#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 -1.74 -3.94 1.61 7.64 -1.26 -4.86 113.62 111.08 2doe n SER 778 Ca 0.00 -1.18 -0.30 0.00 1.01 0.00 0.00 58.87 58.41 2doe n SER 778 Cb 0.00 -1.52 -0.13 0.00 -1.01 0.00 0.00 64.21 61.55 2doe n SER 778 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2doe s SER 779 N -3.14 4.49 0.22 6.43 0.15 -1.26 -5.08 113.70 115.52 2doe s SER 779 Ca 0.79 -3.27 0.03 0.00 0.70 0.00 0.00 55.95 54.21 2doe s SER 779 Cb -0.46 -1.65 -0.05 0.00 -1.71 0.00 0.00 66.02 62.15 2doe s SER 779 CO 0.97 -0.19 -0.00 -0.83 1.20 0.00 0.00 173.24 174.39 2doe s GLY 780 N -0.62 1.50 -0.06 9.45 0.00 -1.26 -5.16 107.32 111.17 2doe s GLY 780 Ca 0.19 -1.73 -0.02 0.00 0.00 0.00 0.00 44.72 43.15 2doe s GLY 780 CO -0.05 -1.64 0.13 -0.56 0.00 0.00 0.00 173.10 170.98 2doe s SER 781 N -3.28 -0.02 0.39 1.64 0.01 -1.26 -5.16 113.70 106.02 2doe s SER 781 Ca 0.28 0.26 0.08 0.00 1.31 0.00 0.00 55.95 57.88 2doe s SER 781 Cb 0.06 0.15 -0.02 0.00 0.21 0.00 0.00 66.02 66.41 2doe s SER 781 CO 0.08 -0.15 0.33 -0.44 0.41 0.00 0.00 173.24 173.47 2doe s SER 782 N 1.24 5.08 -0.12 2.44 0.01 -1.26 -5.14 113.70 115.95 2doe s SER 782 Ca -0.08 -0.69 -0.31 0.00 1.31 0.00 0.00 55.95 56.19 2doe s SER 782 Cb -0.12 -0.69 0.12 0.00 0.21 0.00 0.00 66.02 65.54 2doe s SER 782 CO -0.05 -0.54 1.02 -0.83 0.41 0.00 0.00 173.24 173.24 2doe s GLY 783 N -4.07 -0.32 -0.33 3.44 0.00 -1.26 -5.14 107.32 99.65 2doe s GLY 783 Ca 0.45 1.67 -0.12 0.00 0.00 0.00 0.00 44.72 46.72 2doe s GLY 783 CO 0.27 0.72 0.21 -1.83 0.00 0.00 0.00 173.10 172.47 2doe s GLU 784 N -1.99 3.45 0.00 2.90 -1.05 -1.26 -4.87 118.70 115.87 2doe s GLU 784 Ca 0.03 -0.66 0.00 0.00 -0.15 0.00 0.00 54.97 54.19 2doe s GLU 784 Cb -0.01 -3.73 0.00 0.00 -0.44 0.00 0.00 34.13 29.96 2doe s GLU 784 CO -0.04 -0.43 0.00 0.36 0.95 0.00 0.00 175.26 176.10 2doe n LYS 785 N 5.06 2.34 0.00 -4.83 0.00 -1.26 -4.90 118.16 114.57 2doe n LYS 785 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 2doe n LYS 785 Cb 0.50 -0.90 0.00 0.00 -0.00 0.00 0.00 35.03 34.63 2doe n LYS 785 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.40 176.55 2doe n GLU 786 N -1.48 0.00 -1.09 -1.58 0.28 -1.26 -4.84 120.64 110.67 2doe n GLU 786 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.84 2doe n GLU 786 Cb 0.23 -0.38 -0.14 0.00 1.43 0.00 0.00 31.44 32.57 2doe n GLU 786 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2doe n ASP 787 N -2.46 5.69 -0.07 -1.84 8.00 -1.26 -4.40 116.55 120.22 2doe n ASP 787 Ca 0.00 -2.57 -0.09 0.00 0.71 0.00 0.00 54.79 52.84 2doe n ASP 787 Cb 0.22 -1.41 -0.08 0.00 -0.02 0.00 0.00 41.12 39.83 2doe n ASP 787 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2doe h SER 788 N 3.18 0.00 -0.75 -2.24 0.02 -1.90 -3.10 113.55 108.77 2doe h SER 788 Ca 0.27 -0.55 0.11 0.00 -0.84 0.00 0.00 61.79 60.78 2doe h SER 788 