#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 4.99 0.00 -3.51 0.00 3.85 -1.26 -4.99 116.55 115.63 1wsp n ASP 751 Ca -0.00 -1.00 -0.09 0.00 -0.71 0.00 0.00 54.79 52.99 1wsp n ASP 751 Cb 0.50 0.00 -0.02 0.00 -1.35 0.00 0.00 41.12 40.24 1wsp n ASP 751 CO 0.00 0.00 0.00 -0.94 -1.01 0.00 0.00 177.20 175.25 1wsp s SER 752 N 0.00 -0.38 0.03 -1.12 1.04 -0.87 0.09 113.70 112.49 1wsp s SER 752 Ca 0.00 0.05 0.09 0.00 0.48 0.00 0.00 55.95 56.57 1wsp s SER 752 Cb 0.00 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.48 1wsp s SER 752 CO 0.00 -0.61 -0.25 -0.51 0.98 0.00 0.00 173.24 172.85 1wsp s ILE 753 N -2.92 2.02 -0.11 -1.02 1.10 0.29 -4.84 121.20 115.73 1wsp s ILE 753 Ca 0.04 -1.28 -0.28 0.00 -0.51 0.00 0.00 60.65 58.62 1wsp s ILE 753 Cb -0.01 -1.72 -0.02 0.00 0.15 0.00 0.00 42.46 40.87 1wsp s ILE 753 CO -0.08 0.39 0.93 -0.69 -2.11 0.00 0.00 174.94 173.38 1wsp s VAL 754 N -0.75 4.84 -0.24 4.00 1.01 -1.26 0.22 120.40 128.21 1wsp s VAL 754 Ca 0.11 1.89 0.02 0.00 0.00 0.00 0.00 61.98 64.00 1wsp s VAL 754 Cb -0.10 -4.25 0.06 0.00 0.00 0.00 0.00 36.38 32.09 1wsp s VAL 754 CO 0.01 0.05 -0.09 -0.69 0.00 0.00 0.00 175.10 174.38 1wsp s VAL 755 N 1.85 1.88 -0.07 2.92 1.01 0.93 -1.00 120.40 127.92 1wsp s VAL 755 Ca 0.45 -1.40 0.05 0.00 0.00 0.00 0.00 61.98 61.08 1wsp s VAL 755 Cb -0.18 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.15 1wsp s VAL 755 CO 0.17 -0.02 -0.22 0.00 0.00 0.00 0.00 175.10 175.04 1wsp s ALA 756 N 1.24 2.30 0.01 5.51 0.00 -0.27 -1.02 121.76 129.54 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 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 1wsp s ALA 756 CO -0.06 0.41 -0.10 1.52 0.00 0.00 0.00 175.76 177.53 1wsp s TYR 757 N -0.17 0.87 -0.01 0.00 -0.85 -0.74 -0.58 117.35 115.87 1wsp s TYR 757 Ca -0.03 -0.24 -0.28 0.00 -0.52 0.00 0.00 57.07 56.00 1wsp s TYR 757 Cb -0.14 -0.54 -0.03 0.00 0.38 0.00 0.00 41.96 41.63 1wsp s TYR 757 CO 0.04 -0.01 0.89 0.71 -1.52 0.00 0.00 175.55 175.65 1wsp s TYR 758 N -0.52 3.65 -0.24 -3.49 2.02 0.35 -0.96 117.35 118.15 1wsp s TYR 758 Ca 0.01 1.56 -0.04 0.00 -0.37 0.00 0.00 57.07 58.23 1wsp s TYR 758 Cb -0.05 -3.01 0.01 0.00 -0.40 0.00 0.00 41.96 38.50 1wsp s TYR 758 CO 0.00 0.04 -0.03 0.12 -1.57 0.00 0.00 175.55 174.11 1wsp s PHE 759 N 0.85 3.02 -0.88 2.71 2.19 -1.26 -0.91 117.98 123.70 1wsp s PHE 759 Ca 0.47 -1.14 -0.17 0.00 0.33 0.00 0.00 56.93 56.42 1wsp s PHE 759 Cb -0.20 -2.11 0.02 0.00 -1.31 0.00 0.00 43.02 39.42 1wsp s PHE 759 CO 0.25 -0.61 0.32 0.00 1.83 0.00 0.00 175.22 177.01 1wsp n GLY 761 N -1.83 1.88 2.14 0.00 0.00 -1.26 -4.93 105.19 101.19 1wsp n GLY 761 Ca -0.12 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.51 