 0.00 0.00 57.03 56.81 2doe h ASP 838 Cb 0.49 0.16 -0.12 0.00 0.68 0.00 0.00 39.33 40.54 2doe h ASP 838 CO -0.13 -0.33 -0.38 -0.07 -1.61 0.00 0.00 179.24 176.71 2doe h LEU 839 N -0.54 -1.33 0.33 2.28 3.38 -0.40 0.22 115.31 119.25 2doe h LEU 839 Ca -0.05 0.25 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2doe h LEU 839 Cb 0.43 0.65 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2doe h LEU 839 CO 0.05 -0.31 -0.39 0.15 0.09 0.00 0.00 178.44 178.03 2doe h PHE 840 N -0.14 -1.10 -0.86 1.13 3.57 -0.73 -1.96 116.94 116.85 2doe h PHE 840 Ca 0.24 0.01 0.22 0.00 3.53 0.00 0.00 57.97 61.98 2doe h PHE 840 Cb 0.56 0.44 -0.13 0.00 2.79 0.00 0.00 35.95 39.61 2doe h PHE 840 CO -0.72 -0.51 0.28 0.87 -2.23 0.00 0.00 178.31 176.00 2doe h LYS 841 N -0.74 0.26 -0.04 1.11 1.57 -0.10 -0.21 116.57 118.42 2doe h LYS 841 Ca -0.04 -0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2doe h LYS 841 Cb 0.65 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.86 2doe h LYS 841 CO -0.08 0.17 -0.23 1.96 -0.57 0.00 0.00 179.45 180.70 2doe h GLN 842 N 0.27 -0.33 -0.16 3.15 4.20 -0.08 0.16 115.11 122.33 2doe h GLN 842 Ca 0.54 0.02 0.05 0.00 0.06 0.00 0.00 58.65 59.32 2doe h GLN 842 Cb 1.05 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 28.85 2doe h GLN 842 CO -0.60 -0.22 -0.24 -0.92 -0.67 0.00 0.00 178.83 176.18 2doe h TYR 843 N -0.34 -0.64 -0.35 2.96 5.03 -0.31 -1.96 116.97 121.36 2doe h TYR 843 Ca 0.07 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.45 2doe h TYR 843 Cb 0.44 0.31 -0.03 0.00 1.55 0.00 0.00 36.73 39.00 2doe h TYR 843 CO -0.29 -0.32 0.14 0.82 -1.32 0.00 0.00 178.16 177.19 2doe h ILE 844 N -0.29 0.93 -0.98 1.81 1.08 -1.07 -1.95 117.51 117.04 2doe h ILE 844 Ca 0.11 -0.10 0.21 0.00 -0.39 0.00 0.00 64.86 64.69 2doe h ILE 844 Cb 0.45 0.60 -0.12 0.00 -3.07 0.00 0.00 36.82 34.69 2doe h ILE 844 CO -0.32 0.06 0.57 -0.33 -0.69 0.00 0.00 178.15 177.43 2doe h GLU 845 N 0.30 0.63 0.22 2.37 4.39 -0.05 -1.39 114.58 121.05 2doe h GLU 845 Ca 0.15 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 2doe h GLU 845 Cb 0.11 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2doe h GLU 845 CO -0.14 0.41 -0.11 -0.22 -1.16 0.00 0.00 179.01 177.80 2doe h LYS 846 N 0.65 -0.28 -0.16 2.33 3.64 -0.65 -3.00 116.57 119.09 2doe h LYS 846 Ca 0.60 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 60.02 2doe h LYS 846 Cb 1.04 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.88 2doe h LYS 846 CO -0.43 0.02 -0.32 0.82 -2.27 0.00 0.00 179.45 177.27 2doe h ILE 847 N -0.61 0.00 -0.94 2.00 2.04 -0.78 -1.11 117.51 118.11 2doe h ILE 847 Ca -0.03 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.08 2doe h ILE 847 Cb 0.44 0.00 -0.17 0.00 -0.74 0.00 0.00 36.82 36.35 2doe h ILE 847 CO 0.05 0.00 0.06 0.00 0.00 0.00 0.00 178.15 178.26 2doe h ALA 848 N -0.67 1.15 -0.88 1.87 0.00 -1.46 0.24 119.26 119.51 2doe h ALA 