Cb 1.32 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.74 2doe h SER 788 CO 0.44 0.84 -0.42 0.11 -1.14 0.00 0.00 176.83 176.67 2doe h LYS 789 N -1.00 -0.12 0.00 3.45 6.56 -2.01 1.30 116.57 124.75 2doe h LYS 789 Ca -0.03 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2doe h LYS 789 Cb 0.64 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 32.33 2doe h LYS 789 CO -0.02 -0.08 0.00 0.00 -2.06 0.00 0.00 179.45 177.29 2doe h THR 790 N -0.13 0.00 0.01 -0.16 1.03 -1.91 -2.88 112.91 108.87 2doe h THR 790 Ca 0.24 -0.25 -0.00 0.00 -0.01 0.00 0.00 66.41 66.39 2doe h THR 790 Cb 0.56 1.16 0.00 0.00 -1.07 0.00 0.00 68.15 68.79 2doe h THR 790 CO -0.80 0.00 -0.00 -0.09 -0.01 0.00 0.00 175.52 174.62 2doe h ARG 791 N 0.00 -0.01 0.33 0.00 9.65 0.17 -2.22 114.38 122.30 2doe h ARG 791 Ca 0.00 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 2doe h ARG 791 Cb 0.27 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.85 2doe h ARG 791 CO 0.00 0.53 -0.18 0.78 2.80 0.00 0.00 179.97 183.89 2doe h GLY 792 N -0.55 -0.50 0.58 2.80 0.00 -1.06 -2.17 103.07 102.16 2doe h GLY 792 Ca -0.00 0.20 -0.00 0.00 0.00 0.00 0.00 47.33 47.53 2doe h GLY 792 CO 0.00 -0.19 -0.38 -2.09 0.00 0.00 0.00 176.54 173.88 2doe h GLU 793 N -0.48 -0.73 -0.59 4.80 4.81 -1.65 -1.06 114.58 119.68 2doe h GLU 793 Ca -0.04 0.05 0.07 0.00 -0.13 0.00 0.00 59.36 59.32 2doe h GLU 793 Cb 0.39 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 29.83 2doe h GLU 793 CO 0.05 -0.49 -0.51 -0.22 -0.73 0.00 0.00 179.01 177.12 2doe h LYS 794 N -0.76 -0.25 -0.27 1.92 3.64 -1.38 -0.36 116.57 119.13 2doe h LYS 794 Ca -0.02 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 2doe h LYS 794 Cb 0.69 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.50 2doe h LYS 794 CO -0.08 -0.16 -0.15 0.82 -2.27 0.00 0.00 179.45 177.60 2doe h ILE 795 N -0.25 0.55 -0.84 2.00 2.04 -1.23 -1.33 117.51 118.45 2doe h ILE 795 Ca 0.14 0.00 0.19 0.00 1.00 0.00 0.00 64.86 66.19 2doe h ILE 795 Cb 0.55 0.55 -0.11 0.00 -0.74 0.00 0.00 36.82 37.07 2doe h ILE 795 CO -0.70 0.00 0.34 0.50 0.00 0.00 0.00 178.15 178.29 2doe h LYS 796 N -0.12 0.39 0.65 2.37 3.64 0.20 -0.14 116.57 123.56 2doe h LYS 796 Ca 0.14 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.47 2doe h LYS 796 Cb 0.34 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.08 2doe h LYS 796 CO -0.35 0.26 -0.34 1.03 -2.27 0.00 0.00 179.45 177.79 2doe h SER 797 N 0.41 -0.81 0.04 4.20 0.87 0.01 -2.46 113.55 115.80 2doe h SER 797 Ca 0.50 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 61.12 2doe h SER 797 Cb 0.88 0.22 -0.05 0.00 -0.44 0.00 0.00 62.40 63.01 2doe h SER 797 CO -0.49 -0.56 -0.35 -2.24 -0.53 0.00 0.00 176.83 172.66 2doe h ASP 798 N -0.91 -1.05 -0.61 6.23 3.04 -0.80 -1.58 116.42 120.73 2doe h ASP 798 Ca -0.09 0.13 0.06 0.00 -3.24 0.00 0.00 57.03 53.89 