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 0.00 0.00 0.00 1.61 1.02 -0.99 -4.82 120.64 117.47 1wsp n GLU 762 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1wsp n GLU 762 Cb 0.00 -0.89 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 1wsp n GLU 762 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1wsp n PRO 763 N 3.04 0.00 -1.39 3.49 -0.04 -1.26 -4.15 135.00 134.69 1wsp n PRO 763 Ca 0.23 0.46 -0.53 0.00 -0.04 0.00 0.00 63.50 63.62 1wsp n PRO 763 Cb -0.03 -1.36 -0.09 0.00 -0.04 0.00 0.00 33.50 31.98 1wsp n PRO 763 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wsp n ILE 764 N -1.75 0.12 -1.68 0.52 5.41 -1.26 -4.81 119.36 115.90 1wsp n ILE 764 Ca 0.00 -0.19 -0.33 0.00 1.00 0.00 0.00 62.75 63.24 1wsp n ILE 764 Cb 0.00 -1.31 0.05 0.00 -0.71 0.00 0.00 39.64 37.67 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 6.26 2.76 -0.17 0.38 0.04 -1.26 -4.79 135.00 138.22 1wsp s PRO 765 Ca 1.13 1.31 -0.12 0.00 0.04 0.00 0.00 61.00 63.36 1wsp s PRO 765 Cb -1.04 -1.95 -0.05 0.00 0.04 0.00 0.00 34.50 31.50 1wsp s PRO 765 CO 0.53 -1.27 0.21 0.71 0.04 0.00 0.00 177.00 177.23 1wsp s TYR 766 N -2.49 3.45 -0.10 0.56 1.51 -0.14 -4.90 117.35 115.24 1wsp s TYR 766 Ca 0.65 0.48 0.00 0.00 -1.01 0.00 0.00 57.07 57.19 1wsp s TYR 766 Cb -0.19 -2.24 -0.02 0.00 -0.11 0.00 0.00 41.96 39.40 1wsp s TYR 766 CO 0.44 0.29 -0.11 0.50 -1.11 0.00 0.00 175.55 175.57 1wsp s ARG 767 N 0.32 3.08 0.09 -0.62 3.00 -1.26 -1.80 118.95 121.75 1wsp s ARG 767 Ca 0.13 -0.64 -0.13 0.00 -1.00 0.00 0.00 55.73 54.09 1wsp s ARG 767 Cb -0.12 -2.60 0.02 0.00 0.00 0.00 0.00 34.95 32.25 1wsp s ARG 767 CO 0.01 0.41 0.30 -0.08 0.00 0.00 0.00 175.30 175.94 1wsp s THR 768 N -0.15 0.10 -0.10 4.11 -1.32 -0.19 -5.00 115.64 113.08 1wsp s THR 768 Ca 0.00 -0.82 -0.04 0.00 -1.21 0.00 0.00 61.69 59.62 1wsp s THR 768 Cb -0.13 -1.16 -0.04 0.00 -1.51 0.00 0.00 72.50 69.66 1wsp s THR 768 CO 0.03 -0.45 0.04 -0.76 -2.21 0.00 0.00 174.62 171.26 1wsp s LEU 769 N -2.60 3.77 -0.12 9.08 1.02 -1.26 -0.05 118.68 128.52 1wsp s LEU 769 Ca 0.01 0.20 0.03 0.00 0.02 0.00 0.00 54.13 54.39 1wsp s LEU 769 Cb 0.02 -1.89 0.00 0.00 0.02 0.00 0.00 46.19 44.35 1wsp s LEU 769 CO -0.09 0.36 -0.21 -0.69 0.02 0.00 0.00 176.35 175.74 1wsp s VAL 770 N -0.75 2.25 0.17 -1.59 1.01 0.13 -4.92 120.40 116.70 1wsp s VAL 770 Ca 0.12 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 60.86 1wsp s VAL 770 Cb -0.12 -1.89 -0.08 0.00 0.00 0.00 0.00 36.38 34.29 1wsp s VAL 770 CO 0.02 0.55 1.26 -0.13 0.00 0.00 0.00 175.10 176.80 1wsp s ARG 771 N 0.54 4.43 0.00 2.72 1.81 -1.26 0.11 118.95 127.29 1wsp s ARG 771 Ca -0.13 1.95 0.00 0.00 -1.72 0.00 0.00 55.73 55.83 