#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wsp n ASP 751 N -0.15 0.00 -4.30 0.00 4.64 -1.26 -5.01 116.55 110.47 1wsp n ASP 751 Ca 0.00 0.00 -0.19 0.00 -1.38 0.00 0.00 54.79 53.22 1wsp n ASP 751 Cb 0.00 0.00 -0.10 0.00 -1.04 0.00 0.00 41.12 39.98 1wsp n ASP 751 CO 0.00 0.00 0.00 -0.44 -0.82 0.00 0.00 177.20 175.94 1wsp s SER 752 N 0.56 1.64 0.02 1.67 0.01 -1.24 0.15 113.70 116.52 1wsp s SER 752 Ca 0.00 -1.42 0.04 0.00 1.31 0.00 0.00 55.95 55.88 1wsp s SER 752 Cb 0.00 0.15 -0.02 0.00 0.21 0.00 0.00 66.02 66.36 1wsp s SER 752 CO 0.00 -0.73 -0.12 -0.51 0.41 0.00 0.00 173.24 172.29 1wsp s ILE 753 N -3.59 0.93 -0.10 1.44 2.07 0.26 -4.81 121.20 117.39 1wsp s ILE 753 Ca 0.36 -0.80 -0.27 0.00 -1.41 0.00 0.00 60.65 58.53 1wsp s ILE 753 Cb 0.07 -0.84 -0.02 0.00 0.13 0.00 0.00 42.46 41.81 1wsp s ILE 753 CO 0.15 0.04 0.88 -0.69 -1.91 0.00 0.00 174.94 173.40 1wsp s VAL 754 N -0.69 4.89 -0.24 4.00 1.01 -1.26 0.23 120.40 128.33 1wsp s VAL 754 Ca 0.01 1.78 0.01 0.00 0.00 0.00 0.00 61.98 63.79 1wsp s VAL 754 Cb -0.07 -4.20 0.06 0.00 0.00 0.00 0.00 36.38 32.17 1wsp s VAL 754 CO 0.01 0.09 -0.07 -0.69 0.00 0.00 0.00 175.10 174.43 1wsp s VAL 755 N 1.64 1.74 -0.06 2.92 1.01 0.88 -1.11 120.40 127.43 1wsp s VAL 755 Ca 0.43 -1.35 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1wsp s VAL 755 Cb -0.18 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.23 1wsp s VAL 755 CO 0.18 -0.06 -0.21 0.00 0.00 0.00 0.00 175.10 175.01 1wsp s ALA 756 N 1.30 2.36 0.01 5.51 0.00 -0.32 -1.09 121.76 129.53 1wsp s ALA 756 Ca -0.07 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.91 1wsp s ALA 756 Cb -0.19 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.10 1wsp s ALA 756 CO -0.06 0.44 -0.09 1.52 0.00 0.00 0.00 175.76 177.57 1wsp s TYR 757 N -0.28 0.76 -0.01 0.00 -0.85 -0.76 -0.63 117.35 115.58 1wsp s TYR 757 Ca 0.01 -0.23 -0.28 0.00 -0.52 0.00 0.00 57.07 56.05 1wsp s TYR 757 Cb -0.13 -0.47 -0.03 0.00 0.38 0.00 0.00 41.96 41.70 1wsp s TYR 757 CO 0.03 -0.02 0.90 0.71 -1.52 0.00 0.00 175.55 175.66 1wsp s TYR 758 N -0.49 3.64 -0.24 -3.49 1.51 0.33 -0.99 117.35 117.62 1wsp s TYR 758 Ca 0.00 1.58 -0.04 0.00 -1.01 0.00 0.00 57.07 57.61 1wsp s TYR 758 Cb -0.05 -3.03 0.00 0.00 -0.11 0.00 0.00 41.96 38.77 1wsp s TYR 758 CO 0.00 0.03 -0.02 0.12 -1.11 0.00 0.00 175.55 174.56 1wsp s PHE 759 N 0.91 3.02 -0.67 2.71 2.19 -1.26 -0.84 117.98 124.04 1wsp s PHE 759 Ca 0.48 -1.09 0.00 0.00 0.33 0.00 0.00 56.93 56.65 1wsp s PHE 759 Cb -0.20 -2.12 0.00 0.00 -1.31 0.00 0.00 43.02 39.38 1wsp s PHE 759 CO 0.25 -0.60 0.00 0.00 1.83 0.00 0.00 175.22 176.71 1wsp n GLY 761 N -0.24 2.17 2.40 0.00 0.00 -1.26 -4.98 105.19 103.28 1wsp n GLY 761 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1wsp