#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wii s GLU 731 N 0.00 1.74 -1.26 -1.24 0.41 -1.26 -4.74 118.70 112.35 2wii s GLU 731 Ca 0.00 -1.18 -0.05 0.00 -0.41 0.00 0.00 54.97 53.33 2wii s GLU 731 Cb 0.00 -2.05 -0.01 0.00 -1.78 0.00 0.00 34.13 30.29 2wii s GLU 731 CO 0.00 0.49 0.70 -0.25 -0.49 0.00 0.00 175.26 175.71 2wii n ASP 732 N 1.12 -2.52 -3.62 -0.19 8.00 -1.26 -4.77 116.55 113.30 2wii n ASP 732 Ca -0.17 -0.88 -0.11 0.00 0.71 0.00 0.00 54.79 54.34 2wii n ASP 732 Cb 0.53 -3.88 -0.07 0.00 -0.02 0.00 0.00 41.12 37.68 2wii n ASP 732 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 2wii s ILE 733 N -3.63 0.00 0.31 0.53 2.07 -1.26 -0.85 121.20 118.36 2wii s ILE 733 Ca 0.15 0.00 -0.29 0.00 -1.41 0.00 0.00 60.65 59.10 2wii s ILE 733 Cb -0.05 -1.00 -0.11 0.00 0.13 0.00 0.00 42.46 41.44 2wii s ILE 733 CO 0.83 0.00 1.47 -0.63 -1.91 0.00 0.00 174.94 174.70 2wii s ILE 734 N 0.08 2.35 0.47 2.00 -1.09 -1.26 -4.80 121.20 118.96 2wii s ILE 734 Ca 0.01 0.32 -0.23 0.00 -2.23 0.00 0.00 60.65 58.53 2wii s ILE 734 Cb -0.04 -3.20 -0.07 0.00 -1.58 0.00 0.00 42.46 37.56 2wii s ILE 734 CO -0.03 0.06 1.19 0.00 -1.23 0.00 0.00 174.94 174.93 2wii s ALA 735 N -0.50 2.94 0.32 9.38 0.00 -1.26 -4.90 121.76 127.75 2wii s ALA 735 Ca 0.57 0.98 0.03 0.00 0.00 0.00 0.00 51.96 53.53 2wii s ALA 735 Cb -0.44 -3.40 0.61 0.00 0.00 0.00 0.00 23.12 19.88 2wii s ALA 735 CO 0.51 -0.75 1.92 1.49 0.00 0.00 0.00 175.76 178.94 2wii h GLU 736 N 1.94 0.90 0.00 0.00 4.22 -1.95 -1.25 114.58 118.44 2wii h GLU 736 Ca -0.50 -0.05 -0.05 0.00 0.08 0.00 0.00 59.36 58.84 2wii h GLU 736 Cb 1.25 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 2wii h GLU 736 CO 0.60 0.60 -0.22 1.49 -2.18 0.00 0.00 179.01 179.29 2wii h GLU 737 N 0.93 0.00 -0.00 1.92 4.22 -2.03 -2.62 114.58 116.99 2wii h GLU 737 Ca 0.37 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.81 2wii h GLU 737 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2wii h GLU 737 CO -0.14 0.22 -0.11 0.09 -2.18 0.00 0.00 179.01 176.90 2wii n ASN 738 N -3.43 0.16 -4.66 1.04 3.02 -0.48 -4.79 115.26 106.12 2wii n ASN 738 Ca -0.00 0.10 -0.37 0.00 -0.03 0.00 0.00 54.58 54.27 2wii n ASN 738 Cb 0.41 -0.27 -0.08 0.00 -0.61 0.00 0.00 39.78 39.23 2wii n ASN 738 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2wii s ILE 739 N -2.85 5.27 -0.34 2.41 1.01 -0.99 -4.99 121.20 120.73 2wii s ILE 739 Ca 0.18 0.46 -0.07 0.00 0.00 0.00 0.00 60.65 61.22 2wii s ILE 739 Cb 0.19 -3.62 0.03 0.00 0.01 0.00 0.00 42.46 39.07 2wii s ILE 739 CO 0.54 0.29 0.12 -0.69 0.00 0.00 0.00 174.94 175.20 2wii s VAL 740 N 1.23 3.93 0.50 2.92 1.01 -1.26 -5.02 120.40 123.71 2wii s VAL 740 Ca 0.13 -1.04 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 2wii s VAL 740 Cb -0.14 -3.20 -0.06 0.00 0.00 0.00 0.00 36.38 32.98 2wii s VAL 740 CO 0.06 -0.16 1.26 -0.44 0.00 0.00 0.00 175.10 175.82 2wii s SER 741 N 1.44 5.77 0.03 3.32 0.01 -1.26 -4.67 113.70 118.35 2wii s SER 741 Ca -0.01 2.52 -0.30 0.00 1.31 0.00 0.00 55.95 59.47 2wii s SER 741 Cb -0.19 -2.62 -0.07 0.00 0.21 0.00 0.00 66.02 63.35 2wii s SER 741 CO 0.03 -1.20 1.47 -0.13 0.41 0.00 0.00 173.24 173.82 2wii s ARG 742 N -2.77 4.26 0.00 12.44 0.52 0.59 -4.74 118.95 129.25 2wii s ARG 742 Ca 0.67 2.08 0.00 0.00 -0.52 0.00 0.00 55.73 57.96 2wii s ARG 742 Cb -0.34 -3.54 0.00 0.00 0.52 0.00 0.00 34.95 31.59 2wii s ARG 742 CO 0.41 -0.60 0.00 -1.13 0.02 0.00 0.00 175.30 174.00 2wii n SER 743 N 5.26 4.13 -4.55 0.23 3.41 -1.26 -1.38 113.62 119.46 2wii n SER 743 Ca 0.14 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.34 2wii n SER 743 Cb 0.43 0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 64.97 2wii n SER 743 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2wii s GLU 744 N -1.74 3.25 -0.50 4.33 0.41 -1.26 -4.88 118.70 118.31 2wii s GLU 744 Ca 0.00 -0.40 0.07 0.00 -0.41 0.00 0.00 54.97 54.23 2wii s GLU 744 Cb 0.00 -4.36 0.35 0.00 -1.78 0.00 0.00 34.13 28.34 2wii s GLU 744 CO 0.00 -2.14 0.90 1.19 -0.49 0.00 0.00 175.26 174.71 2wii n PHE 745 N 9.23 2.83 -2.32 1.61 3.72 -1.26 -1.74 117.46 129.53 2wii n PHE 745 Ca 0.07 -3.85 -0.40 0.00 -0.05 0.00 0.00 57.45 53.22 2wii n PHE 745 Cb 0.49 -0.44 -0.03 0.00 -0.94 0.00 0.00 39.48 38.56 2wii n PHE 745 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2wii s PRO 746 N -3.18 4.47 0.46 -1.08 0.02 -1.26 -4.92 135.00 129.52 2wii s PRO 746 Ca 0.46 1.96 0.28 0.00 0.02 0.00 0.00 61.00 63.72 2wii s PRO 746 Cb 0.31 -3.09 0.89 0.00 0.02 0.00 0.00 34.50 32.63 2wii s PRO 746 CO -0.12 0.01 1.80 0.93 -0.33 0.00 0.00 177.00 179.29 2wii h GLU 747 N 3.53 0.00 -2.48 5.54 5.08 -2.04 -3.44 114.58 120.76 2wii h GLU 747 Ca -0.48 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.79 2wii h GLU 747 Cb 1.22 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.25 2wii h GLU 747 CO 0.66 0.00 -0.08 -1.54 -1.00 0.00 0.00 179.01 177.05 2wii s SER 748 N -5.70 -0.51 0.00 1.42 1.04 -1.26 -5.11 113.70 103.58 2wii s SER 748 Ca 0.04 0.85 0.00 0.00 0.48 0.00 0.00 55.95 57.32 2wii s SER 748 Cb 0.08 0.87 0.00 0.00 0.10 0.00 0.00 66.02 67.06 2wii s SER 748 CO 0.59 -0.30 0.00 -2.67 0.98 0.00 0.00 173.24 171.84 2wii n TRP 749 N 2.24 -0.24 -3.81 5.02 4.27 -1.26 -4.97 117.44 118.68 2wii n TRP 749 Ca -0.16 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.18 2wii n TRP 749 Cb 0.56 0.00 0.04 0.00 -1.36 0.00 0.00 31.31 30.55 2wii n TRP 749 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 2wii n LEU 750 N 0.00 -2.83 -3.61 5.67 7.94 -1.26 -4.86 117.00 118.05 2wii n LEU 750 Ca 0.00 -0.75 -0.41 0.00 -1.11 0.00 0.00 56.01 53.74 2wii n LEU 750 Cb 0.00 -2.66 -0.01 0.00 0.53 0.00 0.00 43.42 41.28 2wii n LEU 750 CO 0.00 0.48 2.62 1.87 -1.11 0.00 0.00 177.39 181.25 2wii n TRP 751 N -4.62 2.92 -4.42 1.96 -0.00 -1.26 -4.93 117.44 107.09 2wii n TRP 751 Ca -0.05 -2.93 -0.30 0.00 -0.00 0.00 0.00 57.50 54.23 2wii n TRP 751 Cb 0.57 -2.25 -0.06 0.00 -0.00 0.00 0.00 31.31 29.57 2wii n TRP 751 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 2wii s ASN 752 N 1.79 4.29 -0.01 5.87 0.01 -1.26 -5.15 114.94 120.48 2wii s ASN 752 Ca 0.52 -1.45 0.03 0.00 -0.71 0.00 0.00 52.86 51.25 2wii s ASN 752 Cb 0.15 0.31 -0.01 0.00 0.41 0.00 0.00 41.25 42.11 2wii s ASN 752 CO -0.06 -0.86 -0.11 -0.69 -1.51 0.00 0.00 177.10 173.87 2wii s VAL 753 N -2.80 0.87 0.04 1.60 1.01 -1.26 -5.13 120.40 114.72 2wii s VAL 753 Ca 0.20 -0.46 0.03 0.00 0.00 0.00 0.00 61.98 61.75 2wii s VAL 753 Cb 0.01 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 2wii s VAL 753 CO 0.12 0.25 -0.10 -1.61 0.00 0.00 0.00 175.10 173.76 2wii s GLU 754 N -0.18 0.66 -0.20 2.72 0.41 -1.26 -5.14 118.70 115.71 2wii s GLU 754 Ca 0.03 -0.68 -0.01 0.00 -0.41 0.00 0.00 54.97 53.89 2wii s GLU 754 Cb -0.05 -0.56 0.01 0.00 -1.78 0.00 0.00 34.13 31.75 2wii s GLU 754 CO -0.00 0.13 -0.13 -0.51 -0.49 0.00 0.00 175.26 174.25 2wii s ASP 755 N -1.23 3.63 -1.16 -0.19 1.01 -1.26 -5.05 116.67 112.42 2wii s ASP 755 Ca -0.04 -0.54 -0.21 0.00 0.71 0.00 0.00 52.55 52.48 2wii s ASP 755 Cb -0.08 -1.59 0.04 0.00 1.01 0.00 0.00 42.92 42.30 2wii s ASP 755 CO 0.01 -0.01 1.66 -0.76 0.21 0.00 0.00 175.17 176.28 2wii s LEU 756 N 1.36 3.60 0.00 1.23 1.43 -1.26 -4.68 118.68 120.37 2wii s LEU 756 Ca 0.05 -1.90 0.19 0.00 -1.03 0.00 0.00 54.13 51.44 2wii s LEU 756 Cb -0.14 -2.58 0.23 0.00 0.03 0.00 0.00 46.19 43.74 2wii s LEU 756 CO -0.09 -1.56 1.18 0.29 0.23 0.00 0.00 176.35 176.41 2wii n LYS 757 N 8.60 1.92 -2.26 1.70 5.02 -1.26 -4.99 118.16 126.89 2wii n LYS 757 Ca 0.42 -1.82 -0.35 0.00 -2.02 0.00 0.00 58.31 54.53 2wii n LYS 757 Cb 0.48 -1.39 -0.00 0.00 -0.02 0.00 0.00 35.03 34.09 2wii n LYS 757 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 2wii s GLU 758 N -1.51 3.45 -0.07 1.97 8.01 -1.26 -4.92 118.70 124.37 2wii s GLU 758 Ca 0.26 1.64 -0.36 0.00 0.01 0.00 0.00 54.97 56.53 2wii s GLU 758 Cb 0.17 -2.09 -0.14 0.00 -4.31 0.00 0.00 34.13 27.76 2wii s GLU 758 CO 0.25 -0.78 1.72 -2.30 0.01 0.00 0.00 175.26 174.16 2wii n PRO 759 N -1.12 1.78 -2.19 0.39 -0.02 -1.26 -4.77 135.00 127.81 2wii n PRO 759 Ca 0.11 0.65 -0.39 0.00 -2.02 0.00 0.00 63.50 61.85 2wii n PRO 759 Cb 0.50 -2.41 -0.01 0.00 -0.02 0.00 0.00 33.50 31.56 2wii n PRO 759 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2wii s PRO 760 N 2.88 4.00 -0.30 0.52 0.02 -1.26 -4.70 135.00 136.16 2wii s PRO 760 Ca 0.90 1.97 0.03 0.00 0.02 0.00 0.00 61.00 63.92 2wii s PRO 760 Cb -0.82 -2.70 0.08 0.00 0.02 0.00 0.00 34.50 31.08 2wii s PRO 760 CO 0.52 -0.41 -0.00 0.15 -0.33 0.00 0.00 177.00 176.93 2wii s LYS 761 N -2.28 1.60 -1.31 5.54 1.02 0.08 -4.70 119.74 119.68 2wii s LYS 761 Ca 0.57 -1.50 -0.04 0.00 0.02 0.00 0.00 55.97 55.02 2wii s LYS 761 Cb -0.34 -2.88 0.00 0.00 -0.52 0.00 0.00 37.83 34.09 2wii s LYS 761 CO 0.43 -0.80 0.51 0.09 -0.92 0.00 0.00 175.35 174.66 2wii n ASN 762 N 4.44 -5.42 0.00 2.83 3.02 -1.26 -2.20 115.26 116.67 2wii n ASN 762 Ca -0.04 -0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.27 2wii n ASN 762 Cb 0.42 -4.26 0.00 0.00 -0.61 0.00 0.00 39.78 35.34 2wii n ASN 762 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wii n GLY 763 N -1.40 0.82 3.16 7.41 0.00 -1.26 -5.02 105.19 108.90 2wii n GLY 763 Ca -0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 2wii n GLY 763 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wii s ILE 764 N -3.19 2.55 -0.15 -0.61 1.01 -0.93 -5.04 121.20 114.84 2wii s ILE 764 Ca 0.00 -1.05 -0.11 0.00 0.00 0.00 0.00 60.65 59.49 2wii s ILE 764 Cb 0.00 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 40.18 2wii s ILE 764 CO 0.00 0.29 0.22 -0.44 0.00 0.00 0.00 174.94 175.02 2wii s SER 765 N 1.29 6.39 -0.10 3.58 0.01 -1.26 -0.74 113.70 122.87 2wii s SER 765 Ca 0.01 0.45 -0.00 0.00 1.31 0.00 0.00 55.95 57.72 2wii s SER 765 Cb -0.16 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 63.91 2wii s SER 765 CO -0.07 0.20 -0.08 -0.89 0.41 0.00 0.00 173.24 172.81 2wii s THR 766 N 0.03 3.54 -0.06 1.44 2.01 -1.26 -5.01 115.64 116.33 2wii s THR 766 Ca 0.14 -0.52 0.01 0.00 0.31 0.00 0.00 61.69 61.64 2wii s THR 766 Cb -0.12 -2.47 0.02 0.00 0.01 0.00 0.00 72.50 69.93 2wii s THR 766 CO 0.03 0.56 -0.07 -0.75 -0.69 0.00 0.00 174.62 173.70 2wii s LYS 767 N -0.30 1.17 -0.28 4.92 2.20 -1.26 -4.78 119.74 121.41 2wii s LYS 767 Ca 0.04 -0.21 -0.19 0.00 -0.36 0.00 0.00 55.97 55.24 2wii s LYS 767 Cb -0.13 -1.10 -0.02 0.00 -1.51 0.00 0.00 37.83 35.08 2wii s LYS 767 CO 0.02 -0.07 0.59 -0.51 -0.36 0.00 0.00 175.35 175.02 2wii s LEU 768 N 0.94 4.09 -0.17 5.43 1.43 -1.26 -5.05 118.68 124.09 2wii s LEU 768 Ca -0.10 0.54 -0.02 0.00 -1.03 0.00 0.00 54.13 53.52 2wii s LEU 768 Cb -0.15 -2.77 -0.01 0.00 0.03 0.00 0.00 46.19 43.29 2wii s LEU 768 CO 0.00 -0.38 -0.10 -0.32 0.23 0.00 0.00 176.35 175.78 2wii s MET 769 N 2.47 3.35 -0.22 1.70 -2.45 -1.26 -5.10 119.30 117.80 2wii s MET 769 Ca 0.24 -0.67 -0.18 0.00 -1.25 0.00 0.00 55.69 53.83 2wii s MET 769 Cb -0.15 -2.79 -0.03 0.00 1.25 0.00 0.00 34.83 33.11 2wii s MET 769 CO 0.10 -0.00 0.51 -0.80 1.05 0.00 0.00 175.02 175.87 2wii s ASN 770 N 0.92 6.52 0.18 1.11 0.01 -1.26 -5.07 114.94 117.34 2wii s ASN 770 Ca -0.02 0.62 0.07 0.00 -0.71 0.00 0.00 52.86 52.82 2wii s ASN 770 Cb -0.15 -2.28 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 2wii s ASN 770 CO -0.00 -0.20 -0.15 0.27 -1.51 0.00 0.00 177.10 175.51 2wii s ILE 771 N 1.78 1.62 -0.25 0.60 -4.36 -1.26 -5.13 121.20 114.20 2wii s ILE 771 Ca 0.23 -2.07 -0.05 0.00 -0.26 0.00 0.00 60.65 58.50 2wii s ILE 771 Cb -0.15 -1.91 -0.00 0.00 1.25 0.00 0.00 42.46 41.65 2wii s ILE 771 CO 0.09 -0.54 0.02 -0.36 0.24 0.00 0.00 174.94 174.40 2wii s PHE 772 N -2.72 3.06 0.55 1.37 0.08 -1.26 -5.09 117.98 113.97 2wii s PHE 772 Ca 0.19 -0.89 -0.21 0.00 0.12 0.00 0.00 56.93 56.14 2wii s PHE 772 Cb -0.02 -2.18 -0.05 0.00 -0.57 0.00 0.00 43.02 40.20 2wii s PHE 772 CO 0.05 -0.53 1.25 -0.51 -0.10 0.00 0.00 175.22 175.39 2wii s LEU 773 N 1.50 3.80 1.09 -0.37 1.43 -1.26 -5.02 118.68 119.85 2wii s LEU 773 Ca 0.04 2.51 -0.18 0.00 -1.03 0.00 0.00 54.13 55.47 2wii s LEU 773 Cb -0.16 -4.41 0.25 0.00 0.03 0.00 0.00 46.19 41.90 2wii s LEU 773 CO 0.00 -1.46 1.23 -0.54 0.23 0.00 0.00 176.35 175.81 2wii s LYS 774 N -3.05 -0.37 0.25 1.70 -0.14 -1.26 -4.98 119.74 111.89 2wii s LYS 774 Ca 0.73 -0.31 0.14 0.00 -1.36 0.00 0.00 55.97 55.17 2wii s LYS 774 Cb -0.34 -1.72 0.04 0.00 -1.68 0.00 0.00 37.83 34.13 2wii s LYS 774 CO 0.39 -3.11 1.43 -0.44 -0.76 0.00 0.00 175.35 172.86 2wii h ASP 775 N -2.14 0.00 -2.21 2.83 3.32 -1.74 -3.46 116.42 113.02 2wii h ASP 775 Ca -0.44 0.00 -0.61 0.00 0.02 0.00 0.00 57.03 56.00 2wii h ASP 775 Cb 1.25 0.00 0.07 0.00 0.22 0.00 0.00 39.33 40.87 2wii h ASP 775 CO 0.34 0.60 0.62 -1.20 -1.72 0.00 0.00 179.24 177.87 2wii n SER 776 N -3.27 2.50 -4.45 6.45 7.64 -1.16 -4.90 113.62 116.43 2wii n SER 776 Ca 0.01 1.11 -0.44 0.00 1.01 0.00 0.00 58.87 60.57 2wii n SER 776 Cb 0.77 -1.35 -0.02 0.00 -1.01 0.00 0.00 64.21 62.59 2wii n SER 776 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2wii s ILE 777 N 0.45 4.77 0.22 0.44 -1.09 -1.26 -4.88 121.20 119.86 2wii s ILE 777 Ca 0.77 -1.69 -0.16 0.00 -2.23 0.00 0.00 60.65 57.34 2wii s ILE 777 Cb -0.75 -4.79 0.06 0.00 -1.58 0.00 0.00 42.46 35.40 2wii s ILE 777 CO 0.44 -1.51 0.78 1.07 -1.23 0.00 0.00 174.94 174.49 2wii n THR 778 N 5.39 0.00 -3.58 2.92 5.66 -1.09 -4.99 114.28 118.58 2wii n THR 778 Ca 0.25 -0.61 -0.37 0.00 -3.05 0.00 0.00 64.05 60.27 2wii n THR 778 Cb 0.48 0.72 -0.09 0.00 -1.55 0.00 0.00 70.33 69.89 2wii n THR 778 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2wii s THR 779 N -2.19 5.32 -0.04 1.09 2.01 -1.26 -1.54 115.64 119.03 2wii s THR 779 Ca 0.17 0.35 -0.15 0.00 0.31 0.00 0.00 61.69 62.38 2wii s THR 779 Cb -0.03 -3.57 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 2wii s THR 779 CO 0.07 0.34 0.39 0.26 -0.69 0.00 0.00 174.62 174.98 2wii s TRP 780 N 0.99 3.66 -0.40 4.92 0.52 0.82 -4.88 118.94 124.57 2wii s TRP 780 Ca 0.11 0.90 -0.08 