1wsp s ARG 771 Cb -0.17 -3.24 0.00 0.00 -0.45 0.00 0.00 34.95 31.09 1wsp s ARG 771 CO 0.04 -0.21 0.00 0.41 -0.68 0.00 0.00 175.30 174.87 1wsp n GLY 772 N 2.53 0.56 0.20 -3.53 0.00 0.11 -4.86 105.19 100.21 1wsp n GLY 772 Ca 0.06 -2.15 -0.18 0.00 0.00 0.00 0.00 46.02 43.74 1wsp n GLY 772 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1wsp n ARG 773 N -0.14 0.50 -4.26 1.61 0.00 -1.26 -2.05 116.66 111.06 1wsp n ARG 773 Ca 0.00 0.16 -0.20 0.00 -0.00 0.00 0.00 57.85 57.81 1wsp n ARG 773 Cb 0.00 -1.36 -0.12 0.00 0.00 0.00 0.00 32.46 30.99 1wsp n ARG 773 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1wsp s ALA 774 N -2.41 1.61 -0.02 5.13 0.00 -1.26 -4.82 121.76 119.99 1wsp s ALA 774 Ca -0.29 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.47 1wsp s ALA 774 Cb 0.09 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1wsp s ALA 774 CO 0.44 0.20 -0.24 0.08 0.00 0.00 0.00 175.76 176.24 1wsp s VAL 775 N -1.73 1.87 0.28 0.00 1.01 -1.26 -5.06 120.40 115.51 1wsp s VAL 775 Ca 0.08 -1.01 0.03 0.00 0.00 0.00 0.00 61.98 61.08 1wsp s VAL 775 Cb -0.07 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.72 1wsp s VAL 775 CO 0.04 0.53 0.43 0.42 0.00 0.00 0.00 175.10 176.52 1wsp s THR 776 N -0.51 5.15 0.25 3.92 -4.23 -1.26 -0.74 115.64 118.22 1wsp s THR 776 Ca 0.08 -0.80 -0.03 0.00 -1.18 0.00 0.00 61.69 59.76 1wsp s THR 776 Cb -0.10 -3.84 0.23 0.00 1.34 0.00 0.00 72.50 70.13 1wsp s THR 776 CO -0.00 -0.40 1.81 0.25 -0.54 0.00 0.00 174.62 175.73 1wsp h LEU 777 N 1.01 0.69 -1.45 4.79 5.85 -1.04 -0.81 115.31 124.35 1wsp h LEU 777 Ca -0.51 0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.21 1wsp h LEU 777 Cb 1.23 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 1wsp h LEU 777 CO 0.61 0.38 -0.28 1.23 -0.34 0.00 0.00 178.44 180.04 1wsp h GLY 778 N 0.80 0.00 0.96 3.75 0.00 -1.10 0.16 103.07 107.64 1wsp h GLY 778 Ca 0.42 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.58 1wsp h GLY 778 CO -0.27 0.00 -0.64 -1.61 0.00 0.00 0.00 176.54 174.02 1wsp h GLN 779 N 0.00 0.58 -0.58 4.80 4.15 -1.54 -3.02 115.11 119.50 1wsp h GLN 779 Ca -0.00 -0.52 0.03 0.00 0.77 0.00 0.00 58.65 58.93 1wsp h GLN 779 Cb 0.49 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.27 1wsp h GLN 779 CO 0.04 1.14 0.39 0.35 -1.93 0.00 0.00 178.83 178.81 1wsp h PHE 780 N 0.20 0.65 0.00 3.99 3.04 -0.54 -0.92 116.94 123.37 1wsp h PHE 780 Ca -0.06 0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.91 1wsp h PHE 780 Cb 1.30 -0.22 -0.00 0.00 2.56 0.00 0.00 35.95 39.59 1wsp h PHE 780 CO 0.11 0.38 -0.01 0.87 -2.02 0.00 0.00 178.31 177.65 1wsp h LYS 781 N 0.68 0.00 0.00 1.11 1.57 -0.59 -2.42 116.57 116.92 