n GLY 761 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1wsp n GLU 762 N -0.11 0.00 0.14 1.61 1.02 -0.66 -4.84 120.64 117.81 1wsp n GLU 762 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 1wsp n GLU 762 Cb 0.00 -0.99 -0.03 0.00 -0.02 0.00 0.00 31.44 30.40 1wsp n GLU 762 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1wsp h PRO 763 N 2.62 -0.35 -6.04 3.49 0.13 -1.96 -3.38 132.00 126.50 1wsp h PRO 763 Ca -0.32 0.02 -0.63 0.00 -0.87 0.00 0.00 66.00 64.21 1wsp h PRO 763 Cb 0.93 0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.13 1wsp h PRO 763 CO 0.54 -0.24 1.38 -0.89 -0.23 0.00 0.00 178.00 178.56 1wsp n ILE 764 N -3.03 0.32 -1.76 -3.56 5.41 -1.26 -4.89 119.36 110.58 1wsp n ILE 764 Ca -0.05 -0.30 -0.32 0.00 1.00 0.00 0.00 62.75 63.08 1wsp n ILE 764 Cb 0.14 -2.01 0.04 0.00 -0.71 0.00 0.00 39.64 37.11 1wsp n ILE 764 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1wsp s PRO 765 N 5.86 2.93 -0.17 0.38 0.04 -1.26 -4.78 135.00 138.00 1wsp s PRO 765 Ca 1.03 1.23 -0.12 0.00 0.04 0.00 0.00 61.00 63.18 1wsp s PRO 765 Cb -0.65 -1.98 -0.05 0.00 0.04 0.00 0.00 34.50 31.87 1wsp s PRO 765 CO 0.45 -1.12 0.24 0.71 0.04 0.00 0.00 177.00 177.32 1wsp s TYR 766 N -2.56 3.46 -0.09 0.56 1.51 -0.16 -4.90 117.35 115.16 1wsp s TYR 766 Ca 0.64 0.52 0.01 0.00 -1.01 0.00 0.00 57.07 57.23 1wsp s TYR 766 Cb -0.17 -2.27 -0.02 0.00 -0.11 0.00 0.00 41.96 39.38 1wsp s TYR 766 CO 0.44 0.28 -0.12 0.50 -1.11 0.00 0.00 175.55 175.54 1wsp s ARG 767 N 0.34 3.01 0.09 -0.62 3.52 -1.26 -1.82 118.95 122.21 1wsp s ARG 767 Ca 0.14 -0.66 -0.10 0.00 -0.13 0.00 0.00 55.73 54.97 1wsp s ARG 767 Cb -0.12 -2.55 0.01 0.00 -1.56 0.00 0.00 34.95 30.72 1wsp s ARG 767 CO 0.02 0.42 0.24 -0.08 -0.81 0.00 0.00 175.30 175.09 1wsp s THR 768 N -0.18 0.12 -0.10 4.11 -1.32 -0.25 -5.00 115.64 113.02 1wsp s THR 768 Ca 0.00 -1.02 -0.03 0.00 -1.21 0.00 0.00 61.69 59.43 1wsp s THR 768 Cb -0.13 -1.27 -0.04 0.00 -1.51 0.00 0.00 72.50 69.56 1wsp s THR 768 CO 0.03 -0.57 0.04 -0.76 -2.21 0.00 0.00 174.62 171.16 1wsp s LEU 769 N -2.77 3.80 -0.12 9.08 1.02 -1.26 -0.08 118.68 128.34 1wsp s LEU 769 Ca 0.04 0.23 0.03 0.00 0.02 0.00 0.00 54.13 54.44 1wsp s LEU 769 Cb 0.04 -1.89 0.00 0.00 0.02 0.00 0.00 46.19 44.36 1wsp s LEU 769 CO -0.11 0.39 -0.21 -0.69 0.02 0.00 0.00 176.35 175.75 1wsp s VAL 770 N -0.91 2.27 0.33 -1.59 1.01 0.14 -4.92 120.40 116.72 1wsp s VAL 770 Ca 0.14 -0.93 -0.29 0.00 0.00 0.00 0.00 61.98 60.90 1wsp s VAL 770 Cb -0.12 -1.90 -0.10 0.00 0.00 0.00 0.00 36.38 34.26 1wsp s VAL 770 CO 0.03 0.55 1.32 -0.13 0.00 0.00 0.00 175.10 176.86 1wsp s ARG 771 N 0.53 4.35 0.00 2.72 1.81 -1.26 0.90 118.95 128.00 1wsp s ARG 771 Ca -0.13 2.23 0.00 0.00 -1.72 0.00 0.00 55.73 56.11 1wsp s ARG 771 Cb -0.17 -3.07 0.00 0.00 -0.45 0.00 0.00 34.95 31.26 1wsp s ARG 771 CO 0.04 -0.20 0.00 0.41 -0.68 0.00 0.00 175.30 174.87 1wsp n GLY 772 N 0.84 1.16 0.09 -3.53 0.00 0.40 -4.84 105.19 99.31 1wsp n GLY 772 Ca 0.00 -2.27 -0.19 0.00 0.00 0.00 0.00 46.02 43.56 1wsp n GLY 772 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1wsp h ARG 773 N 0.00 0.02 -4.56 1.61 1.12 -1.90 -3.28 114.38 107.40 1wsp h ARG 773 Ca 0.00 -0.03 -0.21 0.00 -1.11 0.00 0.00 59.98 58.63 1wsp h ARG 773 Cb 0.00 0.01 -0.16 0.00 -0.01 0.00 0.00 29.97 29.81 1wsp h ARG 773 CO 0.00 1.01 -0.70 0.00 -3.11 0.00 0.00 179.97 177.18 1wsp s ALA 774 N -2.31 0.83 -0.02 2.80 0.00 -1.26 -4.80 121.76 117.00 1wsp s ALA 774 Ca -0.24 -1.24 0.07 0.00 0.00 0.00 0.00 51.96 50.55 1wsp s ALA 774 Cb 0.02 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 1wsp s ALA 774 CO 0.64 -0.23 -0.24 0.08 0.00 0.00 0.00 175.76 176.01 1wsp s VAL 775 N -3.37 1.87 0.25 0.00 1.01 -1.26 -5.06 120.40 113.84 1wsp s VAL 775 Ca 0.08 -1.02 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1wsp s VAL 775 Cb 0.04 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.83 1wsp s VAL 775 CO -0.05 0.52 0.37 0.42 0.00 0.00 0.00 175.10 176.37 1wsp s THR 776 N -0.56 5.23 0.26 3.92 -4.23 -1.26 -0.79 115.64 118.20 1wsp s THR 776 Ca 0.09 -0.96 -0.03 0.00 -1.18 0.00 0.00 61.69 59.62 1wsp s THR 776 Cb -0.09 -3.85 0.24 0.00 1.34 0.00 0.00 72.50 70.14 1wsp s THR 776 CO -0.01 -0.34 1.83 0.25 -0.54 0.00 0.00 174.62 175.81 1wsp h LEU 777 N 1.14 0.79 -1.34 4.79 5.85 -1.30 -0.90 115.31 124.33 1wsp h LEU 777 Ca -0.52 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.18 1wsp h LEU 777 Cb 1.23 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 1wsp h LEU 777 CO 0.61 0.45 -0.27 1.23 -0.34 0.00 0.00 178.44 180.12 1wsp h GLY 778 N 0.90 0.10 0.87 3.75 0.00 -1.65 0.18 103.07 107.21 1wsp h GLY 778 Ca 0.43 -0.07 -0.12 0.00 0.00 0.00 0.00 47.33 47.56 1wsp h GLY 778 CO -0.24 0.07 -0.38 -1.61 0.00 0.00 0.00 176.54 174.38 1wsp h GLN 779 N 0.09 0.53 -0.56 4.80 4.15 -1.60 -2.99 115.11 119.53 1wsp h GLN 779 Ca 0.01 -0.36 0.04 0.00 0.77 0.00 0.00 58.65 59.10 1wsp h GLN 779 Cb 0.52 0.05 -0.03 0.00 0.21 0.00 0.00 27.48 28.24 1wsp h GLN 779 CO 0.04 0.98 0.37 0.35 -1.93 0.00 0.00 178.83 178.64 1wsp h PHE 780 N 0.16 0.61 0.00 3.99 3.57 -0.58 -0.59 116.94 124.11 1wsp h PHE 780 Ca -0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1wsp h PHE 780 Cb 0.99 -0.20 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 1wsp h PHE 780 CO 0.10 0.36 -0.06 0.87 -2.23 0.00 0.00 178.31 177.34 1wsp h LYS 781 N 0.63 0.00 0.00 1.11 1.57 -0.53 -2.44 116.57 116.91 1wsp h LYS 781 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1wsp h LYS 781 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.42 