#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 -2.79 -4.89 1.61 2.88 -1.26 -4.93 113.62 104.24 2doe n SER 778 Ca 0.00 0.70 -0.34 0.00 -1.33 0.00 0.00 58.87 57.89 2doe n SER 778 Cb 0.00 -0.79 -0.05 0.00 -0.75 0.00 0.00 64.21 62.62 2doe n SER 778 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2doe s SER 779 N -0.90 6.42 0.00 -3.46 0.01 -1.26 -5.01 113.70 109.50 2doe s SER 779 Ca 0.53 0.45 0.00 0.00 1.31 0.00 0.00 55.95 58.24 2doe s SER 779 Cb -0.54 -2.05 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2doe s SER 779 CO 0.58 0.28 0.00 0.61 0.41 0.00 0.00 173.24 175.12 2doe n GLY 780 N 1.16 0.93 2.98 3.44 0.00 -1.26 -5.06 105.19 107.39 2doe n GLY 780 Ca -0.12 -2.30 -0.27 0.00 0.00 0.00 0.00 46.02 43.33 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 2.19 0.07 1.61 0.15 -1.26 -5.05 113.70 111.41 2doe s SER 781 Ca 0.00 -0.35 -0.37 0.00 0.70 0.00 0.00 55.95 55.93 2doe s SER 781 Cb 0.00 -0.93 -0.20 0.00 -1.71 0.00 0.00 66.02 63.18 2doe s SER 781 CO 0.00 -0.04 1.58 -1.28 1.20 0.00 0.00 173.24 174.69 2doe h SER 782 N 7.68 -1.15 0.00 5.45 0.87 -2.01 -3.44 113.55 120.95 2doe h SER 782 Ca -0.32 0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.20 2doe h SER 782 Cb 1.16 0.31 -0.10 0.00 -0.44 0.00 0.00 62.40 63.33 2doe h SER 782 CO 0.46 -0.77 0.13 0.61 -0.53 0.00 0.00 176.83 176.73 2doe n GLY 783 N -1.64 -1.40 3.70 5.77 0.00 -1.26 -5.01 105.19 105.36 2doe n GLY 783 Ca -0.16 0.66 -0.63 0.00 0.00 0.00 0.00 46.02 45.89 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 0.22 0.38 -0.05 1.61 -0.58 -1.26 -4.85 120.64 116.12 2doe n GLU 784 Ca -0.12 0.14 -0.13 0.00 -0.42 0.00 0.00 57.16 56.63 2doe n GLU 784 Cb 0.73 -1.70 -0.07 0.00 -0.57 0.00 0.00 31.44 29.83 2doe n GLU 784 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2doe h LYS 785 N 5.33 0.30 -0.91 3.49 1.79 -2.00 -3.24 116.57 121.33 2doe h LYS 785 Ca -0.46 -0.15 0.17 0.00 -2.18 0.00 0.00 60.65 58.03 2doe h LYS 785 Cb 1.36 0.00 -0.17 0.00 -1.58 0.00 0.00 32.23 31.85 2doe h LYS 785 CO 0.92 0.69 -0.26 1.49 -1.08 0.00 0.00 179.45 181.21 2doe h GLU 786 N -0.09 -0.01 -5.48 3.15 4.57 -2.08 -3.37 114.58 111.27 2doe h GLU 786 Ca 0.02 0.00 -0.64 0.00 -1.18 0.00 0.00 59.36 57.56 2doe h GLU 786 Cb 0.63 0.00 -0.18 0.00 -0.16 0.00 0.00 28.75 29.04 2doe h GLU 786 CO 0.03 -0.01 -0.62 -0.51 -1.18 0.00 0.00 179.01 176.72 2doe s ASP 787 N -5.27 5.20 -0.23 1.04 1.11 -1.22 -5.01 116.67 112.29 2doe s ASP 787 Ca -0.15 0.02 -0.16 0.00 0.18 0.00 0.00 52.55 52.45 2doe s ASP 787 Cb 0.24 -1.76 -0.10 0.00 1.07 0.00 0.00 42.92 42.37 2doe s ASP 787 CO 0.76 0.23 -0.31 -0.24 1.18 0.00 0.00 175.17 176.79 2doe n SER 788 N 3.13 1.94 -0.28 0.27 2.88 -1.26 -4.22 113.62 116.08 2doe n SER 788 Ca -0.17 0.36 0.09 0.00 -1.33 0.00 0.00 58.87 57.81 2doe n SER 788 Cb 0.53 -0.81 0.18 0.00 -0.75 0.00 