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 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 1wsp h LYS 781 CO -0.06 0.01 -0.01 0.39 -0.57 0.00 0.00 179.45 179.21 1wsp n GLU 782 N -3.10 0.26 0.20 3.15 1.02 -0.35 -2.93 120.64 118.89 1wsp n GLU 782 Ca 0.01 0.21 0.12 0.00 -0.02 0.00 0.00 57.16 57.48 1wsp n GLU 782 Cb 0.34 -1.81 0.14 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 -9.80 -4.62 3.38 -1.45 -3.46 115.31 99.37 1wsp h LEU 783 Ca 0.00 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.47 1wsp h LEU 783 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1wsp h LEU 783 CO 0.00 0.01 0.43 -0.76 0.09 0.00 0.00 178.44 178.21 1wsp s LEU 784 N -6.10 4.57 -0.05 1.67 1.43 -1.15 -4.97 118.68 114.08 1wsp s LEU 784 Ca 0.06 2.14 0.17 0.00 -1.03 0.00 0.00 54.13 55.47 1wsp s LEU 784 Cb 0.06 -3.65 -0.26 0.00 0.03 0.00 0.00 46.19 42.37 1wsp s LEU 784 CO 0.69 -0.05 0.32 0.35 0.23 0.00 0.00 176.35 177.89 1wsp n THR 785 N 1.23 0.20 -3.97 5.49 -2.24 -1.26 -4.96 114.28 108.76 1wsp n THR 785 Ca -0.01 -0.45 -0.35 0.00 -2.27 0.00 0.00 64.05 60.97 1wsp n THR 785 Cb 0.46 -0.02 -0.09 0.00 -2.10 0.00 0.00 70.33 68.58 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 -3.06 3.84 0.68 -0.78 1.02 -1.26 -5.09 119.74 115.09 1wsp s LYS 786 Ca -0.07 -0.29 -0.12 0.00 0.02 0.00 0.00 55.97 55.51 1wsp s LYS 786 Cb 0.10 -3.21 -0.00 0.00 -0.52 0.00 0.00 37.83 34.20 1wsp s LYS 786 CO 0.71 0.40 1.06 0.15 -0.92 0.00 0.00 175.35 176.75 1wsp s LYS 787 N 0.03 3.01 0.00 1.68 1.02 -1.26 -5.00 119.74 119.22 1wsp s LYS 787 Ca 0.07 1.00 0.00 0.00 0.02 0.00 0.00 55.97 57.05 1wsp s LYS 787 Cb -0.12 -2.00 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 1wsp s LYS 787 CO 0.00 -1.05 0.00 0.41 -0.92 0.00 0.00 175.35 173.80 1wsp n GLY 788 N -1.82 0.85 3.69 -3.33 0.00 -1.26 -5.06 105.19 98.27 1wsp n GLY 788 Ca 0.08 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 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 -2.75 6.36 0.05 1.61 0.15 -1.26 -5.08 113.70 112.79 1wsp s SER 789 Ca 0.00 0.42 0.00 0.00 0.70 0.00 0.00 55.95 57.07 1wsp s SER 789 Cb 0.00 -2.18 -0.03 0.00 -1.71 0.00 0.00 66.02 62.09 1wsp s SER 789 CO 0.00 0.02 -0.04 -0.31 1.20 0.00 0.00 173.24 174.11 1wsp s TYR 790 N 0.94 0.57 0.15 3.44 1.51 -1.26 -1.74 117.35 120.97 1wsp s TYR 790 Ca 0.15 -0.86 0.06 0.00 -1.01 0.00 0.00 57.07 55.42 1wsp s TYR 790 Cb -0.14 -0.38 -0.04 0.00 -0.11 0.00 0.00 41.96 41.29 1wsp s TYR 790 CO 0.05 -0.26 0.02 1.03 -1.11 0.00 0.00 175.55 175.29 1wsp s ARG 791 N -3.14 2.51 -0.07 -0.62 0.52 -0.34 -4.91 118.95 112.90 1wsp s ARG 791 Ca 0.02 -1.01 0.02 0.00 -0.52 0.00 0.00 55.73 54.23 1wsp s ARG 791 Cb 0.02 -2.44 0.01 0.00 0.52 0.00 0.00 34.95 