0.00 0.02 0.00 0.00 56.10 57.05 2wii s TRP 780 Cb -0.13 -2.31 0.07 0.00 -1.15 0.00 0.00 33.47 29.95 2wii s TRP 780 CO 0.05 0.54 0.22 -2.00 0.02 0.00 0.00 176.95 175.78 2wii s GLU 781 N -0.67 2.59 -0.35 4.98 2.12 -1.26 -0.56 118.70 125.55 2wii s GLU 781 Ca 0.23 -1.40 -0.21 0.00 0.36 0.00 0.00 54.97 53.95 2wii s GLU 781 Cb -0.16 -3.70 0.00 0.00 0.26 0.00 0.00 34.13 30.53 2wii s GLU 781 CO 0.11 -0.88 0.65 0.42 -0.54 0.00 0.00 175.26 175.01 2wii s ILE 782 N 1.41 4.88 -0.14 -3.70 1.01 0.81 -4.90 121.20 120.57 2wii s ILE 782 Ca 0.02 0.65 -0.06 0.00 0.00 0.00 0.00 60.65 61.26 2wii s ILE 782 Cb -0.22 -4.08 -0.04 0.00 0.01 0.00 0.00 42.46 38.14 2wii s ILE 782 CO 0.02 -0.30 0.07 -0.22 0.00 0.00 0.00 174.94 174.51 2wii s LEU 783 N 2.72 3.90 -0.05 2.97 2.96 -1.26 -1.81 118.68 128.11 2wii s LEU 783 Ca 0.25 0.20 0.04 0.00 -0.22 0.00 0.00 54.13 54.39 2wii s LEU 783 Cb -0.14 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.59 2wii s LEU 783 CO 0.14 0.29 -0.15 0.00 -1.32 0.00 0.00 176.35 175.31 2wii s ALA 784 N -0.30 1.41 -0.02 5.97 0.00 -1.26 -5.07 121.76 122.49 2wii s ALA 784 Ca 0.09 -0.59 0.06 0.00 0.00 0.00 0.00 51.96 51.52 2wii s ALA 784 Cb -0.12 -0.52 -0.02 0.00 0.00 0.00 0.00 23.12 22.47 2wii s ALA 784 CO 0.02 0.22 -0.22 0.08 0.00 0.00 0.00 175.76 175.86 2wii s VAL 785 N 0.23 1.73 0.14 0.00 1.01 -1.26 -1.27 120.40 120.99 2wii s VAL 785 Ca -0.07 -0.93 0.11 0.00 0.00 0.00 0.00 61.98 61.09 2wii s VAL 785 Cb -0.13 -1.45 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 2wii s VAL 785 CO 0.03 0.49 -0.26 -0.94 0.00 0.00 0.00 175.10 174.42 2wii s SER 786 N -0.43 3.28 -0.06 3.32 1.04 -0.32 -4.99 113.70 115.54 2wii s SER 786 Ca 0.06 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.73 2wii s SER 786 Cb -0.09 -0.22 0.02 0.00 0.10 0.00 0.00 66.02 65.83 2wii s SER 786 CO -0.00 0.16 -0.08 -0.32 0.98 0.00 0.00 173.24 173.98 2wii s MET 787 N -2.19 1.23 0.03 4.02 1.75 -1.26 -1.68 119.30 121.19 2wii s MET 787 Ca 0.15 -0.23 0.04 0.00 -1.25 0.00 0.00 55.69 54.40 2wii s MET 787 Cb -0.09 -1.14 -0.02 0.00 2.84 0.00 0.00 34.83 36.42 2wii s MET 787 CO 0.07 -0.07 -0.11 0.45 -0.65 0.00 0.00 175.02 174.71 2wii s SER 788 N 0.94 1.33 0.41 1.11 0.15 -0.59 -4.95 113.70 112.09 2wii s SER 788 Ca -0.10 -0.40 0.08 0.00 0.70 0.00 0.00 55.95 56.23 2wii s SER 788 Cb -0.15 -0.08 0.85 0.00 -1.71 0.00 0.00 66.02 64.94 2wii s SER 788 CO 0.01 0.00 2.01 0.44 1.20 0.00 0.00 173.24 176.90 2wii h ASP 789 N 5.09 0.36 0.00 5.45 3.32 -2.01 -1.83 116.42 126.80 2wii h ASP 789 Ca -0.36 -0.03 -0.37 0.00 0.02 0.00 0.00 57.03 56.30 2wii h ASP 789 Cb 1.18 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 40.59 2wii h ASP 789 CO 0.45 0.35 -2.23 0.29 -1.72 0.00 0.00 179.24 176.37 2wii n LYS 790 N -4.41 0.48 0.01 3.56 4.76 -1.26 -4.67 118.16 116.63 2wii n LYS 790 Ca 0.01 0.20 -0.15 0.00 -2.87 0.00 0.00 58.31 55.50 2wii n LYS 790 Cb 0.14 -1.31 -0.04 0.00 -1.84 0.00 0.00 35.03 31.99 2wii n LYS 790 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2wii h LYS 791 N -0.69 0.64 0.00 1.97 1.79 -1.98 -3.50 116.57 114.80 2wii h LYS 791 Ca -0.55 -0.53 0.00 0.00 -2.18 0.00 0.00 60.65 57.38 2wii h LYS 791 Cb 1.52 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 32.29 2wii h LYS 791 CO -0.31 1.15 0.00 0.41 -1.08 0.00 0.00 179.45 179.63 2wii n GLY 792 N 0.68 -1.12 3.84 3.86 0.00 -0.69 -4.93 105.19 106.84 2wii n GLY 792 Ca -0.06 -1.88 -0.34 0.00 0.00 0.00 0.00 46.02 43.74 2wii n GLY 792 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wii s ILE 793 N 0.00 4.64 -0.21 -0.61 2.07 -1.26 -1.54 121.20 124.29 2wii s ILE 793 Ca 0.00 1.08 -0.10 0.00 -1.41 0.00 0.00 60.65 60.22 2wii s ILE 793 Cb 0.00 -3.70 0.08 0.00 0.13 0.00 0.00 42.46 38.96 2wii s ILE 793 CO 0.00 -0.03 0.48 0.00 -1.91 0.00 0.00 174.94 173.47 2wii s VAL 795 N 1.96 4.94 0.61 0.00 1.01 -1.26 -1.17 120.40 126.49 2wii s VAL 795 Ca -0.07 0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.86 2wii s VAL 795 Cb -0.09 -3.32 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 2wii s VAL 795 CO -0.14 0.32 0.97 0.00 0.00 0.00 0.00 175.10 176.25 2wii s ALA 796 N 1.42 3.14 0.36 5.51 0.00 -0.39 -5.04 121.76 126.76 2wii s ALA 796 Ca 0.06 -0.36 -0.27 0.00 0.00 0.00 0.00 51.96 51.40 2wii s ALA 796 Cb -0.15 -2.88 -0.09 0.00 0.00 0.00 0.00 23.12 20.01 2wii s ALA 796 CO 0.06 -0.76 1.15 -0.51 0.00 0.00 0.00 175.76 175.70 2wii s ASP 797 N -4.24 6.79 0.11 0.00 1.01 -1.26 -4.60 116.67 114.48 2wii s ASP 797 Ca 0.54 2.33 -0.32 0.00 0.71 0.00 0.00 52.55 55.81 2wii s ASP 797 Cb -0.11 -2.62 -0.11 0.00 1.01 0.00 0.00 42.92 41.09 2wii s ASP 797 CO 0.50 -0.48 1.82 -2.65 0.21 0.00 0.00 175.17 174.57 2wii n PRO 798 N 0.46 2.69 -3.84 8.23 -0.02 -1.26 -4.80 135.00 136.46 2wii n PRO 798 Ca 0.02 0.98 -0.36 0.00 -2.02 0.00 0.00 63.50 62.13 2wii n PRO 798 Cb 0.46 -2.86 -0.10 0.00 -0.02 0.00 0.00 33.50 30.98 2wii n PRO 798 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2wii s PHE 799 N 2.73 3.24 -0.04 6.00 5.36 -0.75 -4.92 117.98 129.60 2wii s PHE 799 Ca 0.83 0.04 -0.04 0.00 -0.96 0.00 0.00 56.93 56.80 2wii s PHE 799 Cb -0.52 -2.18 -0.04 0.00 -0.34 0.00 0.00 43.02 39.95 2wii s PHE 799 CO 0.39 0.03 0.17 -1.21 -1.46 0.00 0.00 175.22 173.13 2wii s GLU 800 N 0.84 3.42 -0.13 10.12 2.02 -1.26 -0.14 118.70 133.59 2wii s GLU 800 Ca 0.05 -0.28 -0.01 0.00 0.02 0.00 0.00 54.97 54.75 2wii s GLU 800 Cb -0.13 -3.11 0.04 0.00 0.10 0.00 0.00 34.13 31.02 2wii s GLU 800 CO 0.02 0.70 -0.01 0.08 0.02 0.00 0.00 175.26 176.08 2wii s VAL 801 N -1.24 0.62 -0.23 2.63 1.01 0.27 -4.96 120.40 118.51 2wii s VAL 801 Ca 0.24 -0.24 -0.17 0.00 0.00 0.00 0.00 61.98 61.80 2wii s VAL 801 Cb -0.12 -0.86 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 2wii s VAL 801 CO 0.14 0.12 0.48 0.42 0.00 0.00 0.00 175.10 176.26 2wii s THR 802 N 1.85 5.12 -0.16 3.92 -4.23 -1.26 -0.12 115.64 120.75 2wii s THR 802 Ca 0.03 0.83 -0.01 0.00 -1.18 0.00 0.00 61.69 61.36 2wii s THR 802 Cb -0.14 -3.80 -0.01 0.00 1.34 0.00 0.00 72.50 69.90 2wii s THR 802 CO -0.07 0.16 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.36 2wii s VAL 803 N 1.84 2.94 0.16 2.29 1.01 -0.59 -4.99 120.40 123.06 2wii s VAL 803 Ca 0.21 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.39 2wii s VAL 803 Cb -0.15 -2.27 0.01 0.00 0.00 0.00 0.00 36.38 33.97 2wii s VAL 803 CO 0.09 0.50 0.36 -0.32 0.00 0.00 0.00 175.10 175.72 2wii s MET 804 N 0.85 1.16 0.07 2.72 0.00 -1.26 -2.67 119.30 120.17 2wii s MET 804 Ca -0.04 -0.98 0.03 0.00 0.00 0.00 0.00 55.69 54.70 2wii s MET 804 Cb -0.15 0.43 -0.03 0.00 0.00 0.00 0.00 34.83 35.08 2wii s MET 804 CO 0.00 -0.45 -0.08 -0.65 0.00 0.00 0.00 175.02 173.84 2wii s GLN 805 N -3.90 0.71 0.17 4.11 -0.21 -1.26 -5.05 119.66 114.23 2wii s GLN 805 Ca 0.11 -1.03 -0.13 0.00 0.02 0.00 0.00 55.36 54.33 2wii s GLN 805 Cb 0.02 -0.35 0.07 0.00 1.00 0.00 0.00 33.01 33.75 2wii s GLN 805 CO -0.04 0.04 1.76 -0.44 -2.12 0.00 0.00 175.29 174.49 2wii h ASP 806 N 3.81 0.73 -3.26 5.90 3.32 -1.95 -3.42 116.42 121.55 2wii h ASP 806 Ca -0.36 -0.12 -0.51 0.00 0.02 0.00 0.00 57.03 56.06 2wii h ASP 806 Cb 1.19 -0.19 -0.36 0.00 0.22 0.00 0.00 39.33 40.19 2wii h ASP 806 CO 0.51 0.64 -0.80 0.12 -1.72 0.00 0.00 179.24 177.98 2wii s PHE 807 N -5.76 1.38 0.21 4.55 5.36 -1.26 -1.02 117.98 121.43 2wii s PHE 807 Ca -0.13 -0.62 -0.13 0.00 -0.96 0.00 0.00 56.93 55.09 2wii s PHE 807 Cb 0.12 -1.13 0.00 0.00 -0.34 0.00 0.00 43.02 41.68 2wii s PHE 807 CO 0.77 -0.42 0.44 -0.59 -1.46 0.00 0.00 175.22 173.96 2wii s PHE 808 N 1.41 0.21 -0.07 10.12 -0.12 -1.12 -4.87 117.98 123.55 2wii s PHE 808 Ca -0.01 -0.57 0.03 0.00 -0.05 0.00 0.00 56.93 56.33 2wii s PHE 808 Cb -0.13 0.19 -0.02 0.00 -0.63 0.00 0.00 43.02 42.42 2wii s PHE 808 CO -0.05 -0.89 -0.15 0.42 -0.05 0.00 0.00 175.22 174.50 2wii s ILE 809 N -3.96 2.92 -0.44 -4.49 1.01 -1.26 -1.24 121.20 113.74 2wii s ILE 809 Ca 0.16 -0.75 -0.00 0.00 0.00 0.00 0.00 60.65 60.06 2wii s ILE 809 Cb 0.00 -2.16 0.12 0.00 0.01 0.00 0.00 42.46 40.44 2wii s ILE 809 CO 0.03 0.57 0.21 -0.62 0.00 0.00 0.00 174.94 175.12 2wii s ASP 810 N -0.34 4.99 -0.58 3.58 2.15 0.41 -4.85 116.67 122.03 2wii s ASP 810 Ca 0.03 -2.33 -0.25 0.00 0.43 0.00 0.00 52.55 50.43 2wii s ASP 810 Cb -0.13 -1.75 0.04 0.00 -0.30 0.00 0.00 42.92 40.79 2wii s ASP 810 CO 0.02 -0.43 1.00 -0.22 -0.17 0.00 0.00 175.17 175.38 2wii s LEU 811 N 0.68 3.99 -0.61 -1.34 2.96 -1.26 -2.23 118.68 120.88 2wii s LEU 811 Ca 0.12 -0.39 -0.24 0.00 -0.22 0.00 0.00 54.13 53.39 2wii s LEU 811 Cb -0.22 -2.80 0.05 0.00 0.50 0.00 0.00 46.19 43.73 2wii s LEU 811 CO -0.05 -1.33 1.00 -0.13 -1.32 0.00 0.00 176.35 174.52 2wii s ARG 812 N 4.22 3.26 -0.12 1.98 1.81 -1.04 -5.02 118.95 124.04 2wii s ARG 812 Ca 0.31 -0.40 -0.03 0.00 -1.72 0.00 0.00 55.73 53.88 2wii s ARG 812 Cb -0.12 -4.12 -0.03 0.00 -0.45 0.00 0.00 34.95 30.23 2wii s ARG 812 CO 0.18 -1.68 0.01 -0.51 -0.68 0.00 0.00 175.30 172.63 2wii s LEU 813 N 4.25 3.57 0.80 2.53 1.02 -1.26 -4.08 118.68 125.52 2wii s LEU 813 Ca 0.29 0.08 -0.12 0.00 0.02 0.00 0.00 54.13 54.40 2wii s LEU 813 Cb -0.13 -1.84 0.08 0.00 0.02 0.00 0.00 46.19 44.31 2wii s LEU 813 CO 0.16 0.29 1.14 -2.84 0.02 0.00 0.00 176.35 175.13 2wii s PRO 814 N -0.36 1.84 0.28 1.29 0.02 -1.26 -4.93 135.00 131.88 2wii s PRO 814 Ca 0.07 1.47 -0.03 0.00 0.02 0.00 0.00 61.00 62.54 2wii s PRO 814 Cb -0.12 -1.83 0.40 0.00 0.02 0.00 0.00 34.50 32.97 2wii s PRO 814 CO 0.02 -2.01 1.92 -0.92 -0.33 0.00 0.00 177.00 175.69 2wii h TYR 815 N -1.07 1.15 -2.60 6.54 3.20 -1.98 -3.44 116.97 118.78 2wii h TYR 815 Ca -0.45 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.38 2wii h TYR 815 Cb 1.26 -0.38 -0.18 0.00 1.54 0.00 0.00 36.73 38.97 2wii h TYR 815 CO 0.52 0.67 0.02 -1.54 -1.64 0.00 0.00 178.16 176.19 2wii s SER 816 N -6.09 -0.45 0.04 -2.11 1.04 -1.26 -3.27 113.70 101.60 2wii s SER 816 Ca -0.12 0.32 0.04 0.00 0.48 0.00 0.00 55.95 56.67 2wii s SER 816 Cb 0.19 0.47 -0.02 0.00 0.10 0.00 0.00 66.02 66.75 2wii s SER 816 CO 0.81 -0.63 -0.13 0.68 0.98 0.00 0.00 173.24 174.95 2wii s VAL 817 N -1.84 1.03 0.23 5.02 -7.23 -0.38 -4.98 120.40 112.26 2wii s VAL 817 Ca -0.09 -0.98 -0.30 0.00 -1.81 0.00 0.00 61.98 58.81 2wii s VAL 817 Cb -0.01 -0.95 -0.09 0.00 0.56 0.00 0.00 36.38 35.89 2wii s VAL 817 CO 0.03 -0.03 1.07 -0.69 -0.31 0.00 0.00 175.10 175.17 2wii s VAL 818 N -0.87 3.76 0.44 1.32 1.01 -1.26 -1.43 120.40 123.37 2wii s VAL 818 Ca 0.00 1.66 -0.25 0.00 0.00 0.00 0.00 61.98 63.39 2wii s VAL 818 Cb -0.08 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 2wii s VAL 818 CO 0.01 0.35 1.40 -0.60 0.00 0.00 0.00 175.10 176.26 2wii s ARG 819 N -0.95 3.76 -0.72 2.72 3.52 -0.39 -2.77 118.95 124.12 2wii s ARG 819 Ca 0.46 2.36 0.00 0.00 -0.13 0.00 0.00 55.73 58.41 2wii s ARG 819 Cb -0.30 -2.68 0.00 0.00 -1.56 0.00 0.00 34.95 30.41 2wii s ARG 819 CO 0.37 -0.74 0.00 0.09 -0.81 0.00 0.00 175.30 174.21 2wii n ASN 820 N -0.11 -5.26 -4.45 -2.12 3.02 -0.58 -4.62 115.26 101.14 2wii n ASN 820 Ca 0.05 0.17 -0.35 0.00 -0.03 0.00 0.00 54.58 54.41 2wii n ASN 820 Cb 0.42 -3.35 -0.12 0.00 -0.61 0.00 0.00 39.78 36.11 2wii n ASN 820 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2wii s GLU 821 N -2.33 3.63 -0.15 3.52 2.02 -1.11 -5.00 118.70 119.27 2wii s GLU 821 Ca 0.00 -0.51 -0.29 0.00 0.02 0.00 0.00 54.97 54.19 2wii s GLU 821 Cb 0.00 -3.10 -0.04 0.00 0.10 0.00 0.00 34.13 31.09 2wii s GLU 821 CO 0.00 0.00 1.60 -1.14 0.02 0.00 0.00 175.26 175.74 2wii s GLN 822 N 1.04 3.97 0.31 1.61 0.74 -1.26 -4.48 119.66 121.59 2wii s GLN 822 Ca 0.02 1.86 0.07 0.00 0.05 0.00 0.00 55.36 57.36 2wii s GLN 822 Cb -0.14 -3.99 -0.06 0.00 1.10 0.00 0.00 33.01 29.91 2wii s GLN 822 CO 0.02 -1.08 -0.04 0.14 -0.55 0.00 0.00 175.29 173.78 2wii s VAL 823 N 4.63 1.70 -0.14 1.34 -7.23 -0.84 -5.00 120.40 114.85 2wii s VAL 823 Ca 0.71 -2.10 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2wii s VAL 823 Cb -0.28 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.08 2wii s VAL 823 CO 0.28 -0.20 -0.17 -0.70 -0.31 0.00 0.00 175.10 173.99 2wii s GLU 824 N -3.73 2.56 0.10 4.82 2.12 -1.26 -1.84 118.70 121.47 2wii s GLU 824 Ca 0.32 -0.68 0.04 0.00 0.36 0.00 0.00 54.97 55.01 2wii s GLU 824 Cb 0.05 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 32.21 2wii s GLU 824 CO 0.14 -0.13 0.06 0.96 -0.54 0.00 0.00 175.26 175.75 2wii s ILE 825 N 1.14 4.30 -0.19 -3.70 -4.36 0.36 -4.93 121.20 113.83 2wii s ILE 825 Ca -0.01 -0.93 -0.01 0.00 -0.26 0.00 0.00 60.65 59.44 2wii s ILE 825 Cb -0.14 -3.09 0.01 0.00 1.25 0.00 0.00 42.46 40.49 2wii s ILE 825 CO -0.06 0.07 -0.14 -0.13 0.24 0.00 0.00 174.94 174.92 2wii s ARG 826 N -2.50 3.14 -0.36 0.37 1.81 -1.26 -0.47 118.95 119.69 2wii s ARG 826 Ca 0.28 -0.75 -0.12 0.00 -1.72 0.00 0.00 55.73 53.42 2wii s ARG 826 Cb -0.12 -2.72 0.01 0.00 -0.45 0.00 0.00 34.95 31.67 2wii s ARG 826 CO 0.21 -0.18 0.22 0.00 -0.68 0.00 0.00 175.30 174.87 2wii s ALA 827 N 1.29 3.37 -0.26 2.13 0.00 -0.43 -2.50 121.76 125.36 2wii s ALA 827 Ca 0.04 -1.55 -0.11 0.00 0.00 0.00 0.00 51.96 50.34 2wii s ALA 827 Cb -0.14 -2.61 -0.05 0.00 0.00 0.00 0.00 23.12 20.33 2wii s ALA 827 CO -0.08 -1.17 0.17 0.08 0.00 0.00 0.00 175.76 174.76 2wii s VAL 828 N 1.63 5.33 -0.21 0.00 1.01 -0.95 -0.38 120.40 126.84 2wii s VAL 828 Ca 0.04 0.17 -0.12 0.00 0.00 0.00 0.00 61.98 62.07 2wii s VAL 828 Cb -0.18 -3.51 -0.05 0.00 0.00 0.00 0.00 36.38 32.64 2wii s VAL 828 CO 0.08 0.30 0.24 -0.76 0.00 0.00 0.00 175.10 174.96 2wii s LEU 829 N 1.37 4.17 -0.09 3.92 1.02 0.43 -0.44 118.68 129.05 2wii s LEU 829 Ca 0.07 0.30 -0.01 0.00 0.02 0.00 0.00 54.13 54.52 2wii s LEU 829 Cb -0.15 -2.25 -0.03 0.00 0.02 0.00 0.00 46.19 43.79 2wii s LEU 829 CO 0.07 0.06 -0.05 -0.31 0.02 0.00 0.00 176.35 176.14 2wii s TYR 830 N 0.88 2.99 -0.24 0.29 2.02 -0.37 -1.16 117.35 121.75 2wii s TYR 830 Ca 0.12 -0.03 -0.01 0.00 -0.37 0.00 0.00 57.07 56.78 2wii s TYR 830 Cb -0.13 -1.78 0.07 0.00 -0.40 0.00 0.00 41.96 39.72 2wii s TYR 830 CO 0.04 0.27 0.02 1.21 -1.57 0.00 0.00 