1wsp h LYS 781 CO -0.06 0.06 0.00 0.39 -0.57 0.00 0.00 179.45 179.27 1wsp n GLU 782 N -3.19 0.24 0.19 3.15 1.02 -0.23 -2.91 120.64 118.91 1wsp n GLU 782 Ca 0.01 0.21 0.09 0.00 -0.02 0.00 0.00 57.16 57.45 1wsp n GLU 782 Cb 0.35 -1.79 0.11 0.00 -0.02 0.00 0.00 31.44 30.09 1wsp n GLU 782 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1wsp h LEU 783 N 0.00 0.00 -9.82 -4.62 4.07 -1.46 -3.46 115.31 100.02 1wsp h LEU 783 Ca 0.00 0.00 -0.50 0.00 0.08 0.00 0.00 57.88 57.46 1wsp h LEU 783 Cb 0.71 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.46 1wsp h LEU 783 CO 0.00 0.13 0.44 -0.76 -1.08 0.00 0.00 178.44 177.17 1wsp s LEU 784 N -6.17 4.50 -0.05 1.67 1.43 -1.15 -4.97 118.68 113.94 1wsp s LEU 784 Ca 0.05 2.17 0.16 0.00 -1.03 0.00 0.00 54.13 55.49 1wsp s LEU 784 Cb 0.06 -3.72 -0.25 0.00 0.03 0.00 0.00 46.19 42.31 1wsp s LEU 784 CO 0.70 -0.14 0.30 0.35 0.23 0.00 0.00 176.35 177.79 1wsp n THR 785 N 1.03 0.25 -3.85 5.49 -2.24 -1.26 -4.97 114.28 108.74 1wsp n THR 785 Ca -0.00 -0.45 -0.35 0.00 -2.27 0.00 0.00 64.05 60.97 1wsp n THR 785 Cb 0.46 -0.05 -0.08 0.00 -2.10 0.00 0.00 70.33 68.56 1wsp n THR 785 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1wsp s LYS 786 N -3.00 3.98 0.69 -0.78 -0.14 -1.26 -5.09 119.74 114.14 1wsp s LYS 786 Ca -0.07 -0.24 -0.12 0.00 -1.36 0.00 0.00 55.97 54.18 1wsp s LYS 786 Cb 0.09 -3.31 0.01 0.00 -1.68 0.00 0.00 37.83 32.94 1wsp s LYS 786 CO 0.69 0.38 1.06 0.15 -0.76 0.00 0.00 175.35 176.88 1wsp s LYS 787 N 0.11 2.92 0.00 1.68 1.02 -1.26 -5.00 119.74 119.20 1wsp s LYS 787 Ca 0.08 1.03 0.00 0.00 0.02 0.00 0.00 55.97 57.10 1wsp s LYS 787 Cb -0.12 -1.99 0.00 0.00 -0.52 0.00 0.00 37.83 35.21 1wsp s LYS 787 CO -0.00 -1.12 0.00 0.41 -0.92 0.00 0.00 175.35 173.72 1wsp n GLY 788 N -1.71 0.88 3.69 -3.33 0.00 -1.26 -5.06 105.19 98.40 1wsp n GLY 788 Ca 0.08 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.69 1wsp n GLY 788 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wsp s SER 789 N -2.14 6.44 0.06 1.61 0.15 -1.26 -5.08 113.70 113.47 1wsp s SER 789 Ca 0.00 0.52 0.00 0.00 0.70 0.00 0.00 55.95 57.17 1wsp s SER 789 Cb 0.00 -2.22 -0.04 0.00 -1.71 0.00 0.00 66.02 62.06 1wsp s SER 789 CO 0.00 -0.02 -0.05 -0.31 1.20 0.00 0.00 173.24 174.07 1wsp s TYR 790 N 1.03 0.59 0.17 3.44 1.51 -1.26 -1.71 117.35 121.13 1wsp s TYR 790 Ca 0.18 -0.87 0.07 0.00 -1.01 0.00 0.00 57.07 55.44 1wsp s TYR 790 Cb -0.14 -0.39 -0.04 0.00 -0.11 0.00 0.00 41.96 41.28 1wsp s TYR 790 CO 0.07 -0.25 0.02 1.03 -1.11 0.00 0.00 175.55 175.30 1wsp s ARG 791 N -3.20 2.46 -0.06 -0.62 0.52 -0.39 -4.91 118.95 112.75 1wsp s ARG 791 Ca 0.02 -1.08 0.02 0.00 -0.52 0.00 0.00 55.73 54.17 1wsp s ARG 791 Cb 0.02 -2.39 0.01 0.00 0.52 0.00 0.00 34.95 