33.06 1wsp s ARG 791 CO -0.06 0.48 -0.12 0.71 0.02 0.00 0.00 175.30 176.33 1wsp s TYR 792 N -1.64 1.45 0.12 -0.53 1.51 -1.26 -2.01 117.35 114.99 1wsp s TYR 792 Ca 0.28 -0.54 0.08 0.00 -1.01 0.00 0.00 57.07 55.87 1wsp s TYR 792 Cb -0.10 -1.07 -0.04 0.00 -0.11 0.00 0.00 41.96 40.64 1wsp s TYR 792 CO 0.19 -0.29 -0.19 0.71 -1.11 0.00 0.00 175.55 174.87 1wsp s TYR 793 N 0.72 1.69 -0.02 2.71 2.02 -0.39 -1.01 117.35 123.06 1wsp s TYR 793 Ca -0.14 -0.45 0.00 0.00 -0.37 0.00 0.00 57.07 56.12 1wsp s TYR 793 Cb -0.16 -0.90 0.03 0.00 -0.40 0.00 0.00 41.96 40.53 1wsp s TYR 793 CO 0.03 0.21 0.02 -0.06 -1.57 0.00 0.00 175.55 174.18 1wsp s PHE 794 N -1.48 0.12 0.57 2.71 0.08 -0.33 0.54 117.98 120.20 1wsp s PHE 794 Ca 0.08 0.09 -0.20 0.00 0.12 0.00 0.00 56.93 57.02 1wsp s PHE 794 Cb -0.08 -0.31 -0.05 0.00 -0.57 0.00 0.00 43.02 42.01 1wsp s PHE 794 CO 0.04 -0.11 1.19 1.17 -0.10 0.00 0.00 175.22 177.41 1wsp n LYS 795 N 4.23 1.29 0.00 0.44 4.81 -0.63 -1.34 118.16 126.97 1wsp n LYS 795 Ca -0.26 0.49 0.00 0.00 -0.87 0.00 0.00 58.31 57.66 1wsp n LYS 795 Cb 0.50 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 33.17 1wsp n LYS 795 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1wsp n LYS 796 N -1.08 0.00 -1.68 1.64 4.81 -0.91 -4.20 118.16 116.74 1wsp n LYS 796 Ca 0.12 0.00 -0.43 0.00 -0.87 0.00 0.00 58.31 57.13 1wsp n LYS 796 Cb 0.46 0.00 -0.01 0.00 0.02 0.00 0.00 35.03 35.49 1wsp n LYS 796 CO 0.00 0.00 0.00 1.33 1.17 0.00 0.00 177.40 179.90 1wsp n VAL 797 N 0.00 1.71 -4.00 3.15 0.24 -1.26 -2.55 118.33 115.62 1wsp n VAL 797 Ca 0.00 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.34 61.65 1wsp n VAL 797 Cb 0.00 -1.50 -0.05 0.00 -1.47 0.00 0.00 33.84 30.83 1wsp n VAL 797 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1wsp s SER 798 N -0.16 5.18 -0.23 -1.34 0.15 -1.26 -4.75 113.70 111.28 1wsp s SER 798 Ca 0.59 -0.49 0.13 0.00 0.70 0.00 0.00 55.95 56.89 1wsp s SER 798 Cb -0.60 -1.05 0.78 0.00 -1.71 0.00 0.00 66.02 63.45 1wsp s SER 798 CO 0.59 -0.21 1.69 0.47 1.20 0.00 0.00 173.24 176.98 1wsp n ASP 799 N -1.23 5.51 -2.09 5.45 8.00 -1.26 -4.87 116.55 126.07 1wsp n ASP 799 Ca -0.04 -2.90 0.00 0.00 0.71 0.00 0.00 54.79 52.56 1wsp n ASP 799 Cb 0.59 -0.68 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1wsp n ASP 799 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1wsp n GLU 800 N 0.57 1.71 0.00 -1.24 0.28 -1.26 -5.15 120.64 115.56 1wsp n GLU 800 Ca 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.27 1wsp n GLU 800 Cb 1.16 0.00 0.00 0.00 1.43 0.00 0.00 31.44 34.03 1wsp n GLU 800 CO 0.00 0.00 0.00 1.97 -0.16 0.00 0.00 177.13 178.94 1wsp n PHE 801 N 0.00 0.00 -1.20 -1.84 1.16 -1.26 -4.93 117.46 109.39 1wsp n PHE 801 Ca 0.00 0.00 -0.33 0.00 -1.87 0.00 0.00 57.45 55.25 1wsp n PHE 801 Cb 0.00 0.00 0.11 0.00 -1.61 0.00 0.00 39.48 37.98 1wsp n PHE 801 CO 0.00 0.00 0.00 0.16 -1.87 0.00 0.00 176.76 175.05 1wsp s ASP 802 N -0.43 3.89 0.00 5.98 3.84 -1.26 -1.43 116.67 127.26 1wsp s ASP 802 Ca 0.00 2.22 0.00 0.00 -0.00 0.00 0.00 52.55 54.77 1wsp s ASP 802 Cb 0.00 -2.57 0.00 0.00 -1.38 0.00 0.00 42.92 38.97 1wsp s ASP 802 CO 0.00 -2.46 0.00 0.00 -0.00 0.00 0.00 175.17 172.71 1wsp s GLY 804 N -1.08 1.96 0.43 0.00 0.00 -0.51 -4.99 107.32 103.12 1wsp s GLY 804 Ca 0.00 -1.51 0.04 0.00 0.00 0.00 0.00 44.72 43.25 1wsp s GLY 804 CO 0.00 0.81 0.04 0.14 0.00 0.00 0.00 173.10 174.09 1wsp s VAL 805 N 1.68 1.30 0.29 1.40 1.01 -1.26 -4.67 120.40 120.14 1wsp s VAL 805 Ca 0.05 -2.00 0.07 0.00 0.00 0.00 0.00 61.98 60.10 1wsp s VAL 805 Cb -0.18 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 1wsp s VAL 805 CO 0.09 0.00 0.30 0.68 0.00 0.00 0.00 175.10 176.17 1wsp s VAL 806 N -2.97 4.27 -0.57 2.92 -7.23 -1.06 -4.81 120.40 110.96 1wsp s VAL 806 Ca 0.23 -1.25 -0.15 0.00 -1.81 0.00 0.00 61.98 59.00 1wsp s VAL 806 Cb 0.05 -3.43 0.14 0.00 0.56 0.00 0.00 36.38 33.71 1wsp s VAL 806 CO 0.12 -0.26 0.52 -0.36 -0.31 0.00 0.00 175.10 174.80 1wsp s PHE 807 N -2.16 3.33 -0.01 2.82 0.40 -1.26 -2.14 117.98 118.95 1wsp s PHE 807 Ca 0.37 -1.44 -0.30 0.00 -0.60 0.00 0.00 56.93 54.96 1wsp s PHE 807 Cb -0.08 -3.77 -0.05 0.00 0.51 0.00 0.00 43.02 39.63 1wsp s PHE 807 CO 0.27 -1.01 1.35 -1.21 0.70 0.00 0.00 175.22 175.32 1wsp s GLU 808 N 1.40 4.30 -0.05 0.44 0.41 -0.45 -4.63 118.70 120.13 1wsp s GLU 808 Ca 0.05 1.90 -0.30 0.00 -0.41 0.00 0.00 54.97 56.21 1wsp s GLU 808 Cb -0.27 -3.56 -0.03 0.00 -1.78 0.00 0.00 34.13 28.49 1wsp s GLU 808 CO 0.01 -0.54 1.07 -2.00 -0.49 0.00 0.00 175.26 173.31 1wsp s GLU 809 N 2.31 4.44 0.04 1.61 2.12 -1.26 -1.18 118.70 126.77 1wsp s GLU 809 Ca 0.62 1.51 0.09 0.00 0.36 0.00 0.00 54.97 57.55 1wsp s GLU 809 Cb -0.30 -3.50 -0.03 0.00 0.26 0.00 0.00 34.13 30.56 1wsp s GLU 809 CO 0.25 -0.27 -0.26 0.08 -0.54 0.00 0.00 175.26 174.52 1wsp s VAL 810 N 1.70 2.17 0.00 3.70 1.01 -0.18 -5.00 120.40 123.80 1wsp s VAL 810 Ca 0.52 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 61.16 1wsp s VAL 810 Cb -0.22 -1.83 0.00 0.00 0.00 0.00 0.00 36.38 34.33 1wsp s VAL 810 CO 0.23 0.39 0.00 -1.14 0.00 0.00 0.00 175.10 174.58 1wsp n ARG 811 N 1.86 3.01 0.00 2.72 0.63 -1.26 -4.14 116.66 119.48 1wsp n ARG 811 Ca -0.17 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.76 1wsp n ARG 811 Cb 0.52 -0.25 0.00 0.00 0.45 0.00 0.00 32.46 33.18 1wsp n ARG 811 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 