175.55 175.51 2wii s ASN 831 N -0.55 3.59 -0.08 2.29 2.47 -0.88 -2.79 114.94 119.00 2wii s ASN 831 Ca 0.08 -1.19 0.18 0.00 0.42 0.00 0.00 52.86 52.36 2wii s ASN 831 Cb -0.12 -0.92 0.65 0.00 -1.45 0.00 0.00 41.25 39.41 2wii s ASN 831 CO 0.02 -0.31 1.55 -1.22 -3.72 0.00 0.00 177.10 173.43 2wii n TYR 832 N 4.83 1.22 -2.10 0.43 4.02 -0.19 -2.26 117.16 123.10 2wii n TYR 832 Ca -0.08 -0.59 -0.42 0.00 -0.01 0.00 0.00 57.90 56.80 2wii n TYR 832 Cb 0.45 -0.17 -0.03 0.00 -0.02 0.00 0.00 39.34 39.57 2wii n TYR 832 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2wii s ARG 833 N -1.61 4.25 0.17 -0.72 0.52 -1.26 -4.72 118.95 115.57 2wii s ARG 833 Ca 0.47 2.12 -0.18 0.00 -0.52 0.00 0.00 55.73 57.62 2wii s ARG 833 Cb 0.29 -3.53 0.09 0.00 0.52 0.00 0.00 34.95 32.32 2wii s ARG 833 CO 0.25 -0.62 1.66 0.37 0.02 0.00 0.00 175.30 176.98 2wii h GLN 834 N 7.86 -0.04 -1.50 3.54 5.75 -1.96 -3.07 115.11 125.70 2wii h GLN 834 Ca -0.40 0.00 -0.47 0.00 -0.15 0.00 0.00 58.65 57.63 2wii h GLN 834 Cb 1.19 0.01 -0.33 0.00 1.07 0.00 0.00 27.48 29.42 2wii h GLN 834 CO 0.91 -0.03 -0.96 0.27 -2.65 0.00 0.00 178.83 176.37 2wii n ASN 835 N -5.32 -0.50 -3.65 -0.69 0.23 -1.26 -4.44 115.26 99.63 2wii n ASN 835 Ca 0.02 -2.89 -0.02 0.00 -0.53 0.00 0.00 54.58 51.15 2wii n ASN 835 Cb 0.24 -0.02 -0.05 0.00 -2.08 0.00 0.00 39.78 37.87 2wii n ASN 835 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 2wii s GLN 836 N -0.87 0.55 0.36 -3.83 0.74 -1.25 -5.03 119.66 110.32 2wii s GLN 836 Ca 0.34 1.39 -0.21 0.00 0.05 0.00 0.00 55.36 56.93 2wii s GLN 836 Cb 0.21 0.78 -0.10 0.00 1.10 0.00 0.00 33.01 34.99 2wii s GLN 836 CO -0.13 -0.21 0.88 -1.83 -0.55 0.00 0.00 175.29 173.45 2wii s GLU 837 N 2.82 4.27 -0.06 1.67 -1.05 -1.26 -4.01 118.70 121.07 2wii s GLU 837 Ca -0.06 1.05 0.03 0.00 -0.15 0.00 0.00 54.97 55.85 2wii s GLU 837 Cb -0.12 -2.46 0.01 0.00 -0.44 0.00 0.00 34.13 31.12 2wii s GLU 837 CO -0.18 0.13 -0.15 -0.51 0.95 0.00 0.00 175.26 175.50 2wii s LEU 838 N -2.73 1.78 -0.49 1.83 1.43 -0.70 -4.98 118.68 114.81 2wii s LEU 838 Ca 0.55 -0.35 -0.20 0.00 -1.03 0.00 0.00 54.13 53.11 2wii s LEU 838 Cb -0.12 -0.94 0.04 0.00 0.03 0.00 0.00 46.19 45.20 2wii s LEU 838 CO 0.17 0.08 0.67 -0.75 0.23 0.00 0.00 176.35 176.75 2wii s LYS 839 N 0.46 3.20 -0.03 1.70 2.20 -1.26 -0.94 119.74 125.07 2wii s LYS 839 Ca -0.13 -0.62 0.02 0.00 -0.36 0.00 0.00 55.97 54.89 2wii s LYS 839 Cb -0.15 -4.04 -0.03 0.00 -1.51 0.00 0.00 37.83 32.10 2wii s LYS 839 CO 0.04 -1.18 -0.08 0.08 -0.36 0.00 0.00 175.35 173.86 2wii s VAL 840 N 2.87 3.60 -0.37 4.02 1.01 0.44 -0.68 120.40 131.29 2wii s VAL 840 Ca 0.20 -0.64 -0.05 0.00 0.00 0.00 0.00 61.98 61.48 2wii s VAL 840 Cb -0.16 -2.51 0.07 0.00 0.00 0.00 0.00 36.38 33.78 2wii s VAL 840 CO 0.15 0.50 0.16 -0.60 0.00 0.00 0.00 175.10 175.31 2wii s ARG 841 N -1.08 2.40 -0.16 2.72 3.52 -0.60 -0.26 118.95 125.48 2wii s ARG 841 Ca 0.14 -1.46 -0.15 0.00 -0.13 0.00 0.00 55.73 54.14 2wii s ARG 841 Cb -0.11 -3.53 -0.04 0.00 -1.56 0.00 0.00 34.95 29.71 2wii s ARG 841 CO 0.04 -0.85 0.33 0.54 -0.81 0.00 0.00 175.30 174.55 2wii s VAL 842 N 1.30 5.28 -0.01 7.11 0.11 -0.39 -2.83 120.40 130.97 2wii s VAL 842 Ca 0.02 0.62 0.07 0.00 -2.93 0.00 0.00 61.98 59.76 2wii s VAL 842 Cb -0.21 -3.67 -0.02 0.00 -1.53 0.00 0.00 36.38 30.95 2wii s VAL 842 CO -0.00 0.36 -0.22 -0.70 -3.33 0.00 0.00 175.10 171.20 2wii s GLU 843 N 0.63 1.76 -0.34 1.54 2.12 0.21 -1.54 118.70 123.08 2wii s GLU 843 Ca 0.18 -0.82 -0.11 0.00 0.36 0.00 0.00 54.97 54.58 2wii s GLU 843 Cb -0.14 -1.73 0.00 0.00 0.26 0.00 0.00 34.13 32.53 2wii s GLU 843 CO 0.05 0.47 0.19 -1.17 -0.54 0.00 0.00 175.26 174.27 2wii s LEU 844 N -0.62 4.44 0.64 2.70 2.96 -0.90 -1.54 118.68 126.36 2wii s LEU 844 Ca 0.09 -0.68 -0.17 0.00 -0.22 0.00 0.00 54.13 53.15 2wii s LEU 844 Cb -0.09 -2.04 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 2wii s LEU 844 CO -0.00 -0.28 1.19 -0.76 -1.32 0.00 0.00 176.35 175.18 2wii s LEU 845 N 1.62 3.53 0.46 -0.68 1.02 -0.98 -4.37 118.68 119.27 2wii s LEU 845 Ca 0.04 2.33 -0.20 0.00 0.02 0.00 0.00 54.13 56.32 2wii s LEU 845 Cb -0.18 -4.59 -0.10 0.00 0.02 0.00 0.00 46.19 41.34 2wii s LEU 845 CO 0.07 -1.78 0.96 -2.28 0.02 0.00 0.00 176.35 173.34 2wii s HIS 846 N -1.80 3.35 -0.23 0.29 5.65 -1.26 -4.80 115.29 116.49 2wii s HIS 846 Ca 0.75 1.57 -0.07 0.00 0.25 0.00 0.00 55.06 57.56 2wii s HIS 846 Cb -0.29 -2.84 0.11 0.00 -1.18 0.00 0.00 32.58 28.39 2wii s HIS 846 CO 0.37 -0.20 0.48 1.21 -0.65 0.00 0.00 174.74 175.96 2wii s ASN 847 N -2.45 -0.50 0.50 9.88 3.84 -1.26 -5.03 114.94 119.91 2wii s ASN 847 Ca 0.61 1.09 0.26 0.00 0.21 0.00 0.00 52.86 55.03 2wii s ASN 847 Cb -0.09 1.62 1.34 0.00 -0.55 0.00 0.00 41.25 43.56 2wii s ASN 847 CO 0.19 -0.23 1.89 -0.65 -2.79 0.00 0.00 177.10 175.50 2wii h PRO 848 N 8.12 0.13 -0.32 0.43 0.11 -1.97 -0.16 132.00 138.34 2wii h PRO 848 Ca -0.17 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 65.84 2wii h PRO 848 Cb 1.11 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2wii h PRO 848 CO 0.13 0.09 -0.19 0.00 -0.21 0.00 0.00 178.00 177.81 2wii h ALA 849 N 1.60 1.06 -2.27 -0.75 0.00 -1.96 -3.45 119.26 113.50 2wii h ALA 849 Ca 0.42 -0.33 -0.52 0.00 0.00 0.00 0.00 54.91 54.48 2wii h ALA 849 Cb 1.43 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 19.03 2wii h ALA 849 CO -0.06 0.57 -0.54 -0.06 0.00 0.00 0.00 179.25 179.16 2wii s PHE 850 N -4.62 3.09 -0.32 0.00 0.40 -0.07 -0.70 117.98 115.75 2wii s PHE 850 Ca -0.08 -0.11 0.03 0.00 -0.60 0.00 0.00 56.93 56.17 2wii s PHE 850 Cb 0.14 -1.40 0.09 0.00 0.51 0.00 0.00 43.02 42.35 2wii s PHE 850 CO 0.80 0.53 0.01 0.00 0.70 0.00 0.00 175.22 177.26 2wii n SER 852 N 4.36 1.19 0.31 0.00 3.41 -1.26 -1.86 113.62 119.76 2wii n SER 852 Ca -0.03 -3.16 0.19 0.00 -0.26 0.00 0.00 58.87 55.60 2wii n SER 852 Cb 0.42 1.04 1.00 0.00 -0.26 0.00 0.00 64.21 66.42 2wii n SER 852 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2wii h LEU 853 N 0.00 0.00 -9.37 1.04 3.38 -1.95 -3.41 115.31 105.00 2wii h LEU 853 Ca -0.31 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.11 2wii h LEU 853 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 2wii h LEU 853 CO 0.50 0.02 0.72 0.00 0.09 0.00 0.00 178.44 179.77 2wii s ALA 854 N -4.23 3.51 0.28 1.53 0.00 -1.26 -4.75 121.76 116.83 2wii s ALA 854 Ca -0.04 0.77 0.03 0.00 0.00 0.00 0.00 51.96 52.71 2wii s ALA 854 Cb 0.13 -3.53 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 2wii s ALA 854 CO 0.49 -0.74 0.06 0.95 0.00 0.00 0.00 175.76 176.52 2wii s THR 855 N 2.01 0.92 0.46 0.00 -4.23 -0.75 -4.73 115.64 109.31 2wii s THR 855 Ca 0.59 -2.01 0.40 0.00 -1.18 0.00 0.00 61.69 59.50 2wii s THR 855 Cb -0.28 -2.66 0.42 0.00 1.34 0.00 0.00 72.50 71.32 2wii s THR 855 CO 0.25 -0.06 2.23 0.71 -0.54 0.00 0.00 174.62 177.21 2wii h THR 856 N 2.28 0.00 0.02 3.99 1.35 -1.98 -3.17 112.91 115.40 2wii h THR 856 Ca -0.39 -0.14 -0.37 0.00 -0.55 0.00 0.00 66.41 64.95 2wii h THR 856 Cb 1.24 1.11 -0.05 0.00 -1.73 0.00 0.00 68.15 68.72 2wii h THR 856 CO 0.65 0.00 -2.11 0.29 -0.25 0.00 0.00 175.52 174.11 2wii n LYS 857 N -3.03 0.62 -4.61 4.72 5.02 -1.26 -4.97 118.16 114.65 2wii n LYS 857 Ca -0.02 0.33 -0.30 0.00 -2.02 0.00 0.00 58.31 56.30 2wii n LYS 857 Cb 0.13 -1.60 -0.13 0.00 -0.02 0.00 0.00 35.03 33.42 2wii n LYS 857 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2wii s ARG 858 N -2.48 1.91 0.40 1.97 1.70 -1.20 -5.13 118.95 116.12 2wii s ARG 858 Ca -0.33 -1.08 -0.07 0.00 -0.47 0.00 0.00 55.73 53.78 2wii s ARG 858 Cb 0.10 -2.11 -0.05 0.00 -0.57 0.00 0.00 34.95 32.32 2wii s ARG 858 CO 0.58 0.52 0.72 1.03 -1.08 0.00 0.00 175.30 177.07 2wii s ARG 859 N -1.60 3.66 -0.45 3.89 0.52 -1.26 -1.82 118.95 121.89 2wii s ARG 859 Ca 0.15 0.25 -0.05 0.00 -0.52 0.00 0.00 55.73 55.56 2wii s ARG 859 Cb -0.10 -2.45 0.12 0.00 0.52 0.00 0.00 34.95 33.04 2wii s ARG 859 CO 0.06 -0.03 0.27 -1.58 0.02 0.00 0.00 175.30 174.04 2wii s HIS 860 N -2.43 3.53 -0.03 -0.53 5.65 -1.26 -4.89 115.29 115.33 2wii s HIS 860 Ca 0.48 -2.30 0.05 0.00 0.25 0.00 0.00 55.06 53.54 2wii s HIS 860 Cb -0.10 -3.31 -0.01 0.00 -1.18 0.00 0.00 32.58 27.98 2wii s HIS 860 CO 0.36 -0.97 -0.17 -0.65 -0.65 0.00 0.00 174.74 172.66 2wii s GLN 861 N 1.07 1.56 -0.11 2.88 -0.21 -1.26 -2.12 119.66 121.46 2wii s GLN 861 Ca 0.09 -0.60 0.02 0.00 0.02 0.00 0.00 55.36 54.89 2wii s GLN 861 Cb -0.23 -1.42 0.02 0.00 1.00 0.00 0.00 33.01 32.37 2wii s GLN 861 CO -0.03 0.30 -0.15 -0.65 -2.12 0.00 0.00 175.29 172.63 2wii s GLN 862 N -0.16 2.27 -0.30 2.91 1.11 -0.59 -5.00 119.66 119.89 2wii s GLN 862 Ca 0.01 -0.57 -0.16 0.00 0.01 0.00 0.00 55.36 54.65 2wii s GLN 862 Cb -0.09 -1.94 -0.02 0.00 -1.01 0.00 0.00 33.01 29.95 2wii s GLN 862 CO 0.01 -0.08 0.42 0.99 0.01 0.00 0.00 175.29 176.64 2wii s THR 863 N 1.03 5.12 0.14 -0.19 2.01 -1.26 -1.26 115.64 121.23 2wii s THR 863 Ca -0.06 0.44 0.05 0.00 0.31 0.00 0.00 61.69 62.44 2wii s THR 863 Cb -0.15 -3.80 -0.04 0.00 0.01 0.00 0.00 72.50 68.52 2wii s THR 863 CO -0.02 0.01 -0.12 0.68 -0.69 0.00 0.00 174.62 174.47 2wii s VAL 864 N 2.17 1.30 -0.18 3.82 -7.23 0.64 -4.98 120.40 115.93 2wii s VAL 864 Ca 0.16 -1.94 -0.05 0.00 -1.81 0.00 0.00 61.98 58.33 2wii s VAL 864 Cb -0.16 -1.74 -0.03 0.00 0.56 0.00 0.00 36.38 35.01 2wii s VAL 864 CO 0.11 -0.60 0.01 -0.89 -0.31 0.00 0.00 175.10 173.42 2wii s THR 865 N -2.80 4.21 -0.31 5.32 2.01 -1.26 -0.42 115.64 122.38 2wii s THR 865 Ca 0.14 -0.24 -0.02 0.00 0.31 0.00 0.00 61.69 61.88 2wii s THR 865 Cb -0.01 -2.89 0.05 0.00 0.01 0.00 0.00 72.50 69.67 2wii s THR 865 CO 0.02 0.45 0.03 -0.63 -0.69 0.00 0.00 174.62 173.80 2wii s ILE 866 N 0.65 3.12 0.86 1.82 1.01 -0.12 -4.98 121.20 123.55 2wii s ILE 866 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 60.65 59.15 2wii s ILE 866 Cb -0.14 -2.81 0.11 0.00 0.01 0.00 0.00 42.46 39.63 2wii s ILE 866 CO 0.02 -0.16 1.15 -2.84 0.00 0.00 0.00 174.94 173.12 2wii s PRO 867 N 1.26 1.39 0.52 2.79 0.02 -1.26 -1.72 135.00 138.01 2wii s PRO 867 Ca -0.04 1.55 -0.22 0.00 0.02 0.00 0.00 61.00 62.31 2wii s PRO 867 Cb -0.20 -1.77 -0.06 0.00 0.02 0.00 0.00 34.50 32.50 2wii s PRO 867 CO -0.01 -2.35 1.33 -2.14 -0.33 0.00 0.00 177.00 173.50 2wii s PRO 868 N -4.53 3.29 -1.50 5.54 0.02 -1.26 -2.79 135.00 133.78 2wii s PRO 868 Ca 0.68 2.17 -0.03 0.00 0.02 0.00 0.00 61.00 63.84 2wii s PRO 868 Cb -0.23 -2.32 0.01 0.00 0.02 0.00 0.00 34.50 31.98 2wii s PRO 868 CO 0.55 -1.05 0.25 1.63 -0.33 0.00 0.00 177.00 178.06 2wii n LYS 869 N -0.86 -3.03 -4.23 5.54 5.02 -0.96 -4.95 118.16 114.69 2wii n LYS 869 Ca 0.09 0.82 -0.13 0.00 -2.02 0.00 0.00 58.31 57.08 2wii n LYS 869 Cb 0.45 -5.55 -0.10 0.00 -0.02 0.00 0.00 35.03 29.82 2wii n LYS 869 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2wii s SER 870 N -2.33 0.88 0.03 4.39 0.15 -1.10 -5.03 113.70 110.70 2wii s SER 870 Ca 0.15 -1.23 0.02 0.00 0.70 0.00 0.00 55.95 55.58 2wii s SER 870 Cb -0.07 0.19 -0.02 0.00 -1.71 0.00 0.00 66.02 64.41 2wii s SER 870 CO 0.18 -0.66 -0.07 -0.94 1.20 0.00 0.00 173.24 172.95 2wii s SER 871 N -3.16 0.79 -0.05 5.45 1.04 -1.26 -2.07 113.70 114.44 2wii s SER 871 Ca 0.27 -0.46 0.05 0.00 0.48 0.00 0.00 55.95 56.29 2wii s SER 871 Cb 0.07 0.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.20 2wii s SER 871 CO 0.06 -0.16 -0.21 -0.22 0.98 0.00 0.00 173.24 173.69 2wii s LEU 872 N -1.30 1.99 -0.29 2.42 0.20 -0.31 -4.97 118.68 116.42 2wii s LEU 872 Ca -0.08 -0.42 -0.11 0.00 0.69 0.00 0.00 54.13 54.21 2wii s LEU 872 Cb -0.08 -1.15 -0.04 0.00 -0.43 0.00 0.00 46.19 44.49 2wii s LEU 872 CO 0.00 0.20 0.18 -0.55 -0.29 0.00 0.00 176.35 175.89 2wii s SER 873 N -0.07 5.84 -0.38 3.68 0.15 -1.26 -0.42 113.70 121.23 2wii s SER 873 Ca -0.03 -0.15 -0.09 0.00 0.70 0.00 0.00 55.95 56.38 2wii s SER 873 Cb -0.12 -2.08 0.05 0.00 -1.71 0.00 0.00 66.02 62.16 2wii s SER 873 CO 0.03 -0.09 0.19 -0.69 1.20 0.00 0.00 173.24 173.88 2wii s VAL 874 N 1.72 4.17 0.54 4.45 1.01 0.49 -4.83 120.40 127.95 2wii s VAL 874 Ca 0.07 -1.16 -0.19 0.00 0.00 0.00 0.00 61.98 60.69 2wii s VAL 874 Cb -0.16 -3.43 -0.06 0.00 0.00 0.00 0.00 36.38 32.73 2wii s VAL 874 CO 0.09 -0.32 1.12 -2.84 0.00 0.00 0.00 175.10 173.15 2wii s PRO 875 N 1.45 3.40 -0.04 2.72 0.02 -1.26 -1.32 135.00 139.97 2wii s PRO 875 Ca 0.01 1.58 -0.02 0.00 0.02 0.00 0.00 61.00 62.60 2wii s PRO 875 Cb -0.21 -2.02 0.03 0.00 0.02 0.00 0.00 34.50 32.33 2wii s PRO 875 CO 0.04 -0.80 0.09 0.71 -0.33 0.00 0.00 177.00 176.70 2wii s TYR 876 N -1.80 -0.07 -0.26 6.54 2.02 0.38 -4.92 117.35 119.24 2wii s TYR 876 Ca 0.72 0.31 -0.06 0.00 -0.37 0.00 0.00 57.07 57.66 2wii s TYR 876 Cb -0.23 -0.14 -0.01 0.00 -0.40 0.00 0.00 41.96 41.18 2wii s TYR 876 CO 0.26 -0.12 0.05 0.08 -1.57 0.00 0.00 175.55 174.25 2wii s VAL 877 N 1.05 4.00 0.20 0.71 1.01 -1.26 -0.49 120.40 125.62 2wii s VAL 877 Ca -0.08 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.49 2wii s VAL 877 Cb -0.11 -2.94 -0.05 0.00 0.00 0.00 0.00 36.38 33.28 2wii s VAL 877 CO -0.04 0.25 -0.04 0.27 0.00 0.00 0.00 175.10 175.54 2wii s ILE 878 N 1.54 1.07 -0.21 2.22 -4.36 -0.76 -4.53 121.20 116.17 2wii s ILE 878 Ca 0.05 -2.04 -0.04 0.00 -0.26 0.00 0.00 60.65 58.36 2wii s ILE 878 Cb -0.16 -2.14 0.07 0.00 1.25 0.00 0.00 42.46 41.48 2wii s ILE 878 CO 0.02 -0.49 0.07 -0.69 0.24 0.00 0.00 174.94 174.09 2wii s VAL 879 N -3.40 0.25 0.34 8.37 1.01 -0.78 -1.99 120.40 124.21 2wii s VAL 879 Ca 0.24 -0.53 -0.29 0.00 0.00 0.00 0.00 61.98 61.40 2wii s VAL 879 Cb 0.04 -0.92 -0.11 0.00 0.00 0.00 0.00 36.38 35.39 2wii s VAL 879 CO 0.05 -0.36 1.52 -2.65 0.00 0.00 0.00 175.10 173.66 2wii n PRO 880 N 5.14 2.66 -0.09 2.72 -0.02 -1.26 -1.09 135.00 143.06 2wii n PRO 880 Ca -0.07 0.94 -0.17 0.00 -2.02 0.00 0.00 63.50 62.17 2wii n PRO 880 Cb 0.46 -2.68 -0.07 0.00 -0.02 0.00 0.00 33.50 31.19 2wii n PRO 880 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2wii n LEU 881 N 1.10 1.89 -4.43 2.45 4.77 0.12 -1.52 117.00 121.37 2wii n LEU 881 Ca 0.04 0.12 -0.32 0.00 -0.03 0.00 0.00 56.01 55.82 