33.11 1wsp s ARG 791 CO -0.06 0.46 -0.11 0.71 0.02 0.00 0.00 175.30 176.32 1wsp s TYR 792 N -1.74 1.35 0.11 -0.53 2.02 -1.26 -2.05 117.35 115.25 1wsp s TYR 792 Ca 0.28 -0.49 0.07 0.00 -0.37 0.00 0.00 57.07 56.56 1wsp s TYR 792 Cb -0.09 -1.01 -0.03 0.00 -0.40 0.00 0.00 41.96 40.42 1wsp s TYR 792 CO 0.19 -0.27 -0.18 0.71 -1.57 0.00 0.00 175.55 174.44 1wsp s TYR 793 N 0.72 1.60 -0.02 2.71 1.51 -0.39 -1.02 117.35 122.45 1wsp s TYR 793 Ca -0.14 -0.46 -0.00 0.00 -1.01 0.00 0.00 57.07 55.46 1wsp s TYR 793 Cb -0.16 -0.86 0.03 0.00 -0.11 0.00 0.00 41.96 40.86 1wsp s TYR 793 CO 0.03 0.18 0.03 -0.06 -1.11 0.00 0.00 175.55 174.62 1wsp s PHE 794 N -1.47 0.08 0.51 2.71 0.08 -0.40 0.71 117.98 120.19 1wsp s PHE 794 Ca 0.06 0.12 -0.22 0.00 0.12 0.00 0.00 56.93 57.00 1wsp s PHE 794 Cb -0.09 -0.28 -0.07 0.00 -0.57 0.00 0.00 43.02 42.01 1wsp s PHE 794 CO 0.04 -0.10 1.18 1.63 -0.10 0.00 0.00 175.22 177.87 1wsp n LYS 795 N 4.25 1.50 -3.54 0.44 5.02 -0.62 -1.42 118.16 123.77 1wsp n LYS 795 Ca -0.26 0.55 -0.10 0.00 -2.02 0.00 0.00 58.31 56.48 1wsp n LYS 795 Cb 0.50 -2.34 -0.04 0.00 -0.02 0.00 0.00 35.03 33.13 1wsp n LYS 795 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1wsp s LYS 796 N -2.54 0.70 0.35 1.97 2.20 -0.90 -4.20 119.74 117.33 1wsp s LYS 796 Ca 0.69 -0.05 -0.27 0.00 -0.36 0.00 0.00 55.97 55.98 1wsp s LYS 796 Cb -0.46 0.33 -0.09 0.00 -1.51 0.00 0.00 37.83 36.09 1wsp s LYS 796 CO 0.52 -0.26 1.16 0.14 -0.36 0.00 0.00 175.35 176.55 1wsp s VAL 797 N -2.02 3.24 0.22 4.02 -7.23 -1.26 -2.35 120.40 115.01 1wsp s VAL 797 Ca 0.01 1.13 0.05 0.00 -1.81 0.00 0.00 61.98 61.36 1wsp s VAL 797 Cb -0.01 -3.68 -0.05 0.00 0.56 0.00 0.00 36.38 33.21 1wsp s VAL 797 CO -0.03 0.19 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.35 1wsp s SER 798 N -0.97 2.07 -0.30 4.85 0.15 -1.23 -4.80 113.70 113.46 1wsp s SER 798 Ca 0.51 -1.15 0.09 0.00 0.70 0.00 0.00 55.95 56.11 1wsp s SER 798 Cb -0.32 -0.04 0.54 0.00 -1.71 0.00 0.00 66.02 64.49 1wsp s SER 798 CO 0.41 -0.41 1.54 0.47 1.20 0.00 0.00 173.24 176.45 1wsp n ASP 799 N -0.40 2.85 -4.83 5.45 9.92 -1.26 -4.81 116.55 123.47 1wsp n ASP 799 Ca -0.07 -3.67 -0.29 0.00 -0.53 0.00 0.00 54.79 50.24 1wsp n ASP 799 Cb 0.63 -0.66 -0.04 0.00 -0.64 0.00 0.00 41.12 40.41 1wsp n ASP 799 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1wsp s GLU 800 N -3.21 2.23 0.00 -1.24 -1.05 -1.26 -5.16 118.70 109.01 1wsp s GLU 800 Ca 0.46 -2.19 0.00 0.00 -0.15 0.00 0.00 54.97 53.10 1wsp s GLU 800 Cb 0.41 -1.83 0.00 0.00 -0.44 0.00 0.00 34.13 32.27 1wsp s GLU 800 CO 0.03 -0.47 0.00 1.97 0.95 0.00 0.00 175.26 177.73 1wsp n PHE 801 N -1.51 0.00 0.00 4.83 -1.74 -1.26 -4.23 117.46 113.56 1wsp n PHE 801 Ca -0.10 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.79 