0.00 64.21 63.36 2doe n SER 788 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2doe n LYS 789 N -4.35 -0.07 0.38 -1.46 3.00 -1.26 0.20 118.16 114.59 2doe n LYS 789 Ca -0.37 1.20 -0.18 0.00 -0.00 0.00 0.00 58.31 58.96 2doe n LYS 789 Cb 0.72 -1.86 -0.09 0.00 0.00 0.00 0.00 35.03 33.80 2doe n LYS 789 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2doe h THR 790 N 0.00 0.24 -0.25 3.15 2.02 -1.95 -2.37 112.91 113.75 2doe h THR 790 Ca 0.43 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.69 2doe h THR 790 Cb 0.80 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.44 2doe h THR 790 CO -0.77 0.00 0.20 -0.09 0.37 0.00 0.00 175.52 175.22 2doe h ARG 791 N -0.98 0.00 -1.51 6.66 2.43 -0.42 -2.26 114.38 118.30 2doe h ARG 791 Ca -0.09 0.00 0.46 0.00 -0.81 0.00 0.00 59.98 59.54 2doe h ARG 791 Cb 0.77 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.23 2doe h ARG 791 CO 0.12 0.00 1.04 0.78 -1.51 0.00 0.00 179.97 180.40 2doe h GLY 792 N 0.00 0.61 -0.25 2.80 0.00 0.10 0.16 103.07 106.49 2doe h GLY 792 Ca 0.12 -0.06 0.15 0.00 0.00 0.00 0.00 47.33 47.54 2doe h GLY 792 CO -0.00 -0.18 -0.03 1.05 0.00 0.00 0.00 176.54 177.38 2doe h GLU 793 N 0.06 0.09 0.64 4.80 4.11 -1.53 0.13 114.58 122.87 2doe h GLU 793 Ca 0.81 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 60.20 2doe h GLU 793 Cb 2.89 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 32.13 2doe h GLU 793 CO -0.20 0.06 -0.31 -0.22 0.07 0.00 0.00 179.01 178.41 2doe h LYS 794 N 0.09 -0.82 -1.32 1.06 3.64 -0.93 -1.77 116.57 116.52 2doe h LYS 794 Ca 0.36 0.06 0.39 0.00 -1.27 0.00 0.00 60.65 60.19 2doe h LYS 794 Cb 0.61 0.19 -0.09 0.00 -0.41 0.00 0.00 32.23 32.52 2doe h LYS 794 CO -0.62 -0.55 0.90 0.82 -2.27 0.00 0.00 179.45 177.73 2doe h ILE 795 N -1.18 0.27 0.12 2.00 2.04 -1.46 0.12 117.51 119.42 2doe h ILE 795 Ca -0.09 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.72 2doe h ILE 795 Cb 0.66 0.14 0.00 0.00 -0.74 0.00 0.00 36.82 36.87 2doe h ILE 795 CO 0.14 0.02 -0.06 0.50 0.00 0.00 0.00 178.15 178.76 2doe h LYS 796 N 0.12 -0.15 -0.72 2.37 3.64 -0.65 -2.34 116.57 118.83 2doe h LYS 796 Ca 0.72 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 60.22 2doe h LYS 796 Cb 2.43 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 34.21 2doe h LYS 796 CO -0.22 0.34 0.33 1.03 -2.27 0.00 0.00 179.45 178.65 2doe h SER 797 N -0.82 0.38 0.32 4.20 0.87 0.08 -1.95 113.55 116.62 2doe h SER 797 Ca -0.02 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 2doe h SER 797 Cb 0.56 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2doe h SER 797 CO 0.03 0.19 -0.15 0.44 -0.53 0.00 0.00 176.83 176.80 2doe h ASP 798 N 0.53 -0.36 -0.67 6.23 3.32 -1.12 -2.36 116.42 121.98 2doe h ASP 798 Ca 0.37 -0.07 0.13 0.00 0.02 0.00 0.00 57.03 57.49 2doe h ASP 798 Cb 0.48 0.09 -0.13 0.00 