2doe h ASP 798 Cb 0.71 0.41 -0.09 0.00 -1.04 0.00 0.00 39.33 39.33 2doe h ASP 798 CO 0.13 -0.42 -0.47 0.15 -2.04 0.00 0.00 179.24 176.58 2doe h PHE 799 N -0.54 -1.50 -0.17 4.15 3.57 -1.02 -1.09 116.94 120.35 2doe h PHE 799 Ca 0.05 0.09 0.05 0.00 3.53 0.00 0.00 57.97 61.69 2doe h PHE 799 Cb 0.60 0.73 -0.07 0.00 2.79 0.00 0.00 35.95 40.01 2doe h PHE 799 CO -0.35 -0.35 -0.37 0.74 -2.23 0.00 0.00 178.31 175.75 2doe h PHE 800 N -0.14 -1.04 -0.95 0.41 0.04 -1.21 -2.19 116.94 111.87 2doe h PHE 800 Ca 0.10 0.05 0.10 0.00 2.80 0.00 0.00 57.97 61.02 2doe h PHE 800 Cb 0.40 0.48 -0.12 0.00 2.20 0.00 0.00 35.95 38.91 2doe h PHE 800 CO -0.88 -0.43 -0.55 0.93 -0.60 0.00 0.00 178.31 176.78 2doe h GLU 801 N -0.42 -0.03 0.06 1.51 5.08 -0.21 0.41 114.58 120.97 2doe h GLU 801 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2doe h GLU 801 Cb 0.58 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2doe h GLU 801 CO -0.40 -0.02 -0.15 1.25 -1.00 0.00 0.00 179.01 178.69 2doe h LEU 802 N -0.03 -0.44 -0.89 1.33 5.85 -0.81 0.12 115.31 120.43 2doe h LEU 802 Ca 0.19 0.04 0.08 0.00 0.84 0.00 0.00 57.88 59.03 2doe h LEU 802 Cb 0.46 0.16 -0.11 0.00 0.37 0.00 0.00 40.66 41.54 2doe h LEU 802 CO -0.92 -0.17 -0.53 0.18 -0.34 0.00 0.00 178.44 176.67 2doe n LEU 803 N -3.27 -0.94 -0.36 2.25 4.77 -0.81 0.86 117.00 119.49 2doe n LEU 803 Ca -0.03 1.65 0.10 0.00 -0.03 0.00 0.00 56.01 57.71 2doe n LEU 803 Cb 0.12 -0.24 0.28 0.00 -2.33 0.00 0.00 43.42 41.25 2doe n LEU 803 CO 0.05 -1.33 1.21 0.77 -1.33 0.00 0.00 177.39 176.76 2doe h SER 804 N 0.00 0.85 0.16 -1.43 4.64 -0.78 0.36 113.55 117.35 2doe h SER 804 Ca 0.14 0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.53 2doe h SER 804 Cb 0.37 -0.09 -0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2doe h SER 804 CO -0.84 0.37 -0.04 0.78 -0.87 0.00 0.00 176.83 176.23 2doe h ASN 805 N 0.87 0.00 -0.19 4.97 2.35 0.32 -2.10 115.58 121.80 2doe h ASN 805 Ca 0.54 0.00 -0.10 0.00 -0.55 0.00 0.00 56.30 56.19 2doe h ASN 805 Cb 0.71 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.02 2doe h ASN 805 CO -0.33 0.04 0.13 1.41 -1.65 0.00 0.00 177.43 177.04 2doe n HIS 806 N -3.66 0.60 -3.95 1.19 8.25 0.13 -4.85 115.22 112.93 2doe n HIS 806 Ca -0.02 -0.85 -0.30 0.00 -0.26 0.00 0.00 57.72 56.29 2doe n HIS 806 Cb 0.14 -0.43 -0.03 0.00 1.12 0.00 0.00 29.99 30.79 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 0.30 -1.00 -0.91 4.41 8.25 -0.79 -4.80 115.22 120.68 2doe n HIS 807 Ca 0.12 0.25 -0.36 0.00 -0.26 0.00 0.00 57.72 57.46 2doe n HIS 807 Cb 0.70 -2.12 0.07 0.00 1.12 0.00 0.00 29.99 29.76 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 -3.94 -3.38 -3.73 2.41 4.77 -1.25 -5.02 117.00 106.84 2doe n LEU 808 Ca -0.17 0.06 -0.10 0.00 -0.03 0.00 0.00 56.01 55.77 2doe n LEU 808 Cb 0.48 -0.74 -0.05 0.00 -2.33 0.00 0.00 43.42 40.79 2doe