1wsp n GLU 812 N 0.00 0.00 0.00 -0.14 4.71 -1.26 -4.95 120.64 119.00 1wsp n GLU 812 Ca 0.00 0.43 0.00 0.00 -0.01 0.00 0.00 57.16 57.58 1wsp n GLU 812 Cb 0.00 -1.25 0.00 0.00 -1.01 0.00 0.00 31.44 29.18 1wsp n GLU 812 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1wsp n ASP 813 N -1.79 0.00 -0.95 1.62 3.85 -1.26 -4.75 116.55 113.26 1wsp n ASP 813 Ca 0.00 0.00 0.10 0.00 -0.71 0.00 0.00 54.79 54.18 1wsp n ASP 813 Cb 0.00 0.00 0.26 0.00 -1.35 0.00 0.00 41.12 40.03 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 -1.02 2.22 -2.85 0.11 -0.58 -1.26 -0.55 120.64 116.71 1wsp n GLU 814 Ca 0.00 -1.87 -0.40 0.00 -0.42 0.00 0.00 57.16 54.47 1wsp n GLU 814 Cb 0.00 -1.44 -0.06 0.00 -0.57 0.00 0.00 31.44 29.37 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 -1.44 3.36 -0.20 0.62 0.00 -1.26 -4.86 121.76 117.98 1wsp s ALA 815 Ca 0.36 0.48 -0.24 0.00 0.00 0.00 0.00 51.96 52.56 1wsp s ALA 815 Cb 0.20 -3.11 -0.01 0.00 0.00 0.00 0.00 23.12 20.19 1wsp s ALA 815 CO 0.27 0.17 0.78 0.42 0.00 0.00 0.00 175.76 177.40 1wsp s ILE 816 N -0.76 4.90 0.37 0.00 1.01 -1.26 -0.77 121.20 124.69 1wsp s ILE 816 Ca 0.40 1.51 -0.26 0.00 0.00 0.00 0.00 60.65 62.29 1wsp s ILE 816 Cb -0.24 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.06 1wsp s ILE 816 CO 0.28 0.02 1.20 -0.76 0.00 0.00 0.00 174.94 175.68 1wsp s LEU 817 N 2.28 4.28 0.77 2.97 1.43 0.08 -4.95 118.68 125.52 1wsp s LEU 817 Ca 0.35 2.43 -0.12 0.00 -1.03 0.00 0.00 54.13 55.76 1wsp s LEU 817 Cb -0.16 -3.90 0.06 0.00 0.03 0.00 0.00 46.19 42.22 1wsp s LEU 817 CO 0.11 -0.61 1.13 -2.84 0.23 0.00 0.00 176.35 174.36 1wsp s PRO 818 N -2.11 2.12 -0.18 1.29 0.02 -1.26 -4.77 135.00 130.12 1wsp s PRO 818 Ca 0.54 1.40 -0.01 0.00 0.02 0.00 0.00 61.00 62.95 1wsp s PRO 818 Cb -0.33 -1.87 -0.00 0.00 0.02 0.00 0.00 34.50 32.32 1wsp s PRO 818 CO 0.42 -1.78 -0.11 0.08 -0.33 0.00 0.00 177.00 175.28 1wsp s VAL 819 N -2.56 2.93 -0.19 3.83 1.01 -1.26 -4.67 120.40 119.49 1wsp s VAL 819 Ca 0.66 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.91 1wsp s VAL 819 Cb -0.21 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1wsp s VAL 819 CO 0.51 0.48 0.04 0.12 0.00 0.00 0.00 175.10 176.25 1wsp s PHE 820 N 1.07 3.15 -0.76 5.22 5.36 0.23 -4.55 117.98 127.72 1wsp s PHE 820 Ca -0.00 -0.14 -0.11 0.00 -0.96 0.00 0.00 56.93 55.72 1wsp s PHE 820 Cb -0.15 -2.09 0.02 0.00 -0.34 0.00 0.00 43.02 40.46 1wsp s PHE 820 CO -0.03 -0.02 0.22 -0.85 -1.46 0.00 0.00 175.22 173.08 1wsp n GLU 821 N 3.88 -0.74 0.00 10.12 0.28 -1.26 -0.34 120.64 132.57 1wsp n GLU 821 Ca -0.17 -0.10 0.00 0.00 -0.16 0.00 0.00 57.16 56.74 1wsp n GLU 821 Cb 0.52 -1.38 0.00 0.00 1.43 0.00 0.00 31.44 32.01 