0.22 0.00 0.00 39.33 39.99 2doe h ASP 798 CO -0.32 -0.15 -0.18 0.15 -1.72 0.00 0.00 179.24 177.02 2doe h PHE 799 N -0.56 -0.39 0.65 4.55 3.57 -0.89 -1.83 116.94 122.04 2doe h PHE 799 Ca -0.04 0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 2doe h PHE 799 Cb 0.41 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 2doe h PHE 799 CO -0.02 -0.30 -0.47 0.74 -2.23 0.00 0.00 178.31 176.03 2doe h PHE 800 N -0.01 -1.27 -0.90 0.41 0.04 -1.28 -2.40 116.94 111.52 2doe h PHE 800 Ca 0.32 -0.00 0.17 0.00 2.80 0.00 0.00 57.97 61.25 2doe h PHE 800 Cb 0.50 0.47 -0.16 0.00 2.20 0.00 0.00 35.95 38.96 2doe h PHE 800 CO -0.55 -0.68 -0.27 0.39 -0.60 0.00 0.00 178.31 176.60 2doe n GLU 801 N -5.58 -0.13 0.29 1.51 -0.58 -0.74 -0.90 120.64 114.51 2doe n GLU 801 Ca -0.13 1.40 -0.14 0.00 -0.42 0.00 0.00 57.16 57.87 2doe n GLU 801 Cb 0.47 -2.09 -0.07 0.00 -0.57 0.00 0.00 31.44 29.18 2doe n GLU 801 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 2doe h LEU 802 N 0.00 -0.96 -0.51 -4.62 5.85 -1.18 -0.66 115.31 113.24 2doe h LEU 802 Ca 0.39 0.06 0.05 0.00 0.84 0.00 0.00 57.88 59.22 2doe h LEU 802 Cb 0.62 0.29 -0.08 0.00 0.37 0.00 0.00 40.66 41.86 2doe h LEU 802 CO -0.92 -0.54 -0.44 -0.07 -0.34 0.00 0.00 178.44 176.13 2doe h LEU 803 N -0.85 -1.55 -0.99 2.25 3.38 -0.51 0.28 115.31 117.32 2doe h LEU 803 Ca -0.07 0.22 0.22 0.00 0.09 0.00 0.00 57.88 58.34 2doe h LEU 803 Cb 0.69 0.66 -0.12 0.00 0.09 0.00 0.00 40.66 41.98 2doe h LEU 803 CO 0.04 -0.25 0.58 0.77 0.09 0.00 0.00 178.44 179.66 2doe h SER 804 N -0.18 0.69 0.29 -0.43 4.64 -1.09 0.73 113.55 118.20 2doe h SER 804 Ca 0.08 0.12 -0.02 0.00 -0.47 0.00 0.00 61.79 61.51 2doe h SER 804 Cb 0.40 0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2doe h SER 804 CO -0.58 0.17 -0.09 0.78 -0.87 0.00 0.00 176.83 176.25 2doe h ASN 805 N 0.64 0.00 -0.12 4.97 2.35 0.11 -2.68 115.58 120.85 2doe h ASN 805 Ca 0.61 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 56.28 2doe h ASN 805 Cb 1.06 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.40 2doe h ASN 805 CO -0.44 0.09 0.09 1.41 -1.65 0.00 0.00 177.43 176.93 2doe n HIS 806 N -3.65 0.37 -3.83 1.19 8.25 0.25 -4.82 115.22 112.99 2doe n HIS 806 Ca -0.02 -1.04 -0.26 0.00 -0.26 0.00 0.00 57.72 56.15 2doe n HIS 806 Cb 0.20 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 30.77 2doe n HIS 806 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2doe n HIS 807 N 0.90 -0.85 -0.84 4.41 -0.00 -1.01 -4.80 115.22 113.03 2doe n HIS 807 Ca 0.07 0.21 -0.35 0.00 0.46 0.00 0.00 57.72 58.11 2doe n HIS 807 Cb 0.56 -1.80 0.10 0.00 -0.12 0.00 0.00 29.99 28.73 2doe n HIS 807 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2doe n LEU 808 N -3.49 -2.73 -3.93 0.27 4.77 -1.25 -5.03 117.00 105.61 2doe n LEU 808 Ca -0.14 -0.03 -0.11 0.00 -0.03 0.00 0.00 56.01 55.70 2doe