n LEU 808 CO 0.61 -3.69 0.16 -1.81 -1.33 0.00 0.00 177.39 171.33 2doe s ASP 809 N -1.28 -0.19 0.47 -1.43 1.01 -1.26 -5.01 116.67 108.99 2doe s ASP 809 Ca 0.43 -0.47 0.30 0.00 0.71 0.00 0.00 52.55 53.52 2doe s ASP 809 Cb -0.05 0.50 1.63 0.00 1.01 0.00 0.00 42.92 46.02 2doe s ASP 809 CO 0.71 -0.92 1.91 0.77 0.21 0.00 0.00 175.17 177.85 2doe h SER 810 N 2.35 0.00 -0.42 0.27 4.64 -1.95 0.11 113.55 118.55 2doe h SER 810 Ca -0.32 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.84 2doe h SER 810 Cb 1.25 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 63.25 2doe h SER 810 CO 0.44 0.00 0.05 0.00 -0.87 0.00 0.00 176.83 176.45 2doe n GLN 811 N -2.58 2.36 -1.96 4.77 6.02 -1.26 -4.99 117.38 119.74 2doe n GLN 811 Ca -0.02 -3.05 -0.42 0.00 -0.01 0.00 0.00 57.00 53.49 2doe n GLN 811 Cb 0.09 -1.89 -0.03 0.00 1.02 0.00 0.00 30.24 29.43 2doe n GLN 811 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2doe s SER 812 N -2.12 6.63 -0.34 1.08 1.04 0.37 -4.98 113.70 115.39 2doe s SER 812 Ca 0.46 2.36 -0.12 0.00 0.48 0.00 0.00 55.95 59.14 2doe s SER 812 Cb 0.40 -2.55 -0.00 0.00 0.10 0.00 0.00 66.02 63.97 2doe s SER 812 CO 0.05 -0.91 0.21 -0.13 0.98 0.00 0.00 173.24 173.44 2doe s ARG 813 N 3.47 3.28 0.21 4.02 1.81 -1.26 -4.98 118.95 125.50 2doe s ARG 813 Ca 0.75 -0.78 -0.20 0.00 -1.72 0.00 0.00 55.73 53.78 2doe s ARG 813 Cb -0.36 -3.73 0.17 0.00 -0.45 0.00 0.00 34.95 30.57 2doe s ARG 813 CO 0.32 -0.51 1.57 2.35 -0.68 0.00 0.00 175.30 178.35 2doe h TRP 814 N 8.45 -1.03 -1.02 -0.53 -0.00 -1.98 0.61 115.95 120.45 2doe h TRP 814 Ca -0.30 0.09 0.28 0.00 -0.00 0.00 0.00 58.89 58.96 2doe h TRP 814 Cb 1.14 0.57 -0.13 0.00 -0.00 0.00 0.00 29.16 30.74 2doe h TRP 814 CO 0.63 -0.39 0.60 1.03 -0.00 0.00 0.00 178.44 180.31 2doe h SER 815 N -0.09 0.58 0.19 2.65 0.87 -1.99 0.34 113.55 116.11 2doe h SER 815 Ca 0.28 0.15 -0.01 0.00 -1.23 0.00 0.00 61.79 60.98 2doe h SER 815 Cb 0.57 0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.60 2doe h SER 815 CO -0.83 0.01 -0.09 0.11 -0.53 0.00 0.00 176.83 175.50 2doe h LYS 816 N 0.46 -0.24 -1.18 2.24 1.79 -0.30 -2.23 116.57 117.10 2doe h LYS 816 Ca 0.68 0.02 0.34 0.00 -2.18 0.00 0.00 60.65 59.51 2doe h LYS 816 Cb 1.46 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 32.12 2doe h LYS 816 CO -0.50 -0.16 0.88 -0.24 -1.08 0.00 0.00 179.45 178.35 2doe h VAL 817 N -0.77 0.36 0.00 0.50 3.04 -0.48 0.18 116.25 119.09 2doe h VAL 817 Ca -0.03 0.00 -0.04 0.00 -1.01 0.00 0.00 66.70 65.62 2doe h VAL 817 Cb 0.19 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 29.86 2doe h VAL 817 CO 0.04 0.00 -0.16 0.50 -1.01 0.00 0.00 177.57 176.94 2doe h LYS 818 N 0.00 0.10 0.00 4.17 3.64 -0.39 -0.67 116.57 123.43 2doe h LYS 818 Ca 0.56 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.82 2doe h LYS 818 Cb 2.31 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 