848 Ca 0.03 0.31 0.18 0.00 0.00 0.00 0.00 54.91 55.43 2doe h ALA 848 Cb 0.37 0.53 -0.17 0.00 0.00 0.00 0.00 17.79 18.53 2doe h ALA 848 CO -0.30 -0.54 -0.21 -0.22 0.00 0.00 0.00 179.25 177.97 2doe h LYS 849 N 0.05 0.00 -3.85 0.00 1.63 -1.04 -3.15 116.57 110.20 2doe h LYS 849 Ca 0.57 -0.00 -0.74 0.00 -0.85 0.00 0.00 60.65 59.63 2doe h LYS 849 Cb 1.16 -0.00 -0.31 0.00 -0.60 0.00 0.00 32.23 32.49 2doe h LYS 849 CO -0.85 0.00 -0.21 1.21 -3.45 0.00 0.00 179.45 176.15 2doe s ASN 850 N -5.24 5.89 -0.30 4.20 3.84 0.83 -4.95 114.94 119.20 2doe s ASN 850 Ca -0.15 -2.55 -0.06 0.00 0.21 0.00 0.00 52.86 50.31 2doe s ASN 850 Cb 0.24 -2.02 -0.18 0.00 -0.55 0.00 0.00 41.25 38.74 2doe s ASN 850 CO 0.77 -0.53 3.37 -0.11 -2.79 0.00 0.00 177.10 177.81 2doe n LEU 851 N 4.02 5.93 -4.57 3.21 7.94 -1.19 -4.90 117.00 127.44 2doe n LEU 851 Ca 0.06 -3.52 -0.40 0.00 -1.11 0.00 0.00 56.01 51.04 2doe n LEU 851 Cb 0.42 -1.40 -0.03 0.00 0.53 0.00 0.00 43.42 42.94 2doe n LEU 851 CO 0.36 1.76 1.62 1.51 -1.11 0.00 0.00 177.39 181.53 2doe s ASP 852 N 1.69 5.48 0.52 1.96 -4.77 -1.26 -4.97 116.67 115.31 2doe s ASP 852 Ca 0.66 0.88 -0.06 0.00 -3.30 0.00 0.00 52.55 50.73 2doe s ASP 852 Cb 0.31 -2.52 -0.03 0.00 -1.09 0.00 0.00 42.92 39.59 2doe s ASP 852 CO -0.05 -2.11 0.84 -0.94 0.70 0.00 0.00 175.17 173.61 2doe s SER 853 N 7.58 6.14 -0.01 2.11 1.04 -1.26 -5.03 113.70 124.27 2doe s SER 853 Ca 0.77 0.96 -0.21 0.00 0.48 0.00 0.00 55.95 57.94 2doe s SER 853 Cb -0.18 -2.19 -0.12 0.00 0.10 0.00 0.00 66.02 63.63 2doe s SER 853 CO 0.27 -0.70 0.89 -1.28 0.98 0.00 0.00 173.24 173.40 2doe h SER 854 N 0.08 -0.55 0.00 7.02 0.87 -2.01 -3.50 113.55 115.46 2doe h SER 854 Ca -0.46 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 2doe h SER 854 Cb 1.21 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.31 2doe h SER 854 CO 0.62 -0.14 0.00 0.61 -0.53 0.00 0.00 176.83 177.39 2doe n GLY 855 N -0.05 -1.73 3.56 5.77 0.00 -1.26 -5.07 105.19 106.41 2doe n GLY 855 Ca -0.09 0.72 -0.28 0.00 0.00 0.00 0.00 46.02 46.37 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 0.00 2.56 0.17 1.61 0.04 -1.26 -4.85 135.00 133.27 2doe s PRO 856 Ca 0.00 -0.21 -0.24 0.00 0.04 0.00 0.00 61.00 60.59 2doe s PRO 856 Cb 0.00 -5.00 0.07 0.00 0.04 0.00 0.00 34.50 29.61 2doe s PRO 856 CO 0.00 -3.32 0.99 -1.54 0.04 0.00 0.00 177.00 173.18 2doe s SER 857 N 8.04 -0.10 -0.21 6.66 1.04 -1.26 -5.08 113.70 122.78 2doe s SER 857 Ca 0.70 -0.51 -0.07 0.00 0.48 0.00 0.00 55.95 56.54 2doe s SER 857 Cb -0.07 0.49 -0.10 0.00 0.10 0.00 0.00 66.02 66.44 2doe s SER 857 CO 0.01 -0.94 -0.25 -1.20 0.98 0.00 0.00 173.24 171.84 2doe n SER 858 N -0.75 1.78 0.00 7.02 7.64 -1.26 -5.14 113.62 122.91 2doe n SER 858 Ca -0.05 0.16 0.00 0.00 1.01 0.00 0.00 58.87 59.99 2doe n SER 858 Cb 0.60 -0.55 0.03 0.00 -1.01 0.00 0.00 64.21 63.28 2doe n SER 858 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64