n LEU 808 Cb 0.41 -0.77 -0.01 0.00 -2.33 0.00 0.00 43.42 40.72 2doe n LEU 808 CO 0.52 -3.06 0.35 -1.81 -1.33 0.00 0.00 177.39 172.05 2doe s ASP 809 N -1.45 0.31 -0.01 -1.43 1.11 -1.26 -5.04 116.67 108.91 2doe s ASP 809 Ca 0.47 -1.21 -0.25 0.00 0.18 0.00 0.00 52.55 51.74 2doe s ASP 809 Cb -0.03 0.75 -0.19 0.00 1.07 0.00 0.00 42.92 44.52 2doe s ASP 809 CO 0.67 -1.46 1.29 0.77 1.18 0.00 0.00 175.17 177.62 2doe h SER 810 N 2.07 -0.06 -0.22 0.27 4.64 -1.96 -3.01 113.55 115.27 2doe h SER 810 Ca -0.29 -0.38 -0.12 0.00 -0.47 0.00 0.00 61.79 60.54 2doe h SER 810 Cb 1.25 0.02 -0.07 0.00 -0.31 0.00 0.00 62.40 63.28 2doe h SER 810 CO 0.38 0.35 0.15 0.00 -0.87 0.00 0.00 176.83 176.84 2doe n GLN 811 N -4.93 1.28 -2.44 4.77 10.64 -1.26 -4.89 117.38 120.55 2doe n GLN 811 Ca -0.08 -0.68 -0.43 0.00 -1.83 0.00 0.00 57.00 53.98 2doe n GLN 811 Cb 0.23 -1.27 -0.02 0.00 -0.86 0.00 0.00 30.24 28.32 2doe n GLN 811 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2doe s SER 812 N 0.49 6.97 0.07 2.61 0.15 -1.14 -5.02 113.70 117.83 2doe s SER 812 Ca 0.13 1.70 -0.04 0.00 0.70 0.00 0.00 55.95 58.44 2doe s SER 812 Cb 0.11 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.83 2doe s SER 812 CO 0.02 -0.72 0.29 -0.60 1.20 0.00 0.00 173.24 173.43 2doe s ARG 813 N 3.22 3.55 0.00 5.44 6.06 -1.26 -4.99 118.95 130.97 2doe s ARG 813 Ca 0.54 -0.20 -0.03 0.00 -2.50 0.00 0.00 55.73 53.54 2doe s ARG 813 Cb -0.22 -2.99 -0.02 0.00 0.06 0.00 0.00 34.95 31.79 2doe s ARG 813 CO 0.16 0.57 0.95 2.35 -2.50 0.00 0.00 175.30 176.83 2doe h TRP 814 N 3.29 -0.11 -1.20 5.12 -0.00 -1.99 -0.94 115.95 120.13 2doe h TRP 814 Ca -0.47 -0.00 0.41 0.00 -0.00 0.00 0.00 58.89 58.82 2doe h TRP 814 Cb 1.17 0.04 -0.11 0.00 -0.00 0.00 0.00 29.16 30.26 2doe h TRP 814 CO 0.64 -0.07 0.79 0.43 -0.00 0.00 0.00 178.44 180.22 2doe n SER 815 N -2.36 0.15 0.10 2.65 7.64 -1.26 0.42 113.62 120.97 2doe n SER 815 Ca -0.02 1.11 -0.08 0.00 1.01 0.00 0.00 58.87 60.89 2doe n SER 815 Cb 0.05 -0.55 -0.05 0.00 -1.01 0.00 0.00 64.21 62.65 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 -0.33 -0.80 1.43 1.79 -1.93 -0.94 116.57 115.78 2doe h LYS 816 Ca 0.73 0.02 0.12 0.00 -2.18 0.00 0.00 60.65 59.35 2doe h LYS 816 Cb 2.44 0.08 -0.08 0.00 -1.58 0.00 0.00 32.23 33.09 2doe h LYS 816 CO -0.34 -0.08 0.41 -0.24 -1.08 0.00 0.00 179.45 178.12 2doe h VAL 817 N -1.03 0.80 -0.07 0.50 3.04 0.14 0.04 116.25 119.67 2doe h VAL 817 Ca -0.04 -0.22 -0.13 0.00 -1.01 0.00 0.00 66.70 65.30 2doe h VAL 817 Cb 0.41 0.10 -0.01 0.00 -2.01 0.00 0.00 31.29 29.77 2doe h VAL 817 CO 0.06 0.12 -0.54 0.07 -1.01 0.00 0.00 177.57 176.27 2doe h LYS 818 N 0.65 0.21 0.00 4.17 2.10 -0.73 -0.03 116.57 122.94 2doe h LYS 818 Ca 0.41 -0.13 -0.03 0.00 -2.00 0.00 0.00 60.65 58.90 2doe h LYS 818 Cb 0.50 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.83 