34.16 2doe h LYS 818 CO -0.01 0.90 0.00 -0.44 -2.27 0.00 0.00 179.45 177.63 2doe h ASP 819 N -0.65 0.00 0.08 4.20 3.32 -0.12 0.20 116.42 123.45 2doe h ASP 819 Ca -0.02 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.66 2doe h ASP 819 Cb 0.96 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.47 2doe h ASP 819 CO 0.03 0.00 -2.14 0.29 -1.72 0.00 0.00 179.24 175.70 2doe n LYS 820 N -2.47 0.72 0.09 3.56 4.76 0.22 -4.32 118.16 120.72 2doe n LYS 820 Ca 0.01 0.24 -0.05 0.00 -2.87 0.00 0.00 58.31 55.64 2doe n LYS 820 Cb 0.18 -1.65 -0.01 0.00 -1.84 0.00 0.00 35.03 31.72 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 1.58 -1.14 -0.18 -1.51 -0.87 -3.27 116.25 110.86 2doe h VAL 821 Ca -0.48 -2.92 0.33 0.00 -1.23 0.00 0.00 66.70 62.40 2doe h VAL 821 Cb 1.96 2.59 -0.05 0.00 -2.13 0.00 0.00 31.29 33.66 2doe h VAL 821 CO 0.01 0.83 1.19 -1.84 -1.23 0.00 0.00 177.57 176.52 2doe n GLU 822 N -3.50 0.01 -0.16 5.19 -0.00 0.68 0.23 120.64 123.10 2doe n GLU 822 Ca -0.00 0.97 -0.01 0.00 -0.00 0.00 0.00 57.16 58.12 2doe n GLU 822 Cb 0.82 -2.38 0.05 0.00 -0.00 0.00 0.00 31.44 29.93 2doe n GLU 822 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2doe n SER 823 N -3.24 2.34 -3.94 -1.84 2.88 -1.23 -4.77 113.62 103.81 2doe n SER 823 Ca 0.26 -2.19 -0.14 0.00 -1.33 0.00 0.00 58.87 55.46 2doe n SER 823 Cb 1.53 -0.54 -0.14 0.00 -0.75 0.00 0.00 64.21 64.31 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 0.21 0.43 0.27 -3.46 -1.08 0.62 -5.04 116.67 108.63 2doe s ASP 824 Ca 0.09 -0.09 0.05 0.00 -0.52 0.00 0.00 52.55 52.07 2doe s ASP 824 Cb 0.07 -0.04 0.37 0.00 -1.46 0.00 0.00 42.92 41.86 2doe s ASP 824 CO 0.02 0.03 1.65 1.55 0.52 0.00 0.00 175.17 178.94 2doe h PRO 825 N 5.96 0.28 -0.88 4.34 0.13 -1.86 -3.14 132.00 136.84 2doe h PRO 825 Ca -0.27 -0.15 0.15 0.00 -0.87 0.00 0.00 66.00 64.86 2doe h PRO 825 Cb 1.20 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.24 2doe h PRO 825 CO 0.50 0.69 0.48 0.00 -0.23 0.00 0.00 178.00 179.44 2doe h ARG 826 N 0.23 0.67 -0.57 0.86 3.08 -1.96 0.49 114.38 117.18 2doe h ARG 826 Ca 0.02 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 2doe h ARG 826 Cb 0.90 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.77 2doe h ARG 826 CO 0.07 0.44 0.23 -0.92 -1.07 0.00 0.00 179.97 178.73 2doe h TYR 827 N 0.69 0.84 0.00 3.04 5.03 -1.85 -1.44 116.97 123.28 2doe h TYR 827 Ca 0.48 -0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.74 2doe h TYR 827 Cb 0.65 -0.26 0.00 0.00 1.55 0.00 0.00 36.73 38.67 2doe h TYR 827 CO -0.07 0.65 0.00 0.87 -1.32 0.00 0.00 178.16 178.29 2doe h LYS 828 N 0.82 0.00 -0.57 1.82 1.57 -1.03 -3.10 116.57 116.09 2doe h LYS 828 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2doe h LYS 828 Cb 0.16 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2doe h LYS 828 CO -0.02 0.00 