2wii n LEU 881 Cb 0.38 -0.57 -0.14 0.00 -2.33 0.00 0.00 43.42 40.76 2wii n LEU 881 CO 0.64 0.53 -0.50 -1.59 -1.33 0.00 0.00 177.39 175.14 2wii s LYS 882 N -2.34 2.27 0.85 3.23 -2.85 -1.25 -4.78 119.74 114.87 2wii s LYS 882 Ca -0.25 -0.84 -0.12 0.00 -1.00 0.00 0.00 55.97 53.76 2wii s LYS 882 Cb 0.09 -2.23 0.10 0.00 -2.06 0.00 0.00 37.83 33.73 2wii s LYS 882 CO 0.35 0.58 1.10 0.95 0.10 0.00 0.00 175.35 178.43 2wii s THR 883 N -0.76 2.80 0.00 3.79 -4.23 -1.26 -4.87 115.64 111.11 2wii s THR 883 Ca 0.12 0.26 0.00 0.00 -1.18 0.00 0.00 61.69 60.89 2wii s THR 883 Cb -0.10 -2.90 0.00 0.00 1.34 0.00 0.00 72.50 70.84 2wii s THR 883 CO 0.01 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.37 2wii n GLY 884 N -1.70 1.19 3.55 3.99 0.00 -0.98 -4.92 105.19 106.33 2wii n GLY 884 Ca 0.07 -2.21 -0.38 0.00 0.00 0.00 0.00 46.02 43.50 2wii n GLY 884 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2wii s LEU 885 N 0.00 3.27 0.34 0.99 2.96 -1.26 -1.90 118.68 123.08 2wii s LEU 885 Ca 0.00 0.18 0.05 0.00 -0.22 0.00 0.00 54.13 54.13 2wii s LEU 885 Cb 0.00 -2.53 -0.01 0.00 0.50 0.00 0.00 46.19 44.14 2wii s LEU 885 CO 0.00 -2.34 0.50 -1.10 -1.32 0.00 0.00 176.35 172.09 2wii s GLN 886 N 6.89 3.18 -0.06 1.98 -1.52 0.12 -4.91 119.66 125.34 2wii s GLN 886 Ca 0.64 -0.82 0.05 0.00 -1.95 0.00 0.00 55.36 53.28 2wii s GLN 886 Cb -0.12 -2.77 -0.02 0.00 -0.22 0.00 0.00 33.01 29.89 2wii s GLN 886 CO 0.18 0.06 -0.22 -2.00 -0.25 0.00 0.00 175.29 173.06 2wii s GLU 887 N -4.23 2.55 -0.09 2.91 2.12 -1.26 -0.95 118.70 119.75 2wii s GLU 887 Ca 0.44 -0.84 0.04 0.00 0.36 0.00 0.00 54.97 54.96 2wii s GLU 887 Cb -0.10 -2.23 0.00 0.00 0.26 0.00 0.00 34.13 32.06 2wii s GLU 887 CO 0.32 0.45 -0.22 0.08 -0.54 0.00 0.00 175.26 175.35 2wii s VAL 888 N -0.31 1.87 -0.04 3.70 1.01 -0.17 -4.97 120.40 121.49 2wii s VAL 888 Ca 0.01 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.10 2wii s VAL 888 Cb -0.13 -1.62 0.01 0.00 0.00 0.00 0.00 36.38 34.64 2wii s VAL 888 CO 0.02 0.52 -0.10 -0.70 0.00 0.00 0.00 175.10 174.84 2wii s GLU 889 N 0.33 1.21 -0.06 2.72 2.12 -1.26 -1.94 118.70 121.82 2wii s GLU 889 Ca -0.16 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 54.85 2wii s GLU 889 Cb -0.17 -1.08 0.02 0.00 0.26 0.00 0.00 34.13 33.16 2wii s GLU 889 CO 0.07 0.08 -0.07 0.08 -0.54 0.00 0.00 175.26 174.88 2wii s VAL 890 N 0.41 0.78 0.31 3.70 1.01 -0.28 -2.33 120.40 123.99 2wii s VAL 890 Ca -0.07 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 61.75 2wii s VAL 890 Cb -0.12 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.45 2wii s VAL 890 CO 0.01 0.28 -0.01 -0.54 0.00 0.00 0.00 175.10 174.85 2wii s LYS 891 N 0.95 2.11 -0.17 2.72 1.02 -0.59 -0.41 119.74 125.38 2wii s LYS 891 Ca -0.10 -1.64 -0.28 0.00 0.02 0.00 0.00 55.97 53.97 2wii s LYS 891 Cb -0.15 -1.99 0.08 0.00 -0.52 0.00 0.00 37.83 35.25 2wii s LYS 891 CO 0.00 0.22 0.74 0.00 -0.92 0.00 0.00 175.35 175.39 2wii s ALA 892 N -2.46 -1.80 -0.01 5.17 0.00 0.31 -0.62 121.76 122.36 2wii s ALA 892 Ca 0.33 1.68 -0.02 0.00 0.00 0.00 0.00 51.96 53.96 2wii s ALA 892 Cb -0.03 -0.65 -0.00 0.00 0.00 0.00 0.00 23.12 22.44 2wii s ALA 892 CO 0.19 -0.35 0.04 0.00 0.00 0.00 0.00 175.76 175.65 2wii s ALA 893 N -0.41 -0.09 0.01 0.00 0.00 -1.13 -1.29 121.76 118.86 2wii s ALA 893 Ca -0.05 -0.09 -0.07 0.00 0.00 0.00 0.00 51.96 51.75 2wii s ALA 893 Cb -0.03 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 2wii s ALA 893 CO 0.05 -0.09 0.28 0.14 0.00 0.00 0.00 175.76 176.13 2wii s VAL 894 N -0.58 5.29 0.39 0.00 -7.23 -1.12 -1.56 120.40 115.59 2wii s VAL 894 Ca -0.07 0.19 -0.24 0.00 -1.81 0.00 0.00 61.98 60.05 2wii s VAL 894 Cb -0.04 -3.57 -0.09 0.00 0.56 0.00 0.00 36.38 33.24 2wii s VAL 894 CO -0.00 0.37 1.06 -0.31 -0.31 0.00 0.00 175.10 175.90 2wii s TYR 895 N -1.30 3.28 -0.58 2.82 1.51 0.14 -3.65 117.35 119.58 2wii s TYR 895 Ca 0.27 1.65 0.00 0.00 -1.01 0.00 0.00 57.07 57.98 2wii s TYR 895 Cb -0.13 -3.14 0.00 0.00 -0.11 0.00 0.00 41.96 38.57 2wii s TYR 895 CO 0.16 -0.64 0.00 0.72 -1.11 0.00 0.00 175.55 174.68 2wii n HIS 896 N 0.02 0.00 -4.04 2.71 8.25 -0.03 -4.73 115.22 117.39 2wii n HIS 896 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.39 2wii n HIS 896 Cb 0.49 -2.14 -0.11 0.00 1.12 0.00 0.00 29.99 29.35 2wii n HIS 896 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2wii s HIS 897 N -1.59 0.52 -1.10 4.41 3.76 -1.24 -5.05 115.29 114.99 2wii s HIS 897 Ca 0.00 -0.55 -0.05 0.00 -0.15 0.00 0.00 55.06 54.30 2wii s HIS 897 Cb 0.00 -0.33 0.07 0.00 1.11 0.00 0.00 32.58 33.43 2wii s HIS 897 CO 0.00 -0.14 2.58 0.34 -0.85 0.00 0.00 174.74 176.67 2wii n PHE 898 N 1.39 2.25 -4.70 1.40 7.35 -1.26 -4.69 117.46 119.20 2wii n PHE 898 Ca -0.22 -2.60 -0.24 0.00 -0.76 0.00 0.00 57.45 53.63 2wii n PHE 898 Cb 0.55 -1.78 -0.15 0.00 0.35 0.00 0.00 39.48 38.45 2wii n PHE 898 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 2wii s ILE 899 N -1.02 1.21 0.03 -2.13 1.01 -1.26 -5.11 121.20 113.93 2wii s ILE 899 Ca 0.57 -0.62 -0.17 0.00 0.00 0.00 0.00 60.65 60.42 2wii s ILE 899 Cb 0.23 -1.02 0.03 0.00 0.01 0.00 0.00 42.46 41.71 2wii s ILE 899 CO -0.12 0.35 0.39 -0.94 0.00 0.00 0.00 174.94 174.62 2wii s SER 900 N -0.14 -0.26 0.16 3.58 1.04 -1.26 -2.79 113.70 114.03 2wii s SER 900 Ca 0.01 0.02 -0.20 0.00 0.48 0.00 0.00 55.95 56.27 2wii s SER 900 Cb -0.08 0.40 0.05 0.00 0.10 0.00 0.00 66.02 66.49 2wii s SER 900 CO 0.00 -0.62 0.52 -0.62 0.98 0.00 0.00 173.24 173.51 2wii s ASP 901 N -1.86 -0.39 0.09 7.02 2.15 -0.41 -5.02 116.67 118.24 2wii s ASP 901 Ca -0.07 -0.21 -0.26 0.00 0.43 0.00 0.00 52.55 52.45 2wii s ASP 901 Cb -0.01 0.55 0.08 0.00 -0.30 0.00 0.00 42.92 43.24 2wii s ASP 901 CO -0.01 -0.95 0.68 -0.83 -0.17 0.00 0.00 175.17 173.89 2wii s GLY 902 N -2.79 -0.57 -0.05 2.66 0.00 -1.26 -0.53 107.32 104.77 2wii s GLY 902 Ca 0.03 0.77 0.02 0.00 0.00 0.00 0.00 44.72 45.55 2wii s GLY 902 CO -0.11 0.35 -0.10 0.14 0.00 0.00 0.00 173.10 173.38 2wii s VAL 903 N -3.15 0.96 -0.58 1.40 1.01 0.45 -0.30 120.40 120.20 2wii s VAL 903 Ca -0.00 -0.40 0.04 0.00 0.00 0.00 0.00 61.98 61.62 2wii s VAL 903 Cb -0.01 -0.88 0.16 0.00 0.00 0.00 0.00 36.38 35.65 2wii s VAL 903 CO -0.08 0.31 0.40 -0.60 0.00 0.00 0.00 175.10 175.13 2wii s ARG 904 N 0.55 1.85 0.42 2.72 3.52 -0.48 -1.13 118.95 126.40 2wii s ARG 904 Ca -0.11 -2.77 0.06 0.00 -0.13 0.00 0.00 55.73 52.78 2wii s ARG 904 Cb -0.14 -2.74 0.01 0.00 -1.56 0.00 0.00 34.95 30.53 2wii s ARG 904 CO 0.02 -1.28 0.58 0.15 -0.81 0.00 0.00 175.30 173.96 2wii s LYS 905 N -0.71 2.87 -0.03 5.12 1.02 -0.82 -4.60 119.74 122.60 2wii s LYS 905 Ca 0.25 -1.09 0.03 0.00 0.02 0.00 0.00 55.97 55.18 2wii s LYS 905 Cb -0.07 -2.73 -0.00 0.00 -0.52 0.00 0.00 37.83 34.51 2wii s LYS 905 CO -0.14 -0.25 -0.12 -1.12 -0.92 0.00 0.00 175.35 172.81 2wii s SER 906 N -4.31 1.49 0.23 2.83 0.01 -1.26 -1.00 113.70 111.68 2wii s SER 906 Ca 0.53 -0.23 0.11 0.00 1.31 0.00 0.00 55.95 57.66 2wii s SER 906 Cb -0.10 -0.34 -0.05 0.00 0.21 0.00 0.00 66.02 65.74 2wii s SER 906 CO 0.33 0.11 -0.20 -1.48 0.41 0.00 0.00 173.24 172.42 2wii s LEU 907 N 0.03 2.53 -0.02 2.44 0.05 -0.13 -4.96 118.68 118.62 2wii s LEU 907 Ca -0.01 -0.97 -0.17 0.00 0.05 0.00 0.00 54.13 53.03 2wii s LEU 907 Cb -0.08 -0.99 -0.05 0.00 -2.05 0.00 0.00 46.19 43.01 2wii s LEU 907 CO 0.01 0.01 0.47 -0.54 -0.55 0.00 0.00 176.35 175.75 2wii s LYS 908 N -3.23 4.13 -0.29 1.48 1.02 -1.20 -0.70 119.74 120.94 2wii s LYS 908 Ca 0.24 0.51 -0.07 0.00 0.02 0.00 0.00 55.97 56.67 2wii s LYS 908 Cb -0.05 -3.30 0.00 0.00 -0.52 0.00 0.00 37.83 33.97 2wii s LYS 908 CO 0.11 0.50 0.08 0.08 -0.92 0.00 0.00 175.35 175.20 2wii s VAL 909 N -0.53 4.03 -0.12 3.17 1.01 -0.80 -1.24 120.40 125.93 2wii s VAL 909 Ca 0.26 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 2wii s VAL 909 Cb -0.17 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 2wii s VAL 909 CO 0.14 0.12 0.10 -0.69 0.00 0.00 0.00 175.10 174.77 2wii s VAL 910 N 1.52 5.20 0.91 2.92 1.01 -0.51 -2.31 120.40 129.13 2wii s VAL 910 Ca 0.03 0.09 -0.14 0.00 0.00 0.00 0.00 61.98 61.97 2wii s VAL 910 Cb -0.17 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 32.97 2wii s VAL 910 CO 0.03 0.61 0.40 -2.65 0.00 0.00 0.00 175.10 173.49 2wii n PRO 911 N 2.10 -0.16 0.24 2.72 -0.02 -1.26 -1.27 135.00 137.36 2wii n PRO 911 Ca -0.19 -0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.37 2wii n PRO 911 Cb 0.55 -1.83 0.62 0.00 -0.02 0.00 0.00 33.50 32.81 2wii n PRO 911 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2wii h GLU 912 N -1.30 0.00 0.00 -0.52 3.07 -1.95 -3.43 114.58 110.45 2wii h GLU 912 Ca -0.44 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.33 2wii h GLU 912 Cb 1.30 0.00 0.05 0.00 -0.84 0.00 0.00 28.75 29.26 2wii h GLU 912 CO 0.36 0.16 -0.02 0.41 -1.40 0.00 0.00 179.01 178.51 2wii n GLY 913 N -0.85 -3.33 3.18 -3.84 0.00 -1.26 -4.83 105.19 94.26 2wii n GLY 913 Ca -0.02 -1.32 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 2wii n GLY 913 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wii s ILE 914 N -1.35 1.76 0.12 -0.61 2.07 -0.86 -4.87 121.20 117.47 2wii s ILE 914 Ca 0.17 -0.87 -0.35 0.00 -1.41 0.00 0.00 60.65 58.18 2wii s ILE 914 Cb -0.02 -1.52 -0.16 0.00 0.13 0.00 0.00 42.46 40.88 2wii s ILE 914 CO 0.14 0.49 1.25 0.54 -1.91 0.00 0.00 174.94 175.45 2wii n ARG 915 N 3.36 1.09 -3.87 3.50 1.74 -1.26 -2.19 116.66 119.03 2wii n ARG 915 Ca -0.19 0.39 -0.11 0.00 -0.77 0.00 0.00 57.85 57.17 2wii n ARG 915 Cb 0.53 -1.97 -0.09 0.00 -1.02 0.00 0.00 32.46 29.90 2wii n ARG 915 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 2wii s MET 916 N 0.13 0.54 -0.09 5.56 -1.94 -0.12 -4.89 119.30 118.50 2wii s MET 916 Ca 0.80 -0.46 0.02 0.00 -1.71 0.00 0.00 55.69 54.34 2wii s MET 916 Cb -0.93 0.22 0.01 0.00 2.01 0.00 0.00 34.83 36.15 2wii s MET 916 CO 0.49 -0.14 -0.13 0.54 -0.01 0.00 0.00 175.02 175.78 2wii s ASN 917 N -1.58 2.09 -0.25 3.03 2.20 -1.26 -1.51 114.94 117.66 2wii s ASN 917 Ca -0.12 -0.35 -0.03 0.00 -0.94 0.00 0.00 52.86 51.42 2wii s ASN 917 Cb -0.06 -0.93 0.02 0.00 -2.00 0.00 0.00 41.25 38.28 2wii s ASN 917 CO 0.00 0.01 -0.04 -0.54 -2.94 0.00 0.00 177.10 173.59 2wii s LYS 918 N 0.92 3.00 -0.61 3.55 1.02 0.02 -4.92 119.74 122.72 2wii s LYS 918 Ca -0.09 -0.88 -0.27 0.00 0.02 0.00 0.00 55.97 54.75 2wii s LYS 918 Cb -0.15 -3.04 -0.00 0.00 -0.52 0.00 0.00 37.83 34.12 2wii s LYS 918 CO 0.00 -0.36 1.64 0.99 -0.92 0.00 0.00 175.35 176.71 2wii s THR 919 N 1.38 3.53 0.00 2.17 2.01 -1.26 -0.93 115.64 122.54 2wii s THR 919 Ca 0.02 0.36 -0.21 0.00 0.31 0.00 0.00 61.69 62.18 2wii s THR 919 Cb -0.16 -4.22 -0.21 0.00 0.01 0.00 0.00 72.50 67.91 2wii s THR 919 CO -0.03 -1.12 1.13 0.58 -0.69 0.00 0.00 174.62 174.49 2wii h VAL 920 N 6.60 1.44 -2.42 3.82 2.07 -0.60 -3.48 116.25 123.69 2wii h VAL 920 Ca -0.27 -1.90 -0.08 0.00 0.82 0.00 0.00 66.70 65.26 2wii h VAL 920 Cb 1.13 2.48 -0.21 0.00 -1.52 0.00 0.00 31.29 33.17 2wii h VAL 920 CO 1.21 0.55 -0.03 0.00 0.02 0.00 0.00 177.57 179.32 2wii s ALA 921 N -3.40 -1.36 -0.26 1.67 0.00 -1.14 -4.92 121.76 112.35 2wii s ALA 921 Ca -0.14 1.19 -0.02 0.00 0.00 0.00 0.00 51.96 53.00 2wii s ALA 921 Cb 0.03 -0.38 0.08 0.00 0.00 0.00 0.00 23.12 22.85 2wii s ALA 921 CO 0.79 -0.30 0.07 0.08 0.00 0.00 0.00 175.76 176.40 2wii s VAL 922 N -0.57 0.69 -0.06 0.00 1.01 -1.26 -0.91 120.40 119.30 2wii s VAL 922 Ca -0.07 -1.01 0.06 0.00 0.00 0.00 0.00 61.98 60.96 2wii s VAL 922 Cb -0.03 -1.37 -0.01 0.00 0.00 0.00 0.00 36.38 34.97 2wii s VAL 922 CO 0.05 -0.47 -0.24 -0.13 0.00 0.00 0.00 175.10 174.30 2wii s ARG 923 N 1.74 2.48 -0.13 2.72 1.81 0.50 -4.99 118.95 123.09 2wii s ARG 923 Ca 0.05 -0.88 -0.25 0.00 -1.72 0.00 0.00 55.73 52.92 2wii s ARG 923 Cb -0.17 -2.11 -0.02 0.00 -0.45 0.00 0.00 34.95 32.20 2wii s ARG 923 CO -0.19 0.37 0.80 0.99 -0.68 0.00 0.00 175.30 176.59 2wii s THR 924 N -0.16 4.93 -0.34 0.02 2.01 -1.26 -0.54 115.64 120.30 2wii s THR 924 Ca -0.03 1.59 -0.17 0.00 0.31 0.00 0.00 61.69 63.38 2wii s THR 924 Cb -0.14 -4.12 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 2wii s THR 924 CO 0.03 0.10 0.48 -0.76 -0.69 0.00 0.00 174.62 173.79 2wii s LEU 925 N 1.70 4.34 -0.50 4.42 1.43 -0.24 -4.96 118.68 124.87 2wii s LEU 925 Ca 0.39 -0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.53 2wii s LEU 925 Cb -0.17 -2.54 0.19 0.00 0.03 0.00 0.00 46.19 43.70 2wii s LEU 925 CO 0.15 -0.44 0.67 -0.67 0.23 0.00 0.00 176.35 176.29 2wii n ASP 926 N 5.66 -2.84 0.02 2.29 -0.08 -1.26 -0.33 116.55 120.00 2wii n ASP 926 Ca -0.06 -2.84 -0.11 0.00 -1.51 0.00 0.00 54.79 50.27 2wii n ASP 926 Cb 0.49 1.31 -0.04 0.00 2.34 0.00 0.00 41.12 45.22 2wii n ASP 926 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2wii h PRO 927 N 5.03 -0.39 0.00 -0.67 0.11 -1.80 0.90 132.00 135.19 2wii h PRO 927 Ca 0.08 0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 2wii h PRO 927 Cb 1.06 0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 2wii h PRO 927 CO 0.10 -0.26 -0.02 0.93 -0.21 0.00 0.00 178.00 178.55 2wii h GLU 928 N -0.40 0.00 0.00 1.05 4.39 -1.81 0.25 114.58 118.06 2wii h GLU 928 Ca 0.09 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.54 2wii h GLU 928 Cb 0.53 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.14 2wii h GLU 928 CO -0.32 0.02 -1.96 -2.13 -1.16 0.00 0.00 179.01 173.46 2wii n ARG 929 N -3.80 1.03 -0.00 2.33 0.63 -0.66 -4.66 116.66 111.54 2wii n ARG 929 Ca -0.03 0.05 0.05 0.00 -0.92 0.00 0.00 57.85 57.01 2wii n ARG 929 Cb 0.10 -1.35 -0.07 0.00 0.45 0.00 0.00 32.46 31.60 2wii n ARG 929 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2wii n LEU 930 N -2.78 0.41 -5.01 6.15 4.77 0.31 -5.04 117.00 115.80 2wii n LEU 930 Ca -0.27 -0.40 -0.20 0.00 -0.03 0.00 0.00 56.01 55.12 2wii n LEU 930 Cb 0.87 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 42.02 2wii n LEU 930 CO 0.22 0.10 0.33 -0.83 -1.33 0.00 0.00 177.39 175.88 2wii s GLY 931 N -2.29 1.82 -0.05 -0.72 0.00 0.89 -4.94 107.32 102.03 2wii s GLY 931 Ca 0.02 -1.80 