2doe h LYS 818 CO -0.31 0.70 -0.17 -0.44 -2.00 0.00 0.00 179.45 177.23 2doe h ASP 819 N 0.17 0.00 0.18 7.07 3.32 0.39 0.49 116.42 128.04 2doe h ASP 819 Ca 0.00 0.00 -0.35 0.00 0.02 0.00 0.00 57.03 56.70 2doe h ASP 819 Cb 1.01 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.51 2doe h ASP 819 CO 0.08 0.17 -2.08 0.29 -1.72 0.00 0.00 179.24 175.98 2doe n LYS 820 N -3.33 0.69 0.10 3.56 5.02 -0.25 -4.26 118.16 119.69 2doe n LYS 820 Ca 0.00 0.21 -0.04 0.00 -2.02 0.00 0.00 58.31 56.46 2doe n LYS 820 Cb 0.40 -1.67 0.01 0.00 -0.02 0.00 0.00 35.03 33.75 2doe n LYS 820 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 2doe h VAL 821 N 0.03 1.54 -1.58 -0.18 -1.51 -0.96 -3.28 116.25 110.31 2doe h VAL 821 Ca -0.44 -2.83 0.46 0.00 -1.23 0.00 0.00 66.70 62.66 2doe h VAL 821 Cb 2.03 2.55 -0.07 0.00 -2.13 0.00 0.00 31.29 33.68 2doe h VAL 821 CO 0.04 0.80 1.13 -1.84 -1.23 0.00 0.00 177.57 176.47 2doe n GLU 822 N -3.50 -0.00 -0.23 5.19 0.28 0.16 0.24 120.64 122.78 2doe n GLU 822 Ca -0.00 0.87 -0.04 0.00 -0.16 0.00 0.00 57.16 57.83 2doe n GLU 822 Cb 0.80 -2.01 0.03 0.00 1.43 0.00 0.00 31.44 31.69 2doe n GLU 822 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2doe n SER 823 N -3.56 3.12 -3.95 -1.84 3.41 -1.24 -4.79 113.62 104.78 2doe n SER 823 Ca 0.36 -2.30 -0.15 0.00 -0.26 0.00 0.00 58.87 56.52 2doe n SER 823 Cb 1.62 -0.56 -0.14 0.00 -0.26 0.00 0.00 64.21 64.86 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 0.56 0.52 0.38 4.04 -1.08 0.68 -5.04 116.67 116.72 2doe s ASP 824 Ca 0.11 -0.08 0.17 0.00 -0.52 0.00 0.00 52.55 52.22 2doe s ASP 824 Cb 0.09 -0.06 0.74 0.00 -1.46 0.00 0.00 42.92 42.23 2doe s ASP 824 CO 0.02 0.05 1.79 1.55 0.52 0.00 0.00 175.17 179.10 2doe h PRO 825 N 6.03 0.00 0.00 4.34 0.13 -1.86 -2.90 132.00 137.74 2doe h PRO 825 Ca -0.27 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.81 2doe h PRO 825 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 2doe h PRO 825 CO 0.50 0.38 -0.21 0.00 -0.23 0.00 0.00 178.00 178.44 2doe h ARG 826 N 0.00 0.00 0.00 0.86 3.08 -1.96 -1.66 114.38 114.70 2doe h ARG 826 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2doe h ARG 826 Cb 0.78 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.83 2doe h ARG 826 CO 0.05 0.21 -0.08 -0.92 -1.07 0.00 0.00 179.97 178.16 2doe h TYR 827 N 0.00 0.00 0.00 3.04 5.03 -1.81 -2.06 116.97 121.17 2doe h TYR 827 Ca -0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2doe h TYR 827 Cb 0.38 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.66 2doe h TYR 827 CO 0.00 0.08 -0.22 1.63 -1.32 0.00 0.00 178.16 178.33 2doe n LYS 828 N -3.24 0.02 -0.19 1.82 5.02 -0.63 -3.79 118.16 117.17 2doe n LYS 828 Ca -0.00 0.01 -0.09 0.00 -2.02 0.00 0.00 58.31 56.21 2doe n LYS 828 Cb 0.32 -1.52 0.01 0.00 -0.02 0.00 0.00 35.03 33.82 