0.36 0.00 -0.57 0.00 0.00 179.45 179.22 2doe h ALA 829 N 2.02 0.72 -2.41 3.86 0.00 -0.43 -3.41 119.26 119.61 2doe h ALA 829 Ca 0.00 -0.06 -0.53 0.00 0.00 0.00 0.00 54.91 54.32 2doe h ALA 829 Cb 0.57 -0.23 0.02 0.00 0.00 0.00 0.00 17.79 18.15 2doe h ALA 829 CO 0.00 0.18 1.09 0.08 0.00 0.00 0.00 179.25 180.61 2doe s VAL 830 N -6.06 3.02 -0.21 0.00 1.01 -1.17 -4.90 120.40 112.08 2doe s VAL 830 Ca -0.13 0.32 -0.17 0.00 0.00 0.00 0.00 61.98 62.00 2doe s VAL 830 Cb 0.13 -3.21 -0.13 0.00 0.00 0.00 0.00 36.38 33.17 2doe s VAL 830 CO 0.75 -0.01 -0.08 -0.90 0.00 0.00 0.00 175.10 174.86 2doe n ASP 831 N 6.35 1.89 -4.66 3.32 5.75 -1.26 -4.88 116.55 123.06 2doe n ASP 831 Ca 0.17 0.43 -0.43 0.00 -0.01 0.00 0.00 54.79 54.95 2doe n ASP 831 Cb 0.41 -0.88 -0.02 0.00 -1.03 0.00 0.00 41.12 39.59 2doe n ASP 831 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2doe s SER 832 N -6.75 6.84 0.21 -1.12 0.01 -1.26 -4.91 113.70 106.71 2doe s SER 832 Ca -0.29 1.91 -0.09 0.00 1.31 0.00 0.00 55.95 58.78 2doe s SER 832 Cb 0.08 -2.54 0.16 0.00 0.21 0.00 0.00 66.02 63.93 2doe s SER 832 CO 0.48 -0.82 1.83 0.77 0.41 0.00 0.00 173.24 175.90 2doe h SER 833 N 8.72 0.97 -0.88 2.44 4.64 -2.01 -2.61 113.55 124.81 2doe h SER 833 Ca -0.32 -0.10 0.21 0.00 -0.47 0.00 0.00 61.79 61.12 2doe h SER 833 Cb 1.13 -0.25 -0.12 0.00 -0.31 0.00 0.00 62.40 62.86 2doe h SER 833 CO 0.96 0.79 0.38 -1.28 -0.87 0.00 0.00 176.83 176.81 2doe h SER 834 N 1.07 0.33 -0.55 4.97 0.87 -2.00 0.13 113.55 118.36 2doe h SER 834 Ca 0.27 0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 60.96 2doe h SER 834 Cb 0.03 0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.10 2doe h SER 834 CO -0.04 0.02 0.28 0.24 -0.53 0.00 0.00 176.83 176.79 2doe h MET 835 N 0.41 0.79 0.51 2.24 2.07 -1.87 0.18 114.93 119.26 2doe h MET 835 Ca 0.54 -0.11 -0.02 0.00 -2.07 0.00 0.00 59.70 58.04 2doe h MET 835 Cb 1.00 -0.15 -0.02 0.00 -1.87 0.00 0.00 31.60 30.57 2doe h MET 835 CO -0.51 0.64 -0.44 0.00 1.07 0.00 0.00 176.91 177.67 2doe h ARG 836 N 0.75 -0.90 0.55 1.72 3.08 -0.73 0.50 114.38 119.34 2doe h ARG 836 Ca 0.19 0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.28 2doe h ARG 836 Cb 0.10 0.20 0.01 0.00 0.08 0.00 0.00 29.97 30.36 2doe h ARG 836 CO -0.03 -0.60 -0.26 0.93 -1.07 0.00 0.00 179.97 178.94 2doe h GLU 837 N -0.93 -0.71 0.06 0.04 5.08 -1.38 -0.62 114.58 116.12 2doe h GLU 837 Ca -0.07 0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.36 2doe h GLU 837 Cb 0.79 0.16 -0.05 0.00 0.50 0.00 0.00 28.75 30.15 2doe h GLU 837 CO -0.02 -0.45 -0.48 0.22 -1.00 0.00 0.00 179.01 177.28 2doe h ASP 838 N -0.79 -1.46 -0.37 1.42 3.58 -0.64 0.20 116.42 118.37 2doe h ASP 838 Ca -0.08 0.16 0.08 0.00 0.42 0.00 0.00 57.03 57.61 2doe h ASP 838 Cb 0.59 0.54 -0.08 0.00 1.72 0.00 0.00 39.33 42.10 2doe h ASP 838 CO 0.12 -0.49 -0.23 -0.07 -2.88 0.00 0.00 179.24 175.70 2doe h LEU 839 N -0.65 -0.76 0.24 2.28 3.38 -0.02 0.34 115.31 120.13 2doe h LEU 839 Ca 0.00 0.16 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2doe h LEU 839 Cb 0.67 0.39 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2doe h LEU 839 CO -0.29 -0.25 -0.31 0.15 0.09 0.00 0.00 178.44 177.83 2doe h PHE 840 N -0.17 -0.86 -1.00 1.13 3.57 -0.65 -1.25 116.94 117.71 2doe h PHE 840 Ca 0.18 0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.90 2doe h PHE 840 Cb 0.45 0.35 -0.10 0.00 2.79 0.00 0.00 35.95 39.43 2doe h PHE 840 CO -0.44 -0.39 0.61 0.87 -2.23 0.00 0.00 178.31 176.73 2doe h LYS 841 N -0.57 0.66 0.32 1.11 1.57 -0.34 -1.49 116.57 117.82 2doe h LYS 841 Ca -0.03 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.71 2doe h LYS 841 Cb 0.51 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2doe h LYS 841 CO -0.07 0.43 -0.31 1.96 -0.57 0.00 0.00 179.45 180.89 2doe h GLN 842 N 0.67 -0.64 0.17 3.15 4.20 0.26 0.22 115.11 123.15 2doe h GLN 842 Ca 0.58 0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.35 2doe h GLN 842 Cb 1.02 0.14 -0.03 0.00 0.30 0.00 0.00 27.48 28.92 2doe h GLN 842 CO -0.37 -0.42 -0.26 -0.92 -0.67 0.00 0.00 178.83 176.19 2doe h TYR 843 N -0.66 -0.71 -0.59 2.96 5.03 -0.27 -2.15 116.97 120.59 2doe h TYR 843 Ca -0.02 0.01 0.09 0.00 2.58 0.00 0.00 58.73 61.39 2doe h TYR 843 Cb 0.60 0.29 -0.07 0.00 1.55 0.00 0.00 36.73 39.10 2doe h TYR 843 CO -0.19 -0.37 0.21 0.82 -1.32 0.00 0.00 178.16 177.31 2doe h ILE 844 N -0.50 0.78 -0.71 1.81 1.08 -1.23 -1.45 117.51 117.28 2doe h ILE 844 Ca 0.02 -0.14 0.12 0.00 -0.39 0.00 0.00 64.86 64.47 2doe h ILE 844 Cb 0.51 0.35 -0.09 0.00 -3.07 0.00 0.00 36.82 34.52 2doe h ILE 844 CO -0.12 0.07 0.29 -0.08 -0.69 0.00 0.00 178.15 177.62 2doe h GLU 845 N 0.39 0.45 -0.48 2.37 4.57 -0.15 -1.12 114.58 120.61 2doe h GLU 845 Ca 0.29 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.44 2doe h GLU 845 Cb 0.36 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 28.82 2doe h GLU 845 CO -0.30 0.30 0.27 -0.22 -1.18 0.00 0.00 179.01 177.88 2doe h LYS 846 N 0.46 0.67 0.36 1.92 3.64 -0.65 -1.40 116.57 121.57 2doe h LYS 846 Ca 0.38 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.67 2doe h LYS 846 Cb 0.52 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.20 2doe h LYS 846 CO -0.36 0.52 -0.27 0.82 -2.27 0.00 0.00 179.45 177.90 2doe h ILE 847 N 0.64 0.00 -1.00 2.00 2.04 -0.66 -2.11 117.51 118.42 2doe h ILE 847 Ca 0.17 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.26 2doe h ILE 847 Cb 0.04 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.02 2doe h ILE 847 CO -0.03 0.00 0.62 0.00 0.00 0.00 0.00 178.15 178.75 2doe h ALA 848 N -1.43 1.93 -0.27 1.87 0.00 -1.34 -2.76 119.26 117.26 2doe h ALA 848 Ca -0.05 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2doe