0.05 0.00 0.00 0.00 0.00 44.72 42.99 2wii s GLY 931 CO 0.45 -1.43 -0.19 1.09 0.00 0.00 0.00 173.10 173.01 2wii s ARG 932 N -4.67 2.52 -1.63 2.90 1.70 0.12 -4.58 118.95 115.30 2wii s ARG 932 Ca 0.60 -0.80 0.00 0.00 -0.47 0.00 0.00 55.73 55.06 2wii s ARG 932 Cb -0.08 -2.28 0.00 0.00 -0.57 0.00 0.00 34.95 32.03 2wii s ARG 932 CO 0.38 0.51 0.00 0.39 -1.08 0.00 0.00 175.30 175.50 2wii n GLU 933 N 2.62 -1.50 -0.21 3.89 4.71 -1.26 -1.31 120.64 127.59 2wii n GLU 933 Ca -0.17 0.91 0.00 0.00 -0.01 0.00 0.00 57.16 57.89 2wii n GLU 933 Cb 0.52 -5.28 0.00 0.00 -1.01 0.00 0.00 31.44 25.66 2wii n GLU 933 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2wii n GLY 934 N -0.43 0.63 3.29 0.62 0.00 -1.26 -5.06 105.19 102.97 2wii n GLY 934 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 2wii n GLY 934 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2wii s VAL 935 N -2.45 1.85 -0.13 1.61 -7.23 -0.43 -3.98 120.40 109.66 2wii s VAL 935 Ca 0.00 -1.32 0.02 0.00 -1.81 0.00 0.00 61.98 58.87 2wii s VAL 935 Cb 0.00 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.34 2wii s VAL 935 CO 0.00 0.23 -0.19 -1.58 -0.31 0.00 0.00 175.10 173.25 2wii s GLN 936 N -1.30 2.69 -0.11 4.82 0.74 0.34 0.10 119.66 126.94 2wii s GLN 936 Ca 0.09 -0.73 -0.01 0.00 0.05 0.00 0.00 55.36 54.76 2wii s GLN 936 Cb -0.09 -2.21 -0.03 0.00 1.10 0.00 0.00 33.01 31.78 2wii s GLN 936 CO 0.02 -0.04 -0.07 0.15 -0.55 0.00 0.00 175.29 174.81 2wii s LYS 937 N 0.90 3.19 -0.19 1.67 1.02 -1.26 -1.10 119.74 123.96 2wii s LYS 937 Ca -0.07 -0.56 -0.01 0.00 0.02 0.00 0.00 55.97 55.36 2wii s LYS 937 Cb -0.15 -2.72 0.05 0.00 -0.52 0.00 0.00 37.83 34.49 2wii s LYS 937 CO -0.02 0.44 -0.01 -1.21 -0.92 0.00 0.00 175.35 173.64 2wii s GLU 938 N -0.21 1.07 -0.32 1.68 0.41 0.52 -4.98 118.70 116.87 2wii s GLU 938 Ca 0.03 -0.55 -0.21 0.00 -0.41 0.00 0.00 54.97 53.83 2wii s GLU 938 Cb -0.13 -2.14 -0.00 0.00 -1.78 0.00 0.00 34.13 30.08 2wii s GLU 938 CO 0.03 -0.56 0.66 -0.51 -0.49 0.00 0.00 175.26 174.39 2wii s ASP 939 N 1.70 6.51 -0.17 -0.19 1.01 -1.26 -0.48 116.67 123.78 2wii s ASP 939 Ca -0.01 0.41 -0.10 0.00 0.71 0.00 0.00 52.55 53.55 2wii s ASP 939 Cb -0.17 -2.34 -0.05 0.00 1.01 0.00 0.00 42.92 41.37 2wii s ASP 939 CO -0.07 -0.53 0.17 -0.63 0.21 0.00 0.00 175.17 174.32 2wii s ILE 940 N 2.70 5.40 0.52 0.77 -1.09 0.09 -5.00 121.20 124.59 2wii s ILE 940 Ca 0.26 0.29 -0.14 0.00 -2.23 0.00 0.00 60.65 58.83 2wii s ILE 940 Cb -0.15 -3.50 -0.07 0.00 -1.58 0.00 0.00 42.46 37.17 2wii s ILE 940 CO 0.13 0.47 0.96 -2.84 -1.23 0.00 0.00 174.94 172.43 2wii s PRO 941 N 0.07 3.85 0.66 2.79 0.02 -1.26 -2.14 135.00 138.98 2wii s PRO 941 Ca 0.12 0.83 -0.16 0.00 0.02 0.00 0.00 61.00 61.81 2wii s PRO 941 Cb -0.12 -2.16 -0.00 0.00 0.02 0.00 0.00 34.50 32.24 2wii s PRO 941 CO 0.01 -0.30 1.14 -1.25 -0.33 0.00 0.00 177.00 176.27 2wii s PRO 942 N -4.28 2.73 0.60 5.54 0.04 -1.26 -4.76 135.00 133.61 2wii s PRO 942 Ca 0.57 1.52 -0.18 0.00 0.04 0.00 0.00 61.00 62.95 2wii s PRO 942 Cb -0.10 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 2wii s PRO 942 CO 0.36 -1.33 1.15 0.00 0.04 0.00 0.00 177.00 177.22 2wii s ALA 943 N -2.15 2.55 0.03 8.56 0.00 -1.26 -4.98 121.76 124.51 2wii s ALA 943 Ca 0.70 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 53.31 2wii s ALA 943 Cb -0.23 -3.38 -0.09 0.00 0.00 0.00 0.00 23.12 19.41 2wii s ALA 943 CO 0.40 -1.09 1.25 0.22 0.00 0.00 0.00 175.76 176.54 2wii h ASP 944 N 0.72 -0.55 -6.36 0.00 1.82 -1.99 -3.46 116.42 106.60 2wii h ASP 944 Ca -0.49 0.03 -0.48 0.00 -0.39 0.00 0.00 57.03 55.69 2wii h ASP 944 Cb 1.27 0.15 -0.05 0.00 0.68 0.00 0.00 39.33 41.38 2wii h ASP 944 CO 0.55 -0.35 -0.80 0.18 -1.61 0.00 0.00 179.24 177.21 2wii n LEU 945 N -3.65 -2.47 0.12 2.28 4.77 -1.26 -4.86 117.00 111.93 2wii n LEU 945 Ca -0.07 -0.85 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 2wii n LEU 945 Cb 0.23 -2.46 0.03 0.00 -2.33 0.00 0.00 43.42 38.89 2wii n LEU 945 CO 0.16 0.42 0.41 0.77 -1.33 0.00 0.00 177.39 177.83 2wii h SER 946 N -1.92 0.00 -0.53 -1.43 4.64 -2.02 -3.22 113.55 109.06 2wii h SER 946 Ca -0.59 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.73 2wii h SER 946 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 2wii h SER 946 CO 0.67 0.62 0.00 -0.90 -0.87 0.00 0.00 176.83 176.35 2wii n ASP 947 N -3.31 3.30 -4.76 4.97 5.75 -1.26 -4.98 116.55 116.26 2wii n ASP 947 Ca 0.01 -1.98 -0.41 0.00 -0.01 0.00 0.00 54.79 52.40 2wii n ASP 947 Cb 0.76 -0.35 -0.01 0.00 -1.03 0.00 0.00 41.12 40.48 2wii n ASP 947 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2wii s GLN 948 N -1.29 4.10 0.18 0.11 0.74 -1.22 -0.91 119.66 121.38 2wii s GLN 948 Ca 0.41 2.60 -0.31 0.00 0.05 0.00 0.00 55.36 58.12 2wii s GLN 948 Cb 0.22 -3.00 -0.09 0.00 1.10 0.00 0.00 33.01 31.23 2wii s GLN 948 CO 0.30 -0.63 1.44 0.08 -0.55 0.00 0.00 175.29 175.92 2wii s VAL 949 N -0.23 2.91 0.44 1.34 1.01 0.48 -4.73 120.40 121.61 2wii s VAL 949 Ca 0.61 0.70 -0.25 0.00 0.00 0.00 0.00 61.98 63.04 2wii s VAL 949 Cb -0.48 -3.45 -0.09 0.00 0.00 0.00 0.00 36.38 32.36 2wii s VAL 949 CO 0.52 0.08 1.23 -2.65 0.00 0.00 0.00 175.10 174.28 2wii n PRO 950 N 3.23 1.79 -3.06 2.72 -0.02 -1.26 -3.03 135.00 135.37 2wii n PRO 950 Ca 0.10 0.64 -0.21 0.00 -2.02 0.00 0.00 63.50 62.01 2wii n PRO 950 Cb 0.41 -2.35 0.04 0.00 -0.02 0.00 0.00 33.50 31.58 2wii n PRO 950 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2wii n ASP 951 N 0.08 -5.85 -4.01 2.55 2.03 -1.26 -5.01 116.55 105.08 2wii n ASP 951 Ca 0.08 -0.31 -0.20 0.00 0.52 0.00 0.00 54.79 54.88 2wii n ASP 951 Cb 0.40 -4.64 -0.15 0.00 -0.72 0.00 0.00 41.12 36.01 2wii n ASP 951 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2wii s THR 952 N -3.16 0.76 0.34 5.18 -4.23 -1.17 -5.05 115.64 108.31 2wii s THR 952 Ca 0.33 -0.36 -0.11 0.00 -1.18 0.00 0.00 61.69 60.37 2wii s THR 952 Cb -0.14 -0.66 -0.07 0.00 1.34 0.00 0.00 72.50 72.96 2wii s THR 952 CO 0.41 0.23 0.70 -1.83 -0.54 0.00 0.00 174.62 173.58 2wii s GLU 953 N 0.09 3.82 0.36 3.99 -1.05 -1.26 -4.92 118.70 119.72 2wii s GLU 953 Ca -0.01 0.43 0.07 0.00 -0.15 0.00 0.00 54.97 55.30 2wii s GLU 953 Cb -0.07 -2.47 -0.07 0.00 -0.44 0.00 0.00 34.13 31.07 2wii s GLU 953 CO 0.00 0.10 -0.01 -1.54 0.95 0.00 0.00 175.26 174.77 2wii s SER 954 N -2.81 3.29 -0.03 0.83 1.04 -1.26 -4.71 113.70 110.06 2wii s SER 954 Ca 0.50 -1.31 0.00 0.00 0.48 0.00 0.00 55.95 55.62 2wii s SER 954 Cb -0.10 -0.27 0.03 0.00 0.10 0.00 0.00 66.02 65.77 2wii s SER 954 CO 0.26 -0.43 0.01 -0.70 0.98 0.00 0.00 173.24 173.35 2wii s GLU 955 N -3.74 0.24 -0.21 4.02 2.12 -0.64 -4.43 118.70 116.05 2wii s GLU 955 Ca 0.34 0.09 -0.07 0.00 0.36 0.00 0.00 54.97 55.69 2wii s GLU 955 Cb 0.07 -0.43 -0.04 0.00 0.26 0.00 0.00 34.13 33.99 2wii s GLU 955 CO 0.16 -0.14 0.07 0.99 -0.54 0.00 0.00 175.26 175.80 2wii s THR 956 N 1.01 4.59 -0.13 -1.70 2.01 -0.29 -0.98 115.64 120.14 2wii s THR 956 Ca -0.10 -0.09 -0.10 0.00 0.31 0.00 0.00 61.69 61.71 2wii s THR 956 Cb -0.13 -3.10 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 2wii s THR 956 CO -0.02 0.41 0.20 -0.13 -0.69 0.00 0.00 174.62 174.38 2wii s ARG 957 N 0.90 3.82 -0.37 4.92 0.52 0.13 -1.78 118.95 127.08 2wii s ARG 957 Ca 0.04 -0.05 -0.02 0.00 -0.52 0.00 0.00 55.73 55.18 2wii s ARG 957 Cb -0.14 -3.29 0.09 0.00 0.52 0.00 0.00 34.95 32.13 2wii s ARG 957 CO 0.03 0.56 0.13 0.42 0.02 0.00 0.00 175.30 176.46 2wii s ILE 958 N -0.45 3.15 -0.24 1.52 1.01 0.58 -1.72 121.20 125.04 2wii s ILE 958 Ca 0.15 -1.85 -0.12 0.00 0.00 0.00 0.00 60.65 58.83 2wii s ILE 958 Cb -0.13 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 2wii s ILE 958 CO 0.04 -0.50 0.23 -0.76 0.00 0.00 0.00 174.94 173.95 2wii s LEU 959 N 1.17 4.10 -0.06 2.97 1.43 0.59 -1.87 118.68 127.00 2wii s LEU 959 Ca 0.04 0.18 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 2wii s LEU 959 Cb -0.21 -2.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.77 2wii s LEU 959 CO -0.03 -0.01 -0.20 -0.76 0.23 0.00 0.00 176.35 175.58 2wii s LEU 960 N 1.34 2.40 -0.16 1.79 1.43 0.53 -1.55 118.68 124.46 2wii s LEU 960 Ca 0.10 -0.37 -0.10 0.00 -1.03 0.00 0.00 54.13 52.74 2wii s LEU 960 Cb -0.14 -1.47 0.05 0.00 0.03 0.00 0.00 46.19 44.66 2wii s LEU 960 CO 0.07 0.28 0.40 -1.58 0.23 0.00 0.00 176.35 175.74 2wii s GLN 961 N -0.35 0.39 0.62 1.70 0.74 -1.00 -1.17 119.66 120.60 2wii s GLN 961 Ca 0.02 0.73 -0.16 0.00 0.05 0.00 0.00 55.36 56.00 2wii s GLN 961 Cb -0.12 0.02 -0.02 0.00 1.10 0.00 0.00 33.01 33.98 2wii s GLN 961 CO 0.02 -0.14 1.10 0.20 -0.55 0.00 0.00 175.29 175.92 2wii s GLY 962 N 1.17 2.24 -0.54 2.59 0.00 0.93 -0.31 107.32 113.39 2wii s GLY 962 Ca -0.08 0.56 -0.00 0.00 0.00 0.00 0.00 44.72 45.20 2wii s GLY 962 CO -0.10 0.91 0.32 -1.59 0.00 0.00 0.00 173.10 172.64 2wii s THR 963 N -2.26 3.21 0.15 0.90 2.01 0.71 -4.43 115.64 115.93 2wii s THR 963 Ca 0.67 -2.87 -0.31 0.00 0.31 0.00 0.00 61.69 59.49 2wii s THR 963 Cb -0.20 -3.16 -0.10 0.00 0.01 0.00 0.00 72.50 69.04 2wii s THR 963 CO 0.38 -0.80 1.73 -2.84 -0.69 0.00 0.00 174.62 172.40 2wii s PRO 964 N 0.14 4.15 -0.19 4.92 0.02 -1.26 -4.33 135.00 138.45 2wii s PRO 964 Ca 0.15 2.52 0.01 0.00 0.02 0.00 0.00 61.00 63.70 2wii s PRO 964 Cb -0.22 -3.38 0.04 0.00 0.02 0.00 0.00 34.50 30.96 2wii s PRO 964 CO -0.03 -0.77 -0.11 0.08 -0.33 0.00 0.00 177.00 175.85 2wii s VAL 965 N 2.04 1.63 0.54 3.83 1.01 -1.26 -5.12 120.40 123.07 2wii s VAL 965 Ca 0.76 -0.96 -0.21 0.00 0.00 0.00 0.00 61.98 61.58 2wii s VAL 965 Cb -0.46 -1.68 -0.05 0.00 0.00 0.00 0.00 36.38 34.19 2wii s VAL 965 CO 0.34 0.20 1.22 0.00 0.00 0.00 0.00 175.10 176.86 2wii s ALA 966 N 1.41 2.73 -0.17 5.51 0.00 -1.26 -2.41 121.76 127.57 2wii s ALA 966 Ca -0.00 1.04 -0.29 0.00 0.00 0.00 0.00 51.96 52.70 2wii s ALA 966 Cb -0.16 -3.45 -0.00 0.00 0.00 0.00 0.00 23.12 19.51 2wii s ALA 966 CO -0.08 -1.03 1.07 -1.14 0.00 0.00 0.00 175.76 174.57 2wii s GLN 967 N -3.07 4.32 -0.98 0.00 2.00 -1.26 -4.64 119.66 116.02 2wii s GLN 967 Ca 0.72 1.43 -0.24 0.00 -2.00 0.00 0.00 55.36 55.28 2wii s GLN 967 Cb -0.31 -3.62 -0.01 0.00 0.80 0.00 0.00 33.01 29.87 2wii s GLN 967 CO 0.36 -0.53 1.77 -1.64 -0.50 0.00 0.00 175.29 174.75 2wii s MET 968 N 2.78 2.97 -0.16 1.67 -1.94 -1.26 -4.94 119.30 118.43 2wii s MET 968 Ca 0.48 -0.73 -0.03 0.00 -1.71 0.00 0.00 55.69 53.69 2wii s MET 968 Cb -0.18 -5.20 -0.03 0.00 2.01 0.00 0.00 34.83 31.44 2wii s MET 968 CO 0.12 -2.97 -0.04 0.99 -0.01 0.00 0.00 175.02 173.10 2wii s THR 969 N 8.13 3.81 0.37 2.05 2.01 -1.26 -5.09 115.64 125.66 2wii s THR 969 Ca 0.61 -0.39 -0.28 0.00 0.31 0.00 0.00 61.69 61.94 2wii s THR 969 Cb -0.03 -2.67 -0.11 0.00 0.01 0.00 0.00 72.50 69.70 2wii s THR 969 CO -0.02 0.49 1.51 -1.61 -0.69 0.00 0.00 174.62 174.30 2wii s GLU 970 N 0.40 4.10 0.49 4.92 0.41 -1.26 -4.93 118.70 122.84 2wii s GLU 970 Ca -0.04 2.59 -0.24 0.00 -0.41 0.00 0.00 54.97 56.86 2wii s GLU 970 Cb -0.14 -2.97 -0.07 0.00 -1.78 0.00 0.00 34.13 29.17 2wii s GLU 970 CO 0.03 -0.56 1.41 -0.51 -0.49 0.00 0.00 175.26 175.15 2wii s ASP 971 N -0.05 5.61 0.61 -0.19 1.01 -1.26 -4.99 116.67 117.40 2wii s ASP 971 Ca 0.54 2.89 -0.13 0.00 0.71 0.00 0.00 52.55 56.56 2wii s ASP 971 Cb -0.47 -2.65 -0.04 0.00 1.01 0.00 0.00 42.92 40.77 2wii s ASP 971 CO 0.62 -1.35 1.03 0.00 0.21 0.00 0.00 175.17 175.67 2wii s ALA 972 N -1.23 2.96 0.12 5.23 0.00 -1.26 -4.98 121.76 122.60 2wii s ALA 972 Ca 0.65 0.07 -0.31 0.00 0.00 0.00 0.00 51.96 52.37 2wii s ALA 972 Cb -0.43 -3.13 -0.10 0.00 0.00 0.00 0.00 23.12 19.47 2wii s ALA 972 CO 0.54 -0.71 1.68 0.08 0.00 0.00 0.00 175.76 177.35 2wii s VAL 973 N -2.93 2.69 0.27 0.00 1.01 -1.26 -4.91 120.40 115.27 2wii s VAL 973 Ca 0.58 0.32 -0.30 0.00 0.00 0.00 0.00 61.98 62.57 2wii s VAL 973 Cb -0.12 -3.20 -0.13 0.00 0.00 0.00 0.00 36.38 32.93 2wii s VAL 973 CO 0.47 0.01 1.35 -0.67 0.00 0.00 0.00 175.10 176.25 2wii n ASP 974 N 5.00 2.65 0.09 3.32 2.03 -1.26 -4.87 116.55 123.51 2wii n ASP 974 Ca 0.16 1.16 0.04 0.00 0.52 0.00 0.00 54.79 56.67 2wii n ASP 974 Cb 0.39 -1.43 0.44 0.00 -0.72 0.00 0.00 41.12 39.80 2wii n ASP 974 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2wii h ALA 975 N 3.58 1.67 0.00 -1.67 0.00 -1.91 -1.99 119.26 118.94 2wii h ALA 975 Ca -0.45 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.36 2wii h ALA 975 Cb 1.28 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2wii h ALA 975 CO 0.71 0.26 -0.03 1.49 0.00 0.00 0.00 179.25 181.67 2wii h GLU 976 N 0.33 0.00 0.00 0.00 4.81 -1.90 -1.20 114.58 116.62 2wii h GLU 976 Ca 0.08 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 2wii h GLU 976 Cb 0.13 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.51 2wii h GLU 976 CO -0.00 0.03 -0.11 0.00 -0.73 0.00 0.00 179.01 178.20 2wii h ARG 977 N 0.00 0.00 -0.67 1.92 2.47 -1.72 -3.24 114.38 113.15 2wii h ARG 977 Ca -0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2wii h ARG 977 Cb 0.18 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.50 2wii h ARG 977 CO 0.00 0.11 0.00 1.28 0.56 0.00 0.00 179.97 181.92 2wii n LEU 978 N -3.23 3.66 0.09 3.04 4.77 -0.45 -4.37 117.00 120.52 2wii n LEU 978 Ca 0.01 -1.83 0.10 0.00 -0.03 0.00 0.00 56.01 54.25 2wii n LEU 978 Cb 0.39 -0.46 0.57 0.00 -2.33 0.00 0.00 43.42 41.59 2wii n LEU 978 CO 0.31 0.87 1.13 0.11 -1.33 0.00 0.00 177.39 178.48 2wii h LYS 979 N 3.87 0.20 0.00 3.23 1.79 -1.68 -1.78 116.57 122.20 2wii h LYS 979 Ca 0.00 -0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.44 2wii h LYS 979 Cb 0.95 -0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.55 2wii h LYS 979 CO 0.03 0.13 -0.09 1.12 -1.08 0.00 0.00 179.45 179.56 2wii h HIS 980 N 0.21 0.00 -0.10 -1.35 2.07 -1.88 -3.26 115.15 110.84 2wii h HIS 980 Ca 0.13 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.58 2wii h HIS 980 Cb 0.25 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.22 2wii h HIS 980 CO -0.00 0.09 -0.24 -0.07 -3.07 0.00 0.00 177.93 174.64 2wii h LEU 981 N 0.00 0.17 -8.63 6.12 3.38 -1.63 -3.40 115.31 111.32 2wii h LEU 981 Ca -0.00 -0.05 -0.51 0.00 0.09 0.00 0.00 57.88 57.41 2wii h LEU 981 Cb 0.99 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2wii h LEU 981 CO 0.01 0.41 1.42 -0.63 0.09 0.00 0.00 178.44 179.75 2wii s ILE 982 N -4.50 3.27 0.00 1.22 -1.09 -1.23 -2.66 121.20 116.21 2wii s ILE 982 Ca -0.05 0.20 0.05 0.00 -2.23 0.00 0.00 60.65 58.62 2wii s ILE 982 Cb 0.15 -3.59 -0.02 0.00 -1.58 0.00 0.00 42.46 37.43 2wii s ILE 982 CO 0.74 -0.52 -0.16 -0.69 -1.23 0.00 0.00 174.94 173.07 2wii s VAL 983 N 9.40 1.26 -0.29 2.92 1.01 -1.26 -5.00 120.40 128.44 2wii s VAL 983 Ca 0.79 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 61.70 2wii s VAL 983 Cb -0.17 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.15 2wii s VAL 983 CO 0.26 0.27 1.02 -0.89 0.00 0.00 0.00 175.10 175.76 2wii s THR 984 N -0.50 4.60 0.16 3.92 2.01 -1.26 -4.78 115.64 119.79 2wii s THR 984 Ca 0.05 1.76 -0.31 0.00 0.31 0.00 0.00 61.69 63.50 2wii s THR 984 Cb -0.07 -4.34 -0.10 0.00 0.01 0.00 0.00 72.50 68.00 2wii s THR 984 CO 0.00 -0.35 1.63 -2.84 -0.69 0.00 0.00 174.62 172.37 2wii s PRO 985 N 3.41 4.19 0.22 4.92 0.02 -1.26 -4.94 135.00 141.55 2wii s PRO 985 Ca 0.43 2.43 -0.14 0.00 0.02 0.00 0.00 61.00 63.74 2wii s PRO 985 Cb -0.13 -3.23 0.01 0.00 0.02 0.00 0.00 34.50 31.16 2wii s PRO 985 CO 0.12 -0.67 0.46 -1.54 -0.33 0.00 0.00 177.00 175.04 2wii s SER 986 N 1.45 -0.12 0.00 2.53 1.04 -1.26 -4.87 113.70 112.47 2wii s SER 986 Ca 0.72 -0.77 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2wii s SER 986 Cb -0.45 0.56 0.00 0.00 0.10 0.00 0.00 66.02 66.23 2wii s SER 986 CO 0.32 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 174.08 2wii n GLY 987 N -0.34 -1.86 0.00 7.32 0.00 -1.26 -2.96 105.19 106.09 2wii n GLY 987 Ca -0.05 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 43.95 2wii n GLY 987 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wii h GLY 989 N 0.00 1.33 0.07 0.00 0.00 -1.65 0.12 103.07 102.95 2wii h GLY 989 Ca 0.00 -0.20 -0.28 0.00 0.00 0.00 0.00 47.33 46.86 2wii h GLY 989 CO 0.00 -0.21 -1.52 1.18 0.00 0.00 0.00 176.54 175.99 2wii n GLU 990 N -4.68 0.59 0.19 4.80 1.02 -1.26 -4.18 120.64 117.12 2wii n GLU 990 Ca 0.28 0.50 0.04 0.00 -0.02 0.00 0.00 57.16 57.96 2wii n GLU 990 Cb 0.98 -1.71 0.39 0.00 -0.02 0.00 0.00 31.44 31.08 2wii n GLU 990 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2wii h GLN 991 N -0.86 0.00 -0.51 3.49 4.20 -1.78 -2.52 115.11 117.12 2wii h GLN 991 Ca -0.40 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.29 2wii h GLN 991 Cb 1.43 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.19 2wii h GLN 991 CO -0.20 0.36 0.26 -0.97 -0.67 0.00 0.00 178.83 177.60 2wii h ASN 992 N 0.00 0.63 0.48 1.46 -1.24 -0.64 -1.78 115.58 114.49 2wii h ASN 992 Ca -0.00 -0.05 -0.24 0.00 0.71 0.00 0.00 56.30 56.72 2wii h ASN 992 Cb 0.68 -0.16 0.00 0.00 0.73 0.00 0.00 38.32 39.57 2wii h ASN 992 CO 0.05 0.53 -1.04 0.24 -1.29 0.00 0.00 177.43 175.92 2wii h MET 993 N 0.71 0.33 -0.79 6.67 2.86 -1.64 -2.24 114.93 120.83 2wii h MET 993 Ca 0.18 -0.41 0.03 0.00 -2.06 0.00 0.00 59.70 57.44 2wii h MET 993 Cb 0.05 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.80 2wii h MET 993 CO -0.03 1.12 0.50 0.82 1.06 0.00 0.00 176.91 180.39 2wii h ILE 994 N 0.15 1.12 0.00 -1.22 2.04 -0.99 0.14 117.51 118.75 2wii h ILE 994 Ca -0.09 -0.34 -0.15 0.00 1.00 0.00 0.00 64.86 65.28 2wii h ILE 994 Cb 1.71 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 2wii h ILE 994 CO 0.17 0.18 -0.74 1.23 0.00 0.00 0.00 178.15 179.00 2wii h GLY 995 N 0.98 0.00 2.00 5.37 0.00 -1.40 -3.27 103.07 106.75 2wii h GLY 995 Ca 0.32 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.53 2wii h GLY 995 CO -0.12 0.00 -0.57 1.98 0.00 0.00 0.00 176.54 177.83 2wii h MET 996 N 0.00 0.00 0.28 4.80 1.85 -0.87 -3.36 114.93 117.64 2wii h MET 996 Ca -0.01 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 59.07 2wii h MET 996 Cb 1.56 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.58 2wii h MET 996 CO 0.09 0.57 -0.20 1.15 -0.40 0.00 0.00 176.91 178.12 2wii h THR 997 N 0.00 0.58 -0.40 -0.77 2.02 -0.79 -2.20 112.91 111.36 2wii h THR 997 Ca -0.01 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.19 2wii h THR 997 Cb 1.30 0.58 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 2wii h THR 997 CO 0.07 0.00 0.25 -0.65 0.37 0.00 0.00 175.52 175.56 2wii h PRO 998 N -0.48 0.49 -0.60 6.66 0.11 -1.73 -1.91 132.00 134.53 2wii h PRO 998 Ca -0.02 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2wii h PRO 998 Cb 0.41 -0.11 -0.03 0.00 0.11 0.00 0.00 31.00 31.39 2wii h PRO 998 CO 0.01 0.33 0.26 1.15 -0.21 0.00 0.00 178.00 179.53 2wii h THR 999 N 0.51 1.22 -0.34 -1.15 2.02 -1.48 -0.22 112.91 113.47 2wii h THR 999 Ca 0.15 -0.67 -0.03 0.00 0.77 0.00 0.00 66.41 66.64 2wii h THR 999 Cb -0.03 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 66.91 2wii h THR 999 CO -0.05 0.26 0.11 0.58 0.37 0.00 0.00 175.52 176.79 2wii h VAL 1000N 0.83 1.21 0.00 3.16 2.07 -1.19 -1.90 116.25 120.42 2wii h VAL 1000Ca 0.20 -0.67 -0.09 0.00 0.82 0.00 0.00 66.70 66.96 2wii h VAL 1000Cb 0.17 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 2wii h VAL 1000CO -0.02 0.23 -0.42 -0.29 0.02 0.00 0.00 177.57 177.09 2wii h ILE 1001N 0.39 0.91 0.06 4.57 6.09 -1.22 -2.14 117.51 126.17 2wii h ILE 1001Ca 0.11 -1.71 -0.00 0.00 -1.37 0.00 0.00 64.86 61.89 2wii h ILE 1001Cb 0.25 2.05 0.00 0.00 0.47 0.00 0.00 36.82 39.59 2wii h ILE 1001CO -0.00 0.41 -0.03 0.00 -3.07 0.00 0.00 178.15 175.46 2wii h ALA 1002N 1.58 -0.07 -0.55 0.18 0.00 -0.87 -1.07 119.26 118.45 2wii h ALA 1002Ca -0.00 -0.26 0.02 0.00 0.00 0.00 0.00 54.91 54.67 2wii h ALA 1002Cb 1.01 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2wii h ALA 1002CO 0.05 -0.27 0.37 0.28 0.00 0.00 0.00 179.25 179.68 2wii h VAL 1003N -0.63 1.10 -0.18 0.00 2.07 -1.35 0.84 116.25 118.10 2wii h VAL 1003Ca -0.01 -0.24 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2wii h VAL 1003Cb 0.54 0.35 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 2wii h VAL 1003CO 0.01 0.13 0.01 -0.74 0.02 0.00 0.00 177.57 177.00 2wii h HIS 1004N 0.69 0.34 -0.46 1.57 6.17 -1.33 -1.83 115.15 120.30 2wii h HIS 1004Ca 0.21 -0.05 -0.11 0.00 0.71 0.00 0.00 60.37 61.13 2wii h HIS 1004Cb 0.01 -0.09 -0.01 0.00 2.52 0.00 0.00 27.41 29.83 2wii h HIS 1004CO -0.00 0.50 -0.13 -0.92 0.71 0.00 0.00 177.93 178.09 2wii h TYR 1005N 0.08 1.01 -0.46 5.26 3.20 -0.65 -2.47 116.97 122.93 2wii h TYR 1005Ca 0.05 -0.22 -0.05 0.00 3.14 0.00 0.00 58.73 61.65 2wii h TYR 1005Cb 0.36 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.36 2wii h TYR 1005CO 0.03 0.99 0.07 -0.07 -1.64 0.00 0.00 178.16 177.54 2wii h LEU 1006N 0.73 0.68 -0.32 2.82 3.38 -0.85 -1.38 115.31 120.37 2wii h LEU 1006Ca 0.11 -0.13 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2wii h LEU 1006Cb 0.68 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2wii h LEU 1006CO 0.05 0.71 0.01 0.44 0.09 0.00 0.00 178.44 179.73 2wii h ASP 1007N 0.69 0.54 -0.16 -0.43 3.32 -1.20 0.03 116.42 119.22 2wii h ASP 1007Ca 0.15 -0.30 -0.03 0.00 0.02 0.00 0.00 57.03 56.87 2wii h ASP 1007Cb 0.33 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 2wii h ASP 1007CO 0.01 0.71 -0.00 -0.08 -1.72 0.00 0.00 179.24 178.15 2wii h GLU 1008N 0.35 0.28 0.00 3.56 4.57 -1.20 -3.04 114.58 119.11 2wii h GLU 1008Ca 0.09 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 2wii h GLU 1008Cb 0.43 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2wii h GLU 1008CO 0.01 0.51 -0.00 0.25 -1.18 0.00 0.00 179.01 178.60 2wii n THR 1009N -4.74 0.32 -3.43 0.32 -2.24 -0.54 -4.95 114.28 99.01 2wii n THR 1009Ca -0.05 -0.15 -0.20 0.00 -2.27 0.00 0.00 64.05 61.38 2wii n THR 1009Cb 0.22 -0.55 0.06 0.00 -2.10 0.00 0.00 70.33 67.96 2wii n THR 1009CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2wii n GLU 1010N -1.91 -3.09 -0.32 -0.78 1.02 -0.03 -4.94 120.64 110.60 2wii n GLU 1010Ca 0.06 0.74 0.07 0.00 -0.02 0.00 0.00 57.16 58.02 2wii n GLU 1010Cb 0.39 -5.38 0.21 0.00 -0.02 0.00 0.00 31.44 26.63 2wii n GLU 1010CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2wii n GLN 1011N -3.72 2.86 0.07 3.49 6.02 -1.02 -4.57 117.38 120.51 2wii n GLN 1011Ca -0.14 -2.49 0.07 0.00 -0.01 0.00 0.00 57.00 54.42 2wii n GLN 1011Cb 0.63 -1.59 0.33 0.00 1.02 0.00 0.00 30.24 30.63 2wii n GLN 1011CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 2wii n TRP 1012N -0.15 0.36 -0.06 1.08 7.02 -1.26 -1.32 117.44 123.12 2wii n TRP 1012Ca 0.17 0.17 -0.13 0.00 -1.02 0.00 0.00 57.50 56.68 2wii n TRP 1012Cb 0.69 -0.77 -0.07 0.00 -2.42 0.00 0.00 31.31 28.74 2wii n TRP 1012CO 0.00 0.00 0.00 1.49 -2.02 0.00 0.00 177.69 177.16 2wii h GLU 1013N 0.00 0.40 0.14 -0.99 4.81 -1.91 0.78 114.58 117.80 2wii h GLU 1013Ca 0.00 -0.22 -0.29 0.00 -0.13 0.00 0.00 59.36 58.72 2wii h GLU 1013Cb 0.14 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.54 2wii h GLU 1013CO 0.00 0.79 -1.35 0.87 -0.73 0.00 0.00 179.01 178.59 2wii h LYS 1014N 0.02 0.29 -0.11 1.92 6.56 -1.76 -3.36 116.57 120.13 2wii h LYS 1014Ca 0.02 -0.49 -0.05 0.00 -1.06 0.00 0.00 60.65 59.06 2wii h LYS 1014Cb 0.73 0.18 -0.00 0.00 -0.57 0.00 0.00 32.23 32.57 2wii h LYS 1014CO 0.04 1.21 -0.13 0.35 -2.06 0.00 0.00 179.45 178.86 2wii h PHE 1015N 0.08 0.35 0.00 -1.35 3.57 -1.27 -3.47 116.94 114.85 2wii h PHE 1015Ca -0.18 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.21 2wii h PHE 1015Cb 2.00 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.67 2wii h PHE 1015CO 0.07 0.72 0.00 0.41 -2.23 0.00 0.00 178.31 177.28 2wii n GLY 1016N 0.26 2.55 0.37 2.40 0.00 0.12 -4.91 105.19 105.96 2wii n GLY 1016Ca -0.07 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.65 2wii n GLY 1016CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2wii h LEU 1017N 0.00 0.81 -1.07 0.99 3.38 -1.41 -0.77 115.31 117.24 2wii h LEU 1017Ca 0.00 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2wii h LEU 1017Cb 0.00 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2wii h LEU 1017CO 0.00 0.40 -0.34 -0.33 0.09 0.00 0.00 178.44 178.25 2wii h GLU 1018N 0.85 0.22 0.00 1.13 5.08 -1.95 -3.18 114.58 116.73 2wii h GLU 1018Ca 0.50 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.72 2wii h GLU 1018Cb 0.65 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 2wii h GLU 1018CO -0.27 0.54 -0.23 0.87 -1.00 0.00 0.00 179.01 178.93 2wii h LYS 1019N 0.19 0.00 -0.64 2.33 1.57 -1.49 -3.19 116.57 115.34 2wii h LYS 1019Ca 0.02 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.86 2wii h LYS 1019Cb 0.70 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.96 2wii h LYS 1019CO 0.05 0.23 0.35 -0.09 -0.57 0.00 0.00 179.45 179.42 2wii h ARG 1020N 0.00 0.62 -0.97 3.15 2.43 -1.59 -1.76 114.38 116.26 2wii h ARG 1020Ca -0.00 -0.04 0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2wii h ARG 1020Cb 0.50 -0.14 -0.06 0.00 -0.42 0.00 0.00 29.97 29.85 2wii h ARG 1020CO 0.03 0.41 0.63 0.37 -1.51 0.00 0.00 179.97 179.90 2wii h GLN 1021N 0.64 1.17 -0.17 0.20 5.75 -1.78 -0.39 115.11 120.52 2wii h GLN 1021Ca 0.29 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.68 2wii h GLN 1021Cb 0.20 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 2wii h GLN 1021CO -0.19 0.77 -0.08 0.78 -2.65 0.00 0.00 178.83 177.46 2wii h GLY 1022N 1.21 0.28 0.95 2.39 0.00 -1.50 -2.46 103.07 103.93 2wii h GLY 1022Ca 0.39 -0.16 -0.12 0.00 0.00 0.00 0.00 47.33 47.45 2wii h GLY 1022CO -0.13 0.15 -0.28 0.00 0.00 0.00 0.00 176.54 176.28 2wii h ALA 1023N 1.67 0.40 -0.72 3.60 0.00 -0.57 -2.98 119.26 120.65 2wii h ALA 1023Ca 0.05 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2wii h ALA 1023Cb 0.31 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2wii h ALA 1023CO 0.02 0.40 0.43 -0.07 0.00 0.00 0.00 179.25 180.03 2wii h LEU 1024N 0.39 0.87 -1.48 0.00 3.38 -1.02 -1.38 115.31 116.07 2wii h LEU 1024Ca 0.04 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2wii h LEU 1024Cb 0.85 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 2wii h LEU 1024CO 0.07 0.68 0.01 -0.33 0.09 0.00 0.00 178.44 178.95 2wii h GLU 1025N 1.00 0.34 -0.11 1.13 4.39 -1.38 0.12 114.58 120.07 2wii h GLU 1025Ca 0.26 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.74 2wii h GLU 1025Cb -0.02 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.56 2wii h GLU 1025CO -0.05 0.36 -0.62 -0.07 -1.16 0.00 0.00 179.01 177.48 2wii h LEU 1026N 0.33 0.44 -0.21 1.33 3.38 -1.13 -0.77 115.31 118.68 2wii h LEU 1026Ca 0.08 -0.26 -0.08 0.00 0.09 0.00 0.00 57.88 57.71 2wii h LEU 1026Cb 0.22 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2wii h LEU 1026CO 0.00 0.95 -0.19 0.40 0.09 0.00 0.00 178.44 179.70 2wii h ILE 1027N 0.29 1.32 -0.85 1.22 2.04 -0.41 -0.68 117.51 120.44 2wii h ILE 1027Ca -0.01 -1.34 -0.02 0.00 1.00 0.00 0.00 64.86 64.49 2wii h ILE 1027Cb 1.15 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 38.92 2wii h ILE 1027CO 0.11 0.41 0.44 0.11 0.00 0.00 0.00 178.15 179.22 2wii h LYS 1028N 0.18 1.19 -0.57 2.37 1.57 -0.80 -0.38 116.57 120.13 2wii h LYS 1028Ca 0.04 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 2wii h LYS 1028Cb 0.73 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 32.78 2wii h LYS 1028CO 0.05 0.89 0.29 -0.22 -0.57 0.00 0.00 179.45 179.89 2wii h LYS 1029N 1.19 0.81 -0.23 3.15 3.64 -0.98 0.51 116.57 124.67 2wii h LYS 1029Ca 0.30 -0.11 -0.12 0.00 -1.27 0.00 0.00 60.65 59.45 2wii h LYS 1029Cb 0.06 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.72 2wii h LYS 1029CO -0.04 0.65 -0.36 0.78 -2.27 0.00 0.00 179.45 178.20 2wii h GLY 1030N 0.78 0.55 0.74 5.01 0.00 -0.78 -2.25 103.07 107.12 2wii h GLY 1030Ca 0.20 -0.52 -0.05 0.00 0.00 0.00 0.00 47.33 46.96 2wii h GLY 1030CO -0.03 0.47 -0.09 -1.82 0.00 0.00 0.00 176.54 175.07 2wii h TYR 1031N 0.43 0.37 -0.51 5.60 3.20 -0.75 -2.38 116.97 122.93 2wii h TYR 1031Ca 0.05 -0.10 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2wii h TYR 1031Cb 0.83 