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 2.97 0.73 -2.22 7.82 0.00 -1.36 -3.41 119.26 123.78 2doe h ALA 829 Ca 0.00 -0.26 -0.59 0.00 0.00 0.00 0.00 54.91 54.07 2doe h ALA 829 Cb 0.52 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 2doe h ALA 829 CO 0.00 0.49 0.58 0.08 0.00 0.00 0.00 179.25 180.40 2doe s VAL 830 N -5.16 4.78 -0.21 0.00 1.01 -1.25 -4.92 120.40 114.66 2doe s VAL 830 Ca -0.12 1.75 -0.10 0.00 0.00 0.00 0.00 61.98 63.50 2doe s VAL 830 Cb 0.12 -4.19 -0.19 0.00 0.00 0.00 0.00 36.38 32.12 2doe s VAL 830 CO 0.82 -0.10 0.04 -0.67 0.00 0.00 0.00 175.10 175.20 2doe n ASP 831 N 5.99 1.99 -4.64 3.32 -0.08 -1.26 -4.87 116.55 117.00 2doe n ASP 831 Ca 0.08 0.22 -0.43 0.00 -1.51 0.00 0.00 54.79 53.15 2doe n ASP 831 Cb 0.47 -0.79 -0.02 0.00 2.34 0.00 0.00 41.12 43.12 2doe n ASP 831 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2doe s SER 832 N -6.98 6.49 0.12 1.67 0.15 -1.26 -4.90 113.70 108.99 2doe s SER 832 Ca -0.30 1.67 -0.20 0.00 0.70 0.00 0.00 55.95 57.81 2doe s SER 832 Cb 0.09 -2.53 -0.05 0.00 -1.71 0.00 0.00 66.02 61.81 2doe s SER 832 CO 0.63 -1.15 1.72 0.77 1.20 0.00 0.00 173.24 176.40 2doe h SER 833 N 10.22 -0.11 -0.97 5.45 4.64 -2.00 -2.09 113.55 128.68 2doe h SER 833 Ca -0.33 0.04 0.30 0.00 -0.47 0.00 0.00 61.79 61.33 2doe h SER 833 Cb 1.15 0.09 -0.15 0.00 -0.31 0.00 0.00 62.40 63.17 2doe h SER 833 CO 1.00 -0.03 0.47 0.28 -0.87 0.00 0.00 176.83 177.67 2doe h SER 834 N 0.02 0.36 -0.08 4.97 0.02 -1.99 0.23 113.55 117.08 2doe h SER 834 Ca 0.08 0.19 -0.00 0.00 -0.84 0.00 0.00 61.79 61.22 2doe h SER 834 Cb 0.11 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 2doe h SER 834 CO -0.15 -0.14 0.03 0.24 -1.14 0.00 0.00 176.83 175.67 2doe h MET 835 N 0.29 0.12 -0.32 3.45 2.86 -1.78 0.17 114.93 119.71 2doe h MET 835 Ca 0.68 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 58.35 2doe h MET 835 Cb 1.50 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 33.10 2doe h MET 835 CO -0.62 0.25 0.05 0.00 1.06 0.00 0.00 176.91 177.64 2doe h ARG 836 N -0.04 0.15 0.44 1.72 3.08 -0.41 0.28 114.38 119.60 2doe h ARG 836 Ca 0.03 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 2doe h ARG 836 Cb 0.18 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.20 2doe h ARG 836 CO -0.00 0.10 -0.21 0.93 -1.07 0.00 0.00 179.97 179.72 2doe h GLU 837 N 0.16 -0.56 0.08 0.04 5.08 -1.11 -2.37 114.58 115.90 2doe h GLU 837 Ca 0.15 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.57 2doe h GLU 837 Cb 0.18 0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.51 2doe h GLU 837 CO -0.21 -0.26 -0.44 0.22 -1.00 0.00 0.00 179.01 177.32 2doe h ASP 838 N -0.87 -1.31 -0.31 1.42 3.58 -0.54 0.29 116.42 118.68 2doe h ASP 838 Ca -0.06 0.15 0.04 0.00 0.42 0.00 0.00 57.03 57.58 2doe h ASP 838 Cb 0.56 0.50 -0.08 0.00 1.72 0.00 0.00 39.33 42.03 