1wsp n PHE 801 Cb 0.66 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.66 1wsp n PHE 801 CO 0.00 0.00 0.00 -0.40 -0.56 0.00 0.00 176.76 175.80 1wsp n ASP 802 N 0.00 0.00 -1.94 5.98 5.75 -1.26 -0.17 116.55 124.91 1wsp n ASP 802 Ca 0.00 0.00 -0.23 0.00 -0.01 0.00 0.00 54.79 54.55 1wsp n ASP 802 Cb 0.00 0.00 0.12 0.00 -1.03 0.00 0.00 41.12 40.21 1wsp n ASP 802 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1wsp n GLY 804 N -0.98 2.21 3.03 0.00 0.00 0.77 -4.83 105.19 105.39 1wsp n GLY 804 Ca 0.51 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.44 1wsp n GLY 804 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wsp s VAL 805 N 0.00 0.15 0.39 1.61 1.01 -1.26 -3.57 120.40 118.73 1wsp s VAL 805 Ca 0.00 -1.23 0.08 0.00 0.00 0.00 0.00 61.98 60.83 1wsp s VAL 805 Cb 0.00 -0.75 -0.07 0.00 0.00 0.00 0.00 36.38 35.56 1wsp s VAL 805 CO 0.00 -0.68 0.04 0.68 0.00 0.00 0.00 175.10 175.15 1wsp s VAL 806 N -2.41 2.22 -0.47 2.92 -7.23 -0.99 -4.93 120.40 109.51 1wsp s VAL 806 Ca -0.07 -1.94 -0.09 0.00 -1.81 0.00 0.00 61.98 58.07 1wsp s VAL 806 Cb -0.03 -2.92 0.12 0.00 0.56 0.00 0.00 36.38 34.11 1wsp s VAL 806 CO -0.04 -0.06 0.34 -0.36 -0.31 0.00 0.00 175.10 174.67 1wsp s PHE 807 N -2.63 3.43 -0.03 2.82 0.40 -1.26 -2.11 117.98 118.60 1wsp s PHE 807 Ca 0.36 -1.88 -0.30 0.00 -0.60 0.00 0.00 56.93 54.51 1wsp s PHE 807 Cb 0.06 -3.50 -0.05 0.00 0.51 0.00 0.00 43.02 40.04 1wsp s PHE 807 CO 0.19 -1.00 1.34 -1.21 0.70 0.00 0.00 175.22 175.24 1wsp s GLU 808 N 1.36 4.30 -0.06 0.44 0.41 -0.51 -4.64 118.70 120.01 1wsp s GLU 808 Ca 0.06 1.86 -0.30 0.00 -0.41 0.00 0.00 54.97 56.18 1wsp s GLU 808 Cb -0.26 -3.59 -0.02 0.00 -1.78 0.00 0.00 34.13 28.48 1wsp s GLU 808 CO -0.01 -0.55 1.01 -2.00 -0.49 0.00 0.00 175.26 173.22 1wsp s GLU 809 N 2.43 4.48 0.00 1.61 2.12 -1.26 -1.28 118.70 126.81 1wsp s GLU 809 Ca 0.61 1.43 0.08 0.00 0.36 0.00 0.00 54.97 57.45 1wsp s GLU 809 Cb -0.29 -3.50 -0.02 0.00 0.26 0.00 0.00 34.13 30.57 1wsp s GLU 809 CO 0.24 -0.21 -0.24 0.08 -0.54 0.00 0.00 175.26 174.59 1wsp s VAL 810 N 1.58 2.24 0.00 3.70 1.01 -0.19 -5.00 120.40 123.74 1wsp s VAL 810 Ca 0.50 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 61.32 1wsp s VAL 810 Cb -0.20 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.35 1wsp s VAL 810 CO 0.23 0.50 0.00 0.54 0.00 0.00 0.00 175.10 176.36 1wsp n ARG 811 N 2.16 1.32 0.34 2.72 1.74 -1.26 -4.14 116.66 119.53 1wsp n ARG 811 Ca -0.16 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.76 1wsp n ARG 811 Cb 0.51 -0.56 -0.08 0.00 -1.02 0.00 0.00 32.46 31.32 1wsp n ARG 811 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1wsp h GLU 812 N 0.00 -0.90 0.00 5.56 3.07 -1.95 -3.47 114.58 116.90 1wsp h GLU 812 Ca 0.00 