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.99 2wii h TYR 1031CO 0.03 0.66 0.33 1.15 -1.64 0.00 0.00 178.16 178.69 2wii h THR 1032N -0.03 1.10 -0.20 1.81 2.02 -0.87 -2.64 112.91 114.11 2wii h THR 1032Ca 0.03 -0.23 -0.09 0.00 0.77 0.00 0.00 66.41 66.89 2wii h THR 1032Cb 0.58 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2wii h THR 1032CO 0.03 0.12 -0.28 1.56 0.37 0.00 0.00 175.52 177.32 2wii h GLN 1033N 0.67 0.39 0.00 6.66 4.20 -1.44 -2.79 115.11 122.80 2wii h GLN 1033Ca 0.19 -0.15 -0.06 0.00 0.06 0.00 0.00 58.65 58.69 2wii h GLN 1033Cb -0.05 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 2wii h GLN 1033CO -0.06 0.64 -0.30 0.37 -0.67 0.00 0.00 178.83 178.81 2wii h GLN 1034N 0.34 0.00 0.00 1.46 5.75 -1.07 -2.45 115.11 119.13 2wii h GLN 1034Ca 0.05 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.52 2wii h GLN 1034Cb 0.67 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.22 2wii h GLN 1034CO 0.05 0.30 -0.14 -0.07 -2.65 0.00 0.00 178.83 176.32 2wii h LEU 1035N 0.00 0.00 -2.18 -2.39 3.38 -1.23 -1.76 115.31 111.12 2wii h LEU 1035Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 2wii h LEU 1035Cb 0.54 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.29 2wii h LEU 1035CO 0.04 0.14 -0.01 0.00 0.09 0.00 0.00 178.44 178.70 2wii h ALA 1036N 1.86 1.03 -0.54 1.53 0.00 -1.53 -1.22 119.26 120.39 2wii h ALA 1036Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2wii h ALA 1036Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2wii h ALA 1036CO 0.02 0.02 0.00 1.19 0.00 0.00 0.00 179.25 180.48 2wii n PHE 1037N -3.15 0.72 -2.66 0.00 3.72 -0.67 -4.91 117.46 110.52 2wii n PHE 1037Ca -0.01 -0.42 -0.43 0.00 -0.05 0.00 0.00 57.45 56.54 2wii n PHE 1037Cb 0.20 -0.01 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 2wii n PHE 1037CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2wii s ARG 1038N -1.12 4.26 0.60 -1.08 3.52 -0.46 -4.01 118.95 120.66 2wii s ARG 1038Ca 0.40 1.36 -0.07 0.00 -0.13 0.00 0.00 55.73 57.29 2wii s ARG 1038Cb 0.22 -3.64 0.00 0.00 -1.56 0.00 0.00 34.95 29.97 2wii s ARG 1038CO 0.29 -0.63 0.93 -0.65 -0.81 0.00 0.00 175.30 174.43 2wii s GLN 1039N 3.20 3.01 0.61 5.12 -0.21 -0.66 -4.91 119.66 125.82 2wii s GLN 1039Ca 0.44 0.14 0.29 0.00 0.02 0.00 0.00 55.36 56.26 2wii s GLN 1039Cb -0.15 -2.23 1.56 0.00 1.00 0.00 0.00 33.01 33.20 2wii s GLN 1039CO 0.06 -0.71 1.94 -1.35 -2.12 0.00 0.00 175.29 173.12 2wii h PRO 1040N -0.23 0.00 -0.01 2.91 0.11 -1.96 0.45 132.00 133.27 2wii h PRO 1040Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2wii h PRO 1040Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2wii h PRO 1040CO 0.61 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.27 2wii n SER 1041N -3.46 0.41 -0.10 -2.05 3.41 -1.26 -4.88 113.62 105.69 2wii n SER 1041Ca 0.04 -1.18 -0.01 0.00 -0.26 0.00 0.00 58.87 57.45 2wii n SER 1041Cb 0.51 -0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.45 2wii n SER 1041CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2wii n SER 1042N -0.66 -4.27 -4.91 4.04 7.64 0.16 -4.75 113.62 110.87 2wii n SER 1042Ca 0.22 0.03 -0.21 0.00 1.01 0.00 0.00 58.87 59.92 2wii n SER 1042Cb 0.17 -1.89 0.05 0.00 -1.01 0.00 0.00 64.21 61.54 2wii n SER 1042CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2wii s ALA 1043N -1.68 4.06 0.06 -0.43 0.00 -1.25 -3.72 121.76 118.79 2wii s ALA 1043Ca 0.00 -1.60 0.05 0.00 0.00 0.00 0.00 51.96 50.42 2wii s ALA 1043Cb 0.00 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.19 2wii s ALA 1043CO 0.00 -0.88 -0.15 -0.06 0.00 0.00 0.00 175.76 174.68 2wii s PHE 1044N -2.78 1.26 0.18 0.00 0.40 -1.26 -1.65 117.98 114.12 2wii s PHE 1044Ca 0.60 -0.41 -0.14 0.00 -0.60 0.00 0.00 56.93 56.38 2wii s PHE 1044Cb -0.08 -0.73 0.01 0.00 0.51 0.00 0.00 43.02 42.73 2wii s PHE 1044CO 0.39 0.06 0.42 0.00 0.70 0.00 0.00 175.22 176.79 2wii s ALA 1045N -1.07 -0.57 0.26 5.36 0.00 -1.26 -1.25 121.76 123.22 2wii s ALA 1045Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 2wii s ALA 1045Cb -0.09 0.84 0.40 0.00 0.00 0.00 0.00 23.12 24.27 2wii s ALA 1045CO 0.02 -0.74 1.85 0.00 0.00 0.00 0.00 175.76 176.89 2wii h ALA 1046N 2.34 1.30 -2.79 0.00 0.00 -1.88 -3.38 119.26 114.85 2wii h ALA 1046Ca -0.30 -0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.12 2wii h ALA 1046Cb 1.25 -0.23 -0.17 0.00 0.00 0.00 0.00 17.79 18.63 2wii h ALA 1046CO 0.42 0.29 -0.77 -0.06 0.00 0.00 0.00 179.25 179.13 2wii s PHE 1047N -6.03 1.71 0.38 0.00 0.08 -1.26 -2.34 117.98 110.52 2wii s PHE 1047Ca -0.12 -0.51 0.21 0.00 0.12 0.00 0.00 56.93 56.63 2wii s PHE 1047Cb 0.20 -0.85 1.12 0.00 -0.57 0.00 0.00 43.02 42.92 2wii s PHE 1047CO 0.80 0.30 1.97 -0.39 -0.10 0.00 0.00 175.22 177.79 2wii h VAL 1048N 3.18 0.85 -0.01 -0.44 -1.51 -1.89 -2.38 116.25 114.05 2wii h VAL 1048Ca -0.41 -0.81 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 2wii h VAL 1048Cb 1.21 1.48 0.00 0.00 -2.13 0.00 0.00 31.29 31.85 2wii h VAL 1048CO 0.53 0.21 -0.51 0.29 -1.23 0.00 0.00 177.57 176.86 2wii n LYS 1049N -3.85 0.57 -3.09 5.19 5.02 -1.26 -4.92 118.16 115.82 2wii n LYS 1049Ca -0.02 -0.40 -0.34 0.00 -2.02 0.00 0.00 58.31 55.53 2wii n LYS 1049Cb 0.30 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.76 2wii n LYS 1049CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2wii s ARG 1050N -2.71 4.15 0.34 1.97 3.52 -0.90 -5.02 118.95 120.29 2wii s ARG 1050Ca 0.17 0.81 -0.29 0.00 -0.13 0.00 0.00 55.73 56.28 2wii s ARG 1050Cb 0.18 -2.62 -0.11 0.00 -1.56 0.00 0.00 34.95 30.83 2wii s ARG 1050CO 0.64 0.25 1.55 0.00 -0.81 0.00 0.00 175.30 176.94 2wii s ALA 1051N -1.78 3.66 0.30 6.12 0.00 -1.26 -4.81 121.76 124.00 2wii s ALA 1051Ca 0.50 1.60 -0.30 0.00 0.00 0.00 0.00 51.96 53.76 2wii s ALA 1051Cb -0.13 -3.64 -0.12 0.00 0.00 0.00 0.00 23.12 19.23 2wii s ALA 1051CO 0.19 -1.05 1.49 -2.30 0.00 0.00 0.00 175.76 174.08 2wii n PRO 1052N 1.25 2.45 -3.57 0.00 -0.02 -1.26 -4.79 135.00 129.07 2wii n PRO 1052Ca 0.04 0.87 -0.37 0.00 -2.02 0.00 0.00 63.50 62.03 2wii n PRO 1052Cb 0.38 -2.58 -0.08 0.00 -0.02 0.00 0.00 33.50 31.20 2wii n PRO 1052CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2wii s SER 1053N 0.21 6.28 0.11 2.55 0.15 -0.38 -4.27 113.70 118.35 2wii s SER 1053Ca 0.62 0.32 -0.20 0.00 0.70 0.00 0.00 55.95 57.39 2wii s SER 1053Cb -0.54 -2.15 -0.08 0.00 -1.71 0.00 0.00 66.02 61.53 2wii s SER 1053CO 0.54 0.05 1.74 0.74 1.20 0.00 0.00 173.24 177.51 2wii h THR 1054N 4.91 1.07 -0.15 6.45 2.02 -1.87 -1.50 112.91 123.83 2wii h THR 1054Ca -0.38 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.62 2wii h THR 1054Cb 1.16 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 2wii h THR 1054CO 0.71 0.06 0.05 -0.25 0.37 0.00 0.00 175.52 176.46 2wii h TRP 1055N 0.21 0.24 -0.38 3.16 7.01 -1.92 -1.49 115.95 122.78 2wii h TRP 1055Ca 0.06 -0.02 0.03 0.00 2.11 0.00 0.00 58.89 61.07 2wii h TRP 1055Cb 0.01 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 26.97 2wii h TRP 1055CO -0.06 0.35 0.18 1.25 -2.79 0.00 0.00 178.44 177.37 2wii h LEU 1056N 0.06 0.25 -0.83 0.65 5.85 -1.87 0.14 115.31 119.57 2wii h LEU 1056Ca 0.05 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 2wii h LEU 1056Cb 0.22 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2wii h LEU 1056CO -0.00 0.18 0.43 0.74 -0.34 0.00 0.00 178.44 179.45 2wii h THR 1057N 0.36 1.25 -0.31 1.05 2.02 -1.22 -0.46 112.91 115.60 2wii h THR 1057Ca 0.16 -0.66 -0.08 0.00 0.77 0.00 0.00 66.41 66.60 2wii h THR 1057Cb 0.08 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.64 2wii h THR 1057CO -0.12 0.29 -0.16 0.00 0.37 0.00 0.00 175.52 175.90 2wii h ALA 1058N 1.23 1.14 -0.29 6.16 0.00 -0.60 -2.44 119.26 124.46 2wii h ALA 1058Ca 0.29 -0.30 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 2wii h ALA 1058Cb 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2wii h ALA 1058CO -0.04 0.54 -0.53 -0.92 0.00 0.00 0.00 179.25 178.30 2wii h TYR 1059N 0.50 1.10 -0.87 0.00 3.20 -0.19 -1.46 116.97 119.25 2wii h TYR 1059Ca 0.09 -0.39 0.07 0.00 3.14 0.00 0.00 58.73 61.64 2wii h TYR 1059Cb 0.57 -0.21 -0.06 0.00 1.54 0.00 0.00 36.73 38.57 2wii h TYR 1059CO 0.02 1.22 0.54 0.28 -1.64 0.00 0.00 178.16 178.57 2wii h VAL 1060N 0.66 1.03 -0.43 1.81 2.07 -0.92 0.35 116.25 120.82 2wii h VAL 1060Ca 0.02 -0.33 -0.08 0.00 0.82 0.00 0.00 66.70 67.13 2wii h VAL 1060Cb 1.14 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 2wii h VAL 1060CO 0.12 0.18 -0.06 0.58 0.02 0.00 0.00 177.57 178.41 2wii h VAL 1061N 0.97 1.25 -0.22 2.57 2.07 -1.29 -0.19 116.25 121.41 2wii h VAL 1061Ca 0.38 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.82 2wii h VAL 1061Cb 0.19 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 2wii h VAL 1061CO -0.18 0.37 0.05 0.50 0.02 0.00 0.00 177.57 178.33 2wii h LYS 1062N 0.68 0.35 -0.06 1.57 3.64 0.00 -1.31 116.57 121.44 2wii h LYS 1062Ca 0.13 -0.08 -0.10 0.00 -1.27 0.00 0.00 60.65 59.32 2wii h LYS 1062Cb 0.50 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 32.28 2wii h LYS 1062CO 0.03 0.46 -0.36 0.28 -2.27 0.00 0.00 179.45 177.59 2wii h VAL 1063N 0.17 1.43 -0.93 2.00 2.07 -0.96 -3.19 116.25 116.84 2wii h VAL 1063Ca 0.07 -1.78 -0.00 0.00 0.82 0.00 0.00 66.70 65.80 2wii h VAL 1063Cb 0.27 2.36 -0.05 0.00 -1.52 0.00 0.00 31.29 32.36 2wii h VAL 1063CO 0.00 0.51 0.57 -0.26 0.02 0.00 0.00 177.57 178.42 2wii h PHE 1064N -0.14 1.22 -0.16 1.57 -1.00 -1.06 -1.51 116.94 115.86 2wii h PHE 1064Ca -0.03 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.71 2wii h PHE 1064Cb 1.02 -0.40 -0.01 0.00 3.61 0.00 0.00 35.95 40.17 2wii h PHE 1064CO 0.13 0.80 -0.10 0.77 -1.61 0.00 0.00 178.31 178.31 2wii h SER 1065N 1.29 0.24 1.58 2.17 0.02 -1.31 -1.63 113.55 115.90 2wii h SER 1065Ca 0.34 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.24 2wii h SER 1065Cb -0.07 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.41 2wii h SER 1065CO -0.06 0.37 -0.24 0.25 -1.14 0.00 0.00 176.83 176.00 2wii h LEU 1066N 0.24 0.00 -0.72 5.07 6.46 -1.39 -3.28 115.31 121.70 2wii h LEU 1066Ca 0.05 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.79 2wii h LEU 1066Cb 0.34 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.27 2wii h LEU 1066CO 0.02 0.01 -0.25 0.00 -0.62 0.00 0.00 178.44 177.60 2wii n ALA 1067N -2.01 3.07 0.30 1.25 0.00 -0.63 -4.04 120.51 118.45 2wii n ALA 1067Ca 0.04 -0.47 0.19 0.00 0.00 0.00 0.00 53.44 53.20 2wii n ALA 1067Cb 0.50 -1.06 0.94 0.00 0.00 0.00 0.00 19.45 19.83 2wii n ALA 1067CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2wii h VAL 1068N 1.76 0.08 0.00 0.00 -1.51 -1.52 0.19 116.25 115.25 2wii h VAL 1068Ca 0.00 -0.28 -0.00 0.00 -1.23 0.00 0.00 66.70 65.19 2wii h VAL 1068Cb 0.57 1.25 -0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2wii h VAL 1068CO 0.00 0.02 -0.38 0.78 -1.23 0.00 0.00 177.57 176.76 2wii h ASN 1069N 0.00 0.00 0.00 4.19 2.35 -1.84 -3.39 115.58 116.90 2wii h ASN 1069Ca -0.00 0.00 -0.40 0.00 -0.55 0.00 0.00 56.30 55.35 2wii h ASN 1069Cb 0.25 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.56 2wii h ASN 1069CO 0.00 0.02 -2.19 0.18 -1.65 0.00 0.00 177.43 173.79 2wii n LEU 1070N -2.95 1.93 -4.49 1.61 4.77 -0.19 -5.05 117.00 112.63 2wii n LEU 1070Ca 0.02 0.36 -0.24 0.00 -0.03 0.00 0.00 56.01 56.13 2wii n LEU 1070Cb 0.55 -0.85 -0.09 0.00 -2.33 0.00 0.00 43.42 40.70 2wii n LEU 1070CO 0.36 0.47 -0.22 0.27 -1.33 0.00 0.00 177.39 176.95 2wii s ILE 1071N -2.48 0.75 -0.34 -0.08 -4.36 -0.12 -5.07 121.20 109.50 2wii s ILE 1071Ca -0.36 -2.00 -0.28 0.00 -0.26 0.00 0.00 60.65 57.75 2wii s ILE 1071Cb 0.12 -2.48 0.02 0.00 1.25 0.00 0.00 42.46 41.37 2wii s ILE 1071CO 0.51 0.00 1.04 0.00 0.24 0.00 0.00 174.94 176.73 2wii s ALA 1072N -3.27 3.46 -0.18 2.27 0.00 -1.26 -4.35 121.76 118.43 2wii s ALA 1072Ca 0.28 -0.16 -0.03 0.00 0.00 0.00 0.00 51.96 52.05 2wii s ALA 1072Cb 0.04 -3.65 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 2wii s ALA 1072CO 0.15 -1.54 -0.06 0.42 0.00 0.00 0.00 175.76 174.73 2wii s ILE 1073N 3.64 3.43 0.02 0.00 -1.09 -1.26 -5.07 121.20 120.87 2wii s ILE 1073Ca 0.44 -0.50 -0.30 0.00 -2.23 0.00 0.00 60.65 58.06 2wii s ILE 1073Cb -0.12 -2.52 -0.06 0.00 -1.58 0.00 0.00 42.46 38.18 2wii s ILE 1073CO 0.17 0.46 1.50 -0.62 -1.23 0.00 0.00 174.94 175.22 2wii s ASP 1074N 0.93 6.75 0.23 3.58 2.15 -1.26 -4.91 116.67 124.14 2wii s ASP 1074Ca -0.01 2.25 -0.07 0.00 0.43 0.00 0.00 52.55 55.15 2wii s ASP 1074Cb -0.15 -2.56 0.20 0.00 -0.30 0.00 0.00 42.92 40.11 2wii s ASP 1074CO 0.01 -0.79 1.85 0.28 -0.17 0.00 0.00 175.17 176.35 2wii h SER 1075N 8.08 1.10 -1.00 -0.34 0.02 -1.98 -2.45 113.55 116.98 2wii h SER 1075Ca -0.40 -0.10 0.09 0.00 -0.84 0.00 0.00 61.79 60.55 2wii h SER 1075Cb 1.19 -0.28 -0.08 0.00 0.14 0.00 0.00 62.40 63.37 2wii h SER 1075CO 0.92 0.88 0.64 1.56 -1.14 0.00 0.00 176.83 179.69 2wii h GLN 1076N 1.23 1.06 -0.04 3.45 1.08 -1.98 0.22 115.11 120.13 2wii h GLN 1076Ca 0.31 -0.06 -0.03 0.00 -1.45 0.00 0.00 58.65 57.42 2wii h GLN 1076Cb 0.02 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.22 2wii h GLN 1076CO -0.05 0.70 -0.08 0.28 -0.95 0.00 0.00 178.83 178.73 2wii h VAL 1077N 1.09 1.42 0.27 -0.54 2.07 -1.87 -1.06 116.25 117.62 2wii h VAL 1077Ca 0.46 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 2wii h VAL 1077Cb 0.33 2.24 0.00 0.00 -1.52 0.00 0.00 31.29 32.34 2wii h VAL 1077CO -0.22 0.38 -0.13 0.25 0.02 0.00 0.00 177.57 177.87 2wii h LEU 1078N -0.38 -0.30 -1.06 2.57 5.85 -1.09 -2.59 115.31 118.31 2wii h LEU 1078Ca 0.00 -0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.46 2wii h LEU 1078Cb 0.65 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2wii h LEU 1078CO 0.02 0.03 -0.17 0.00 -0.34 0.00 0.00 178.44 177.98 2wii h GLY 1080N 0.95 1.23 1.31 0.00 0.00 -1.17 0.19 103.07 105.58 2wii h GLY 1080Ca 0.07 -0.45 -0.12 0.00 0.00 0.00 0.00 47.33 46.84 2wii h GLY 1080CO 0.04 0.43 -0.23 0.00 0.00 0.00 0.00 176.54 176.77 2wii h ALA 1081N 1.33 0.85 -0.43 3.60 0.00 -1.18 -2.43 119.26 120.99 2wii h ALA 1081Ca 0.32 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 2wii h ALA 1081Cb -0.10 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2wii h ALA 1081CO -0.08 0.64 0.15 0.28 0.00 0.00 0.00 179.25 180.24 2wii h VAL 1082N 0.69 1.21 0.00 0.00 2.07 -0.92 -1.88 116.25 117.42 2wii h VAL 1082Ca 0.09 -0.69 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 2wii h VAL 1082Cb 0.75 0.