2doe h ASP 838 CO 0.10 -0.49 -0.55 -0.07 -2.88 0.00 0.00 179.24 175.35 2doe h LEU 839 N -0.65 -1.80 0.05 2.28 3.38 -0.51 0.22 115.31 118.28 2doe h LEU 839 Ca 0.03 0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.25 2doe h LEU 839 Cb 0.69 0.73 -0.05 0.00 0.09 0.00 0.00 40.66 42.11 2doe h LEU 839 CO -0.28 -0.43 -0.50 0.15 0.09 0.00 0.00 178.44 177.47 2doe h PHE 840 N -0.47 -1.43 -0.78 1.13 3.57 -1.16 -1.52 116.94 116.28 2doe h PHE 840 Ca 0.06 0.04 0.18 0.00 3.53 0.00 0.00 57.97 61.78 2doe h PHE 840 Cb 0.63 0.62 -0.12 0.00 2.79 0.00 0.00 35.95 39.87 2doe h PHE 840 CO -0.67 -0.56 0.19 0.87 -2.23 0.00 0.00 178.31 175.91 2doe h LYS 841 N -0.68 0.25 0.19 1.11 1.57 -0.43 -0.80 116.57 117.78 2doe h LYS 841 Ca 0.02 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2doe h LYS 841 Cb 0.72 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.94 2doe h LYS 841 CO -0.31 0.17 -0.35 1.96 -0.57 0.00 0.00 179.45 180.34 2doe h GLN 842 N 0.26 -0.60 0.35 3.15 4.20 0.37 0.17 115.11 123.01 2doe h GLN 842 Ca 0.45 0.04 -0.00 0.00 0.06 0.00 0.00 58.65 59.20 2doe h GLN 842 Cb 0.81 0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.69 2doe h GLN 842 CO -0.55 -0.40 -0.44 -0.92 -0.67 0.00 0.00 178.83 175.85 2doe h TYR 843 N -0.62 -1.21 -0.23 2.96 5.03 -0.38 -2.19 116.97 120.33 2doe h TYR 843 Ca 0.01 0.01 0.06 0.00 2.58 0.00 0.00 58.73 61.40 2doe h TYR 843 Cb 0.62 0.48 -0.07 0.00 1.55 0.00 0.00 36.73 39.31 2doe h TYR 843 CO -0.28 -0.58 -0.34 0.82 -1.32 0.00 0.00 178.16 176.46 2doe h ILE 844 N -0.83 0.24 -0.82 1.81 1.08 -1.06 -1.23 117.51 116.70 2doe h ILE 844 Ca -0.03 0.00 0.20 0.00 -0.39 0.00 0.00 64.86 64.64 2doe h ILE 844 Cb 0.76 0.24 -0.14 0.00 -3.07 0.00 0.00 36.82 34.61 2doe h ILE 844 CO -0.12 0.00 0.02 -0.33 -0.69 0.00 0.00 178.15 177.03 2doe h GLU 845 N -0.36 0.09 -0.41 2.37 5.08 -0.46 0.22 114.58 121.11 2doe h GLU 845 Ca 0.12 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 2doe h GLU 845 Cb 0.56 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 2doe h GLU 845 CO -0.43 0.06 0.20 -0.22 -1.00 0.00 0.00 179.01 177.62 2doe h LYS 846 N 0.09 0.39 0.26 2.33 3.64 -0.60 0.29 116.57 122.97 2doe h LYS 846 Ca 0.46 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.81 2doe h LYS 846 Cb 0.85 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 2doe h LYS 846 CO -0.73 0.26 -0.22 0.82 -2.27 0.00 0.00 179.45 177.31 2doe h ILE 847 N 0.40 0.00 -0.84 2.00 2.04 -0.01 -2.76 117.51 118.34 2doe h ILE 847 Ca 0.17 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.15 2doe h ILE 847 Cb 0.09 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.11 2doe h ILE 847 CO -0.13 0.00 0.54 0.00 0.00 0.00 0.00 178.15 178.57 2doe h ALA 848 N -1.46 1.80 -0.25 1.87 0.00 -1.29 -2.23 119.26 117.71 2doe h ALA 848 Ca -0.03 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.57 