0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1wsp h GLU 812 Cb 0.10 0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1wsp h GLU 812 CO 0.00 -0.60 0.00 -0.40 -1.40 0.00 0.00 179.01 176.61 1wsp n ASP 813 N -4.78 0.00 -0.03 1.42 3.85 -1.26 -4.69 116.55 111.06 1wsp n ASP 813 Ca -0.11 0.00 0.13 0.00 -0.71 0.00 0.00 54.79 54.10 1wsp n ASP 813 Cb 0.39 0.00 0.41 0.00 -1.35 0.00 0.00 41.12 40.57 1wsp n ASP 813 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1wsp n GLU 814 N -2.00 0.14 -2.66 0.11 -0.58 -1.26 -1.88 120.64 112.51 1wsp n GLU 814 Ca 0.00 -0.06 -0.37 0.00 -0.42 0.00 0.00 57.16 56.31 1wsp n GLU 814 Cb 0.00 -1.50 -0.05 0.00 -0.57 0.00 0.00 31.44 29.32 1wsp n GLU 814 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1wsp s ALA 815 N -2.90 3.16 -0.18 0.62 0.00 -1.26 -4.88 121.76 116.32 1wsp s ALA 815 Ca 0.15 0.62 -0.20 0.00 0.00 0.00 0.00 51.96 52.53 1wsp s ALA 815 Cb 0.18 -3.23 -0.03 0.00 0.00 0.00 0.00 23.12 20.05 1wsp s ALA 815 CO 0.61 -0.02 0.59 0.42 0.00 0.00 0.00 175.76 177.37 1wsp s ILE 816 N -1.64 5.06 0.37 0.00 1.01 -1.26 -1.36 121.20 123.38 1wsp s ILE 816 Ca 0.54 1.13 -0.27 0.00 0.00 0.00 0.00 60.65 62.05 1wsp s ILE 816 Cb -0.20 -3.92 -0.09 0.00 0.01 0.00 0.00 42.46 38.26 1wsp s ILE 816 CO 0.26 0.15 1.22 -0.76 0.00 0.00 0.00 174.94 175.81 1wsp s LEU 817 N 1.66 4.31 0.75 2.97 1.43 0.03 -4.95 118.68 124.88 1wsp s LEU 817 Ca 0.28 2.49 -0.13 0.00 -1.03 0.00 0.00 54.13 55.74 1wsp s LEU 817 Cb -0.16 -3.85 0.05 0.00 0.03 0.00 0.00 46.19 42.27 1wsp s LEU 817 CO 0.11 -0.60 1.13 -2.84 0.23 0.00 0.00 176.35 174.38 1wsp s PRO 818 N -2.03 2.22 -0.19 1.29 0.02 -1.26 -4.77 135.00 130.28 1wsp s PRO 818 Ca 0.53 1.41 -0.02 0.00 0.02 0.00 0.00 61.00 62.94 1wsp s PRO 818 Cb -0.35 -1.88 -0.01 0.00 0.02 0.00 0.00 34.50 32.29 1wsp s PRO 818 CO 0.45 -1.70 -0.09 0.08 -0.33 0.00 0.00 177.00 175.41 1wsp s VAL 819 N -2.50 3.13 -0.18 3.83 1.01 -1.26 -4.67 120.40 119.75 1wsp s VAL 819 Ca 0.66 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.99 1wsp s VAL 819 Cb -0.21 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1wsp s VAL 819 CO 0.49 0.47 0.04 0.12 0.00 0.00 0.00 175.10 176.22 1wsp s PHE 820 N 1.09 3.17 -0.73 5.22 5.36 0.26 -4.54 117.98 127.81 1wsp s PHE 820 Ca 0.01 -0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 55.79 1wsp s PHE 820 Cb -0.15 -2.07 0.01 0.00 -0.34 0.00 0.00 43.02 40.48 1wsp s PHE 820 CO -0.02 0.03 0.18 -0.85 -1.46 0.00 0.00 175.22 173.11 1wsp n GLU 821 N 3.74 -0.78 0.00 10.12 0.28 -1.26 -0.23 120.64 132.51 1wsp n GLU 821 Ca -0.17 -0.09 0.00 0.00 -0.16 0.00 0.00 57.16 56.74 1wsp n GLU 821 Cb 0.52 -1.34 0.00 0.00 1.43 0.00 0.00 31.44 32.05 1wsp n GLU 821 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1wsp n GLU 822 N -3.02 0.00 -4.12 3.44 4.71 -1.26 -4.98 120.64 115.41 1wsp n GLU 822 Ca -0.11 0.00 -0.23 0.00 -0.01 0.00 0.00 57.16 56.80 1wsp n GLU 822 Cb 0.33 -1.14 -0.07 0.00 -1.01 0.00 0.00 31.44 29.55 1wsp n GLU 822 CO 0.00 0.00 0.00 -1.59 0.09 0.00 0.00 177.13 175.63 1wsp s LYS 823 N -0.11 2.34 -0.38 3.49 -2.85 0.68 -4.62 119.74 118.31 1wsp s LYS 823 Ca 0.00 -1.58 -0.12 0.00 -1.00 0.00 0.00 55.97 53.28 1wsp s LYS 823 Cb 0.00 -2.15 0.02 0.00 -2.06 0.00 0.00 37.83 33.65 1wsp s LYS 823 CO 0.00 0.10 0.22 0.42 0.10 0.00 0.00 175.35 176.19 1wsp s ILE 824 N -2.44 4.72 -0.39 3.79 1.01 -0.27 0.92 121.20 128.54 1wsp s ILE 824 Ca 0.38 -0.78 -0.09 0.00 0.00 0.00 0.00 60.65 60.16 1wsp s ILE 824 Cb -0.02 -3.61 0.06 0.00 0.01 0.00 0.00 42.46 38.89 1wsp s ILE 824 CO 0.22 -0.22 0.21 -0.63 0.00 0.00 0.00 174.94 174.52 1wsp s ILE 825 N 1.58 4.20 0.08 2.92 1.01 -1.26 -1.17 121.20 128.57 1wsp s ILE 825 Ca 0.03 -1.21 0.04 0.00 0.00 0.00 0.00 60.65 59.51 1wsp s ILE 825 Cb -0.19 -3.47 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1wsp s ILE 825 CO 0.07 -0.36 0.01 -0.83 0.00 0.00 0.00 174.94 173.83 1wsp s GLY 826 N 1.80 1.93 -0.20 6.18 0.00 0.20 -1.59 107.32 115.63 1wsp s GLY 826 Ca 0.02 -1.09 -0.03 0.00 0.00 0.00 0.00 44.72 43.62 1wsp s GLY 826 CO 0.03 -1.07 -0.08 0.54 0.00 0.00 0.00 173.10 172.53 1wsp s LYS 827 N -2.28 3.33 -0.24 2.90 1.02 0.22 -0.51 119.74 124.19 1wsp s LYS 827 Ca 0.26 -0.66 -0.05 0.00 0.02 0.00 0.00 55.97 55.54 1wsp s LYS 827 Cb -0.12 -2.88 -0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1wsp s LYS 827 CO 0.18 -0.12 -0.00 0.08 -0.92 0.00 0.00 175.35 174.58 1wsp s VAL 828 N 1.23 3.67 -0.13 3.17 1.01 -0.02 -1.26 120.40 128.07 1wsp s VAL 828 Ca 0.03 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1wsp s VAL 828 Cb -0.14 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.53 1wsp s VAL 828 CO -0.03 0.36 -0.21 -1.61 0.00 0.00 0.00 175.10 173.62 1wsp s GLU 829 N 1.51 3.09 0.22 2.72 0.41 -0.87 -0.16 118.70 125.62 1wsp s GLU 829 Ca 0.06 -0.83 -0.30 0.00 -0.41 0.00 0.00 54.97 53.49 1wsp s GLU 829 Cb -0.15 -2.45 -0.09 0.00 -1.78 0.00 0.00 34.13 29.66 1wsp s GLU 829 CO -0.01 0.05 1.28 0.21 -0.49 0.00 0.00 175.26 176.30 1wsp s LYS 830 N 0.68 4.42 -0.34 1.61 2.36 -1.26 -1.26 119.74 125.94 1wsp s LYS 830 Ca -0.10 2.03 -0.29 0.00 -2.55 0.00 0.00 55.97 55.06 1wsp s LYS 830 Cb -0.16 -3.18 0.01 0.00 -1.05 0.00 0.00 37.83 33.45 1wsp s LYS 830 CO 0.01 -0.18 1.20 0.54 1.55 0.00 0.00 175.35 178.47 1wsp s VAL 831 N -0.18 4.27 -2.68 4.02 0.11 -0.69 -4.91 120.40 120.33 1wsp s VAL 831 Ca 0.54 1.42 0.21 0.00 -2.93 0.00 0.00 61.98 61.23 1wsp s VAL 831 Cb -0.36 -4.33 0.17 0.00 -1.53 0.00 0.00 36.38 30.33 1wsp s VAL 831 CO 0.40 -0.58 1.18 0.47 -3.33 0.00 0.00 175.10 173.24