h ALA 848 Cb 0.50 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2doe h ALA 848 CO 0.02 -0.32 0.00 1.17 0.00 0.00 0.00 179.25 180.12 2doe n LYS 849 N -4.72 0.00 -3.74 0.00 0.00 -0.53 -4.35 118.16 104.82 2doe n LYS 849 Ca 0.24 0.57 -0.37 0.00 0.00 0.00 0.00 58.31 58.76 2doe n LYS 849 Cb 0.71 -1.46 -0.11 0.00 0.00 0.00 0.00 35.03 34.18 2doe n LYS 849 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.40 178.61 2doe s ASN 850 N -2.23 5.31 0.22 3.14 2.47 -0.82 -5.08 114.94 117.94 2doe s ASN 850 Ca 0.00 -2.18 0.06 0.00 0.42 0.00 0.00 52.86 51.15 2doe s ASN 850 Cb 0.00 -1.85 -0.03 0.00 -1.45 0.00 0.00 41.25 37.91 2doe s ASN 850 CO 0.00 -0.53 0.25 -1.48 -3.72 0.00 0.00 177.10 171.62 2doe s LEU 851 N 0.93 4.03 0.03 3.21 2.34 -1.18 -4.73 118.68 123.30 2doe s LEU 851 Ca 0.10 -0.09 -0.05 0.00 0.06 0.00 0.00 54.13 54.15 2doe s LEU 851 Cb -0.23 -2.58 -0.05 0.00 -0.56 0.00 0.00 46.19 42.78 2doe s LEU 851 CO -0.04 -0.02 0.26 -0.62 -1.06 0.00 0.00 176.35 174.87 2doe s ASP 852 N -3.70 6.46 -0.21 1.48 2.15 -1.26 -5.02 116.67 116.57 2doe s ASP 852 Ca 0.33 0.50 -0.36 0.00 0.43 0.00 0.00 52.55 53.44 2doe s ASP 852 Cb -0.09 -2.06 -0.13 0.00 -0.30 0.00 0.00 42.92 40.34 2doe s ASP 852 CO 0.26 0.22 1.90 -1.54 -0.17 0.00 0.00 175.17 175.85 2doe n SER 853 N 0.88 2.82 -4.72 -0.34 3.41 -1.26 -4.95 113.62 109.47 2doe n SER 853 Ca -0.09 0.89 -0.23 0.00 -0.26 0.00 0.00 58.87 59.17 2doe n SER 853 Cb 0.52 -1.27 -0.06 0.00 -0.26 0.00 0.00 64.21 63.14 2doe n SER 853 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2doe s SER 854 N 4.63 4.68 0.00 4.04 0.15 -1.26 -5.12 113.70 120.82 2doe s SER 854 Ca 0.98 -0.72 0.00 0.00 0.70 0.00 0.00 55.95 56.91 2doe s SER 854 Cb -0.85 -0.78 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 2doe s SER 854 CO 0.56 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.39 2doe n GLY 855 N -1.09 1.29 3.56 9.45 0.00 -1.26 -4.76 105.19 112.39 2doe n GLY 855 Ca -0.04 0.00 -0.27 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 0.17 2.54 -0.16 1.61 0.04 -1.26 -4.75 135.00 133.19 2doe s PRO 856 Ca 0.00 -0.51 -0.26 0.00 0.04 0.00 0.00 61.00 60.26 2doe s PRO 856 Cb 0.00 -5.11 -0.23 0.00 0.04 0.00 0.00 34.50 29.20 2doe s PRO 856 CO 0.00 -3.53 0.57 0.66 0.04 0.00 0.00 177.00 174.74 2doe h SER 857 N 10.89 0.00 -3.42 6.66 4.64 -2.04 -3.44 113.55 126.83 2doe h SER 857 Ca 0.13 -0.82 -0.59 0.00 -0.47 0.00 0.00 61.79 60.04 2doe h SER 857 Cb 0.99 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.98 2doe h SER 857 CO 1.21 1.15 0.02 -0.55 -0.87 0.00 0.00 176.83 177.79 2doe s SER 858 N -6.42 6.66 0.00 4.97 0.15 -1.26 -5.23 113.70 112.57 2doe s SER 858 Ca -0.22 0.80 0.00 0.00 0.70 0.00 0.00 55.95 57.23 2doe s SER 858 Cb -0.00 -2.32 0.00 0.00 -1.71 0.00 0.00 66.02 61.99 2doe s SER 858 CO 0.65 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.52