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 -3.14 0.00 -4.20 3.44 4.71 -1.26 -4.98 120.64 115.21 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 0.34 -1.14 -0.07 0.00 -1.01 0.00 0.00 31.44 29.56 1wsp n GLU 822 CO 0.00 0.00 0.00 0.15 0.09 0.00 0.00 177.13 177.37 1wsp s LYS 823 N -0.11 2.28 -0.39 3.49 1.02 0.53 -4.62 119.74 121.94 1wsp s LYS 823 Ca 0.00 -1.58 -0.13 0.00 0.02 0.00 0.00 55.97 54.28 1wsp s LYS 823 Cb 0.00 -2.10 0.02 0.00 -0.52 0.00 0.00 37.83 35.23 1wsp s LYS 823 CO 0.00 0.16 0.24 0.42 -0.92 0.00 0.00 175.35 175.26 1wsp s ILE 824 N -2.43 4.85 -0.37 2.17 1.01 -0.17 0.78 121.20 127.04 1wsp s ILE 824 Ca 0.36 -0.77 -0.09 0.00 0.00 0.00 0.00 60.65 60.14 1wsp s ILE 824 Cb -0.02 -3.70 0.04 0.00 0.01 0.00 0.00 42.46 38.78 1wsp s ILE 824 CO 0.21 -0.26 0.18 -0.63 0.00 0.00 0.00 174.94 174.44 1wsp s ILE 825 N 1.61 4.25 0.11 2.92 1.01 -1.26 -1.11 121.20 128.72 1wsp s ILE 825 Ca 0.03 -1.05 0.06 0.00 0.00 0.00 0.00 60.65 59.69 1wsp s ILE 825 Cb -0.19 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1wsp s ILE 825 CO 0.08 -0.27 -0.00 -0.83 0.00 0.00 0.00 174.94 173.92 1wsp s GLY 826 N 1.59 1.86 -0.20 6.18 0.00 0.26 -1.60 107.32 115.42 1wsp s GLY 826 Ca 0.01 -1.18 -0.01 0.00 0.00 0.00 0.00 44.72 43.53 1wsp s GLY 826 CO 0.05 -1.17 -0.12 1.25 0.00 0.00 0.00 173.10 173.11 1wsp s LYS 827 N -2.47 3.22 -0.24 2.90 2.20 0.19 -0.49 119.74 125.05 1wsp s LYS 827 Ca 0.26 -0.72 -0.05 0.00 -0.36 0.00 0.00 55.97 55.10 1wsp s LYS 827 Cb -0.11 -2.79 -0.01 0.00 -1.51 0.00 0.00 37.83 33.41 1wsp s LYS 827 CO 0.18 -0.17 -0.00 0.08 -0.36 0.00 0.00 175.35 175.08 1wsp s VAL 828 N 1.30 3.63 -0.14 4.02 1.01 -0.09 -1.26 120.40 128.88 1wsp s VAL 828 Ca 0.04 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.58 1wsp s VAL 828 Cb -0.14 -2.70 0.00 0.00 0.00 0.00 0.00 36.38 33.55 1wsp s VAL 828 CO -0.06 0.36 -0.19 -1.61 0.00 0.00 0.00 175.10 173.59 1wsp s GLU 829 N 1.51 3.12 0.23 2.72 0.41 -0.85 -0.35 118.70 125.49 1wsp s GLU 829 Ca 0.05 -0.81 -0.30 0.00 -0.41 0.00 0.00 54.97 53.51 1wsp s GLU 829 Cb -0.15 -2.49 -0.09 0.00 -1.78 0.00 0.00 34.13 29.62 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 4.41 -0.33 1.61 2.47 -1.26 -1.19 119.74 126.13 1wsp s LYS 830 Ca -0.09 2.05 -0.29 0.00 -1.56 0.00 0.00 55.97 56.08 1wsp s LYS 830 Cb -0.16 -3.17 0.01 0.00 -1.46 0.00 0.00 37.83 33.05 1wsp s LYS 830 CO 0.02 -0.18 1.18 0.08 0.16 0.00 0.00 175.35 176.60 1wsp s VAL 831 N -0.27 4.32 -2.53 4.02 1.01 -0.71 -4.90 120.40 121.33 1wsp s VAL 831 Ca 0.54 1.49 0.28 0.00 0.00 0.00 0.00 61.98 64.28 1wsp s VAL 831 Cb -0.36 -4.33 0.53 0.00 0.00 0.00 0.00 36.38 32.21 1wsp s VAL 831 CO 0.41 -0.54 1.71 0.47 0.00 0.00 0.00 175.10 177.15