2doe h ALA 848 Cb 0.39 -0.15 -0.11 0.00 0.00 0.00 0.00 17.79 17.92 2doe h ALA 848 CO -0.00 0.00 0.01 1.17 0.00 0.00 0.00 179.25 180.43 2doe n LYS 849 N -4.53 2.07 -3.82 0.00 4.81 0.10 -4.67 118.16 112.12 2doe n LYS 849 Ca 0.15 -1.50 -0.28 0.00 -0.87 0.00 0.00 58.31 55.81 2doe n LYS 849 Cb 0.39 -1.95 -0.12 0.00 0.02 0.00 0.00 35.03 33.37 2doe n LYS 849 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2doe n ASN 850 N 1.61 2.84 -3.83 3.14 6.94 -0.84 -4.85 115.26 120.27 2doe n ASN 850 Ca 0.41 -3.17 -0.26 0.00 -0.02 0.00 0.00 54.58 51.54 2doe n ASN 850 Cb 0.72 -0.74 -0.17 0.00 -2.36 0.00 0.00 39.78 37.23 2doe n ASN 850 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2doe s LEU 851 N -1.46 1.03 -0.47 -4.53 1.02 -1.26 -5.08 118.68 107.93 2doe s LEU 851 Ca 0.27 -0.34 0.03 0.00 0.02 0.00 0.00 54.13 54.10 2doe s LEU 851 Cb -0.02 -0.67 0.14 0.00 0.02 0.00 0.00 46.19 45.66 2doe s LEU 851 CO -0.16 -0.18 0.27 -0.62 0.02 0.00 0.00 176.35 175.68 2doe s ASP 852 N 1.81 3.68 -0.41 2.29 -1.08 -1.26 -5.07 116.67 116.63 2doe s ASP 852 Ca 0.04 -2.82 -0.10 0.00 -0.52 0.00 0.00 52.55 49.15 2doe s ASP 852 Cb -0.13 -1.11 0.07 0.00 -1.46 0.00 0.00 42.92 40.28 2doe s ASP 852 CO -0.07 -0.24 0.25 -0.55 0.52 0.00 0.00 175.17 175.08 2doe s SER 853 N 0.09 5.67 0.05 -0.34 0.15 -1.26 -4.98 113.70 113.07 2doe s SER 853 Ca 0.19 -1.38 -0.31 0.00 0.70 0.00 0.00 55.95 55.16 2doe s SER 853 Cb -0.20 -2.00 -0.17 0.00 -1.71 0.00 0.00 66.02 61.94 2doe s SER 853 CO -0.03 -0.50 1.45 0.77 1.20 0.00 0.00 173.24 176.12 2doe h SER 854 N 8.42 -0.94 -1.94 5.45 4.64 -2.08 -3.44 113.55 123.66 2doe h SER 854 Ca -0.24 0.03 -0.62 0.00 -0.47 0.00 0.00 61.79 60.50 2doe h SER 854 Cb 1.09 0.24 0.15 0.00 -0.31 0.00 0.00 62.40 63.57 2doe h SER 854 CO 0.74 -0.67 -0.68 0.61 -0.87 0.00 0.00 176.83 175.96 2doe n GLY 855 N -1.51 -2.12 3.76 -0.77 0.00 -1.26 -4.87 105.19 98.42 2doe n GLY 855 Ca -0.14 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.27 4.44 -0.15 1.61 0.04 -1.26 -4.93 135.00 133.49 2doe s PRO 856 Ca 0.61 2.05 -0.29 0.00 0.04 0.00 0.00 61.00 63.42 2doe s PRO 856 Cb -0.64 -3.14 -0.06 0.00 0.04 0.00 0.00 34.50 30.70 2doe s PRO 856 CO 0.60 -0.10 2.15 -1.54 0.04 0.00 0.00 177.00 178.16 2doe s SER 857 N -0.35 5.73 0.07 6.66 1.04 -1.26 -4.93 113.70 120.65 2doe s SER 857 Ca 0.50 2.11 -0.18 0.00 0.48 0.00 0.00 55.95 58.86 2doe s SER 857 Cb -0.37 -2.52 0.04 0.00 0.10 0.00 0.00 66.02 63.28 2doe s SER 857 CO 0.45 -1.71 0.42 -0.94 0.98 0.00 0.00 173.24 172.44 2doe s SER 858 N 7.22 -0.28 0.00 7.02 1.04 -1.26 -5.30 113.70 122.13 2doe s SER 858 Ca 0.97 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 57.33 2doe s SER 858 Cb -0.36 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2doe s SER 858 CO 0.37 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.48