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2wii h VAL 1082CO 0.06 0.25 -0.30 0.50 0.02 0.00 0.00 177.57 178.10 2wii h LYS 1083N 0.55 0.00 -0.20 1.57 3.64 -0.91 -2.51 116.57 118.71 2wii h LYS 1083Ca 0.14 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.31 2wii h LYS 1083Cb 0.24 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.06 2wii h LYS 1083CO -0.01 0.30 -0.68 2.35 -2.27 0.00 0.00 179.45 179.14 2wii h TRP 1084N 0.00 1.07 -0.37 1.91 7.01 -1.13 -2.17 115.95 122.26 2wii h TRP 1084Ca -0.00 -0.44 -0.04 0.00 2.11 0.00 0.00 58.89 60.51 2wii h TRP 1084Cb 0.60 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 27.47 2wii h TRP 1084CO 0.00 1.27 0.04 -0.07 -2.79 0.00 0.00 178.44 176.89 2wii h LEU 1085N 0.56 0.53 0.21 0.65 3.38 -1.03 -1.40 115.31 118.20 2wii h LEU 1085Ca -0.03 -0.09 -0.27 0.00 0.09 0.00 0.00 57.88 57.58 2wii h LEU 1085Cb 1.31 -0.14 0.03 0.00 0.09 0.00 0.00 40.66 41.95 2wii h LEU 1085CO 0.14 0.56 -1.20 0.40 0.09 0.00 0.00 178.44 178.44 2wii h ILE 1086N 0.55 1.38 -0.00 1.22 2.04 -1.44 -2.26 117.51 119.00 2wii h ILE 1086Ca 0.12 -2.63 0.00 0.00 1.00 0.00 0.00 64.86 63.35 2wii h ILE 1086Cb 0.28 3.11 0.00 0.00 -0.74 0.00 0.00 36.82 39.48 2wii h ILE 1086CO 0.00 0.77 -0.44 0.18 0.00 0.00 0.00 178.15 178.66 2wii n LEU 1087N -3.89 0.78 0.00 1.44 4.77 -0.82 -3.88 117.00 115.40 2wii n LEU 1087Ca -0.16 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 2wii n LEU 1087Cb 0.99 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.90 2wii n LEU 1087CO 0.56 0.17 -0.31 -0.62 -1.33 0.00 0.00 177.39 175.85 2wii n GLU 1088N -1.13 2.39 0.00 3.23 -0.58 -0.53 -4.86 120.64 119.15 2wii n GLU 1088Ca 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 2wii n GLU 1088Cb 0.34 -0.81 0.00 0.00 -0.57 0.00 0.00 31.44 30.40 2wii n GLU 1088CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2wii n LYS 1089N -1.22 0.27 -4.45 3.49 4.76 -0.87 -5.00 118.16 115.14 2wii n LYS 1089Ca 0.00 -0.81 -0.34 0.00 -2.87 0.00 0.00 58.31 54.29 2wii n LYS 1089Cb 0.18 -0.99 -0.11 0.00 -1.84 0.00 0.00 35.03 32.26 2wii n LYS 1089CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2wii s GLN 1090N -0.31 3.27 0.38 1.97 0.74 -1.06 -1.46 119.66 123.19 2wii s GLN 1090Ca 0.00 -0.50 0.01 0.00 0.05 0.00 0.00 55.36 54.92 2wii s GLN 1090Cb 0.00 -2.80 -0.02 0.00 1.10 0.00 0.00 33.01 31.28 2wii s GLN 1090CO 0.00 0.47 0.59 0.15 -0.55 0.00 0.00 175.29 175.95 2wii s LYS 1091N -0.25 3.34 0.42 1.67 -0.14 0.43 -4.91 119.74 120.30 2wii s LYS 1091Ca 0.05 -0.40 0.20 0.00 -1.36 0.00 0.00 55.97 54.46 2wii s LYS 1091Cb -0.13 -2.63 1.14 0.00 -1.68 0.00 0.00 37.83 34.53 2wii s LYS 1091CO 0.02 0.01 1.81 -1.35 -0.76 0.00 0.00 175.35 175.08 2wii h PRO 1092N 0.63 0.35 0.00 -1.68 0.11 -2.00 0.34 132.00 129.76 2wii h PRO 1092Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2wii h PRO 1092Cb 1.23 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2wii h PRO 1092CO 0.60 0.23 0.00 -0.40 -0.21 0.00 0.00 178.00 178.22 2wii n ASP 1093N -4.53 0.26 0.00 -2.05 5.75 -1.26 -4.88 116.55 109.83 2wii n ASP 1093Ca 0.23 0.54 0.00 0.00 -0.01 0.00 0.00 54.79 55.55 2wii n ASP 1093Cb 0.83 -0.60 0.00 0.00 -1.03 0.00 0.00 41.12 40.32 2wii n ASP 1093CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2wii n GLY 1094N 0.78 1.02 3.80 6.12 0.00 0.12 -4.42 105.19 112.60 2wii n GLY 1094Ca 0.05 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 2wii n GLY 1094CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wii s VAL 1095N -2.00 5.24 -0.03 1.61 1.01 -1.24 -3.93 120.40 121.06 2wii s VAL 1095Ca 0.00 0.60 -0.20 0.00 0.00 0.00 0.00 61.98 62.38 2wii s VAL 1095Cb 0.00 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.71 2wii s VAL 1095CO 0.00 0.50 0.56 -0.36 0.00 0.00 0.00 175.10 175.81 2wii s PHE 1096N -0.39 3.64 -0.03 5.22 0.08 -1.26 -0.43 117.98 124.82 2wii s PHE 1096Ca 0.19 1.12 0.07 0.00 0.12 0.00 0.00 56.93 58.43 2wii s PHE 1096Cb -0.14 -2.59 -0.02 0.00 -0.57 0.00 0.00 43.02 39.70 2wii s PHE 1096CO 0.08 0.31 -0.25 -1.14 -0.10 0.00 0.00 175.22 174.12 2wii s GLN 1097N -0.01 2.20 -0.25 0.44 0.74 -0.53 -4.43 119.66 117.82 2wii s GLN 1097Ca 0.30 -0.91 -0.14 0.00 0.05 0.00 0.00 55.36 54.66 2wii s GLN 1097Cb -0.17 -2.08 -0.04 0.00 1.10 0.00 0.00 33.01 31.81 2wii s GLN 1097CO 0.15 0.54 0.31 -2.00 -0.55 0.00 0.00 175.29 173.74 2wii s GLU 1098N -0.56 4.04 -0.01 1.67 2.56 -1.26 -4.79 118.70 120.36 2wii s GLU 1098Ca 0.08 -0.05 0.16 0.00 0.00 0.00 0.00 54.97 55.16 2wii s GLU 1098Cb -0.11 -3.61 -0.20 0.00 2.00 0.00 0.00 34.13 32.21 2wii s GLU 1098CO -0.00 -0.15 0.55 -0.25 -0.56 0.00 0.00 175.26 174.84 2wii n ASP 1099N 4.92 0.95 -3.43 -1.70 8.00 -1.26 -4.83 116.55 119.21 2wii n ASP 1099Ca -0.11 -0.53 -0.22 0.00 0.71 0.00 0.00 54.79 54.64 2wii n ASP 1099Cb 0.51 1.30 -0.11 0.00 -0.02 0.00 0.00 41.12 42.80 2wii n ASP 1099CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wii s ALA 1100N -2.75 0.13 0.71 2.24 0.00 -1.26 -5.08 121.76 115.75 2wii s ALA 1100Ca 0.01 -1.11 -0.16 0.00 0.00 0.00 0.00 51.96 50.70 2wii s ALA 1100Cb 0.11 -1.76 0.02 0.00 0.00 0.00 0.00 23.12 21.50 2wii s ALA 1100CO 0.66 -1.96 1.23 -2.30 0.00 0.00 0.00 175.76 173.40 2wii n PRO 1101N 4.58 0.74 -2.23 0.00 -0.02 -1.26 -4.20 135.00 132.61 2wii n PRO 1101Ca 0.06 0.31 -0.32 0.00 -2.02 0.00 0.00 63.50 61.53 2wii n PRO 1101Cb 0.42 -2.47 -0.01 0.00 -0.02 0.00 0.00 33.50 31.42 2wii n PRO 1101CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2wii s VAL 1102N -1.68 4.20 0.16 -1.45 -7.23 -1.26 -4.98 120.40 108.16 2wii s VAL 1102Ca 0.79 1.05 -0.10 0.00 -1.81 0.00 0.00 61.98 61.91 2wii s VAL 1102Cb -0.35 -3.57 -0.02 0.00 0.56 0.00 0.00 36.38 33.01 2wii s VAL 1102CO 0.45 -0.61 1.52 0.40 -0.31 0.00 0.00 175.10 176.55 2wii h ILE 1103N 0.69 1.27 -1.60 -0.62 2.04 -2.03 -3.35 117.51 113.92 2wii h ILE 1103Ca -0.47 -1.47 -0.72 0.00 1.00 0.00 0.00 64.86 63.20 2wii h ILE 1103Cb 1.20 1.26 -0.14 0.00 -0.74 0.00 0.00 36.82 38.41 2wii h ILE 1103CO 0.60 0.50 1.76 1.41 0.00 0.00 0.00 178.15 182.41 2wii n HIS 1104N -4.08 4.64 0.15 1.37 8.25 -1.26 -4.80 115.22 119.50 2wii n HIS 1104Ca -0.01 -3.14 0.04 0.00 -0.26 0.00 0.00 57.72 54.36 2wii n HIS 1104Cb 0.50 -2.32 0.21 0.00 1.12 0.00 0.00 29.99 29.50 2wii n HIS 1104CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2wii n GLN 1105N 6.35 0.04 0.07 -0.41 1.13 -1.26 -1.66 117.38 121.65 2wii n GLN 1105Ca 0.42 0.48 0.12 0.00 -1.94 0.00 0.00 57.00 56.08 2wii n GLN 1105Cb 0.43 -1.62 0.28 0.00 0.11 0.00 0.00 30.24 29.45 2wii n GLN 1105CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2wii n GLU 1106N -1.70 0.25 0.00 -1.09 0.00 -1.26 -3.66 120.64 113.18 2wii n GLU 1106Ca 0.01 0.12 0.14 0.00 0.00 0.00 0.00 57.16 57.43 2wii n GLU 1106Cb 0.05 -1.71 0.50 0.00 0.00 0.00 0.00 31.44 30.28 2wii n GLU 1106CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wii n MET 1107N -2.10 0.84 0.00 3.44 0.00 -0.66 -3.66 117.12 114.98 2wii n MET 1107Ca 0.04 -0.41 0.12 0.00 0.00 0.00 0.00 57.70 57.46 2wii n MET 1107Cb 0.43 -1.49 0.22 0.00 0.00 0.00 0.00 33.22 32.37 2wii n MET 1107CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 2wii n ILE 1108N -0.72 0.00 0.00 3.17 -5.35 -1.24 -4.20 119.36 111.02 2wii n ILE 1108Ca 0.14 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.38 2wii n ILE 1108Cb 0.31 0.87 0.00 0.00 -1.74 0.00 0.00 39.64 39.08 2wii n ILE 1108CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2wii n GLY 1109N 1.35 3.21 0.22 3.28 0.00 -1.24 -3.18 105.19 108.84 2wii n GLY 1109Ca 0.12 -0.15 0.14 0.00 0.00 0.00 0.00 46.02 46.13 2wii n GLY 1109CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2wii h GLY 1110N 0.00 0.00 2.00 -0.02 0.00 -1.92 -3.18 103.07 99.95 2wii h GLY 1110Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2wii h GLY 1110CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.58 2wii n LEU 1111N -2.94 0.37 0.18 3.11 4.32 -1.19 -2.55 117.00 118.30 2wii n LEU 1111Ca 0.03 0.67 0.05 0.00 -0.02 0.00 0.00 56.01 56.73 2wii n LEU 1111Cb 0.40 -0.71 0.30 0.00 -1.62 0.00 0.00 43.42 41.79 2wii n LEU 1111CO 0.30 -0.78 0.65 -0.09 -1.22 0.00 0.00 177.39 176.24 2wii h ARG 1112N 0.00 0.00 -2.84 3.23 2.43 -1.80 -3.36 114.38 112.04 2wii h ARG 1112Ca 0.00 0.00 -0.64 0.00 -0.81 0.00 0.00 59.98 58.53 2wii h ARG 1112Cb 0.01 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 2wii h ARG 1112CO 0.00 0.41 3.23 0.09 -1.51 0.00 0.00 179.97 182.19 2wii n ASN 1113N -3.55 8.35 0.00 -3.80 4.13 -1.06 -4.97 115.26 114.37 2wii n ASN 1113Ca -0.00 -2.67 0.00 0.00 1.68 0.00 0.00 54.58 53.59 2wii n ASN 1113Cb 0.53 -1.51 0.00 0.00 -1.54 0.00 0.00 39.78 37.26 2wii n ASN 1113CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2wii n ASN 1114N 3.14 0.00 -1.23 6.41 5.03 -1.26 -4.88 115.26 122.48 2wii n ASN 1114Ca 0.73 0.00 0.00 0.00 0.87 0.00 0.00 54.58 56.18 2wii n ASN 1114Cb 0.29 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.05 2wii n ASN 1114CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2wii n ASN 1115N -0.01 0.00 -4.12 6.41 3.02 -1.26 -3.93 115.26 115.37 2wii n ASN 1115Ca 0.00 0.82 -0.35 0.00 -0.03 0.00 0.00 54.58 55.02 2wii n ASN 1115Cb 0.00 -1.23 -0.04 0.00 -0.61 0.00 0.00 39.78 37.91 2wii n ASN 1115CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2wii n GLU 1116N 1.20 -1.20 0.04 3.52 0.28 -1.26 -4.86 120.64 118.36 2wii n GLU 1116Ca 0.00 0.18 -0.07 0.00 -0.16 0.00 0.00 57.16 57.10 2wii n GLU 1116Cb 0.00 -3.48 0.09 0.00 1.43 0.00 0.00 31.44 29.48 2wii n GLU 1116CO 0.00 0.00 0.00 1.57 -0.16 0.00 0.00 177.13 178.54 2wii h LYS 1117N -2.07 0.43 -0.77 3.44 2.10 -1.94 -2.60 116.57 115.16 2wii h LYS 1117Ca -0.67 -0.27 -0.03 0.00 -2.00 0.00 0.00 60.65 57.68 2wii h LYS 1117Cb 1.39 0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 32.72 2wii h LYS 1117CO 0.61 0.86 0.38 -0.44 -2.00 0.00 0.00 179.45 178.86 2wii h ASP 1118N 0.34 1.00 -0.50 7.07 3.32 -1.91 0.32 116.42 126.06 2wii h ASP 1118Ca 0.01 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.82 2wii h ASP 1118Cb 1.05 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.33 2wii h ASP 1118CO 0.09 0.85 -0.10 0.24 -1.72 0.00 0.00 179.24 178.60 2wii h MET 1119N 1.08 0.95 0.03 3.56 2.86 -1.92 -1.35 114.93 120.13 2wii h MET 1119Ca 0.27 -0.35 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 2wii h MET 1119Cb 0.11 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.71 2wii h MET 1119CO -0.03 1.02 -0.01 0.00 1.06 0.00 0.00 176.91 178.94 2wii h ALA 1120N 0.90 -0.04 -0.48 6.32 0.00 -1.09 -2.48 119.26 122.39 2wii h ALA 1120Ca 0.13 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2wii h ALA 1120Cb 0.65 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2wii h ALA 1120CO 0.05 -0.28 0.02 1.25 0.00 0.00 0.00 179.25 180.29 2wii h LEU 1121N -0.51 0.82 -0.86 0.00 5.85 -0.42 -1.25 115.31 118.94 2wii h LEU 1121Ca -0.00 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 2wii h LEU 1121Cb 0.48 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 2wii h LEU 1121CO 0.01 0.91 0.47 0.74 -0.34 0.00 0.00 178.44 180.23 2wii h THR 1122N 0.70 1.25 -0.36 1.05 2.02 -1.33 -1.54 112.91 114.69 2wii h THR 1122Ca 0.14 -0.61 -0.06 0.00 0.77 0.00 0.00 66.41 66.65 2wii h THR 1122Cb 0.48 0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.97 2wii h THR 1122CO 0.02 0.28 -0.02 0.00 0.37 0.00 0.00 175.52 176.17 2wii h ALA 1123N 1.25 0.49 0.20 6.16 0.00 -1.24 -0.75 119.26 125.38 2wii h ALA 1123Ca 0.30 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2wii h ALA 1123Cb 0.02 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2wii h ALA 1123CO -0.05 0.28 -0.12 0.35 0.00 0.00 0.00 179.25 179.70 2wii h PHE 1124N 0.46 -0.32 -0.82 0.00 3.57 -0.94 0.30 116.94 119.18 2wii h PHE 1124Ca 0.10 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 2wii h PHE 1124Cb 0.49 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.31 2wii h PHE 1124CO 0.04 -0.20 0.46 0.28 -2.23 0.00 0.00 178.31 176.67 2wii h VAL 1125N -0.32 1.24 -0.47 1.41 2.07 -1.31 -2.50 116.25 116.38 2wii h VAL 1125Ca -0.02 -0.58 0.01 0.00 0.82 0.00 0.00 66.70 66.93 2wii h VAL 1125Cb 0.26 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 2wii h VAL 1125CO 0.02 0.26 0.29 0.25 0.02 0.00 0.00 177.57 178.42 2wii h LEU 1126N 1.14 0.49 -0.82 2.57 5.85 -0.81 -1.10 115.31 122.63 2wii h LEU 1126Ca 0.29 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.06 2wii h LEU 1126Cb 0.01 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.87 2wii h LEU 1126CO -0.05 0.35 0.50 0.40 -0.34 0.00 0.00 178.44 179.30 2wii h ILE 1127N 0.59 1.04 -0.69 4.05 2.04 -0.65 -1.36 117.51 122.53 2wii h ILE 1127Ca 0.18 -0.32 -0.06 0.00 1.00 0.00 0.00 64.86 65.66 2wii h ILE 1127Cb -0.03 0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.06 2wii h ILE 1127CO -0.06 0.17 0.19 0.28 0.00 0.00 0.00 178.15 178.73 2wii h SER 1128N 0.93 1.00 -0.57 1.72 0.02 -0.97 -2.53 113.55 113.15 2wii h SER 1128Ca 0.36 -0.19 -0.10 0.00 -0.84 0.00 0.00 61.79 61.01 2wii h SER 1128Cb 0.15 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2wii h SER 1128CO -0.17 0.95 -0.05 -0.07 -1.14 0.00 0.00 176.83 176.35 2wii h LEU 1129N 1.02 1.03 -1.01 5.07 3.38 -0.43 -2.47 115.31 121.90 2wii h LEU 1129Ca 0.22 -0.33 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 2wii h LEU 1129Cb 0.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2wii h LEU 1129CO -0.00 1.11 -0.49 1.56 0.09 0.00 0.00 178.44 180.71 2wii h GLN 1130N 0.92 0.02 0.00 1.13 4.20 -1.14 -0.63 115.11 119.61 2wii h GLN 1130Ca 0.15 -0.01 -0.05 0.00 0.06 0.00 0.00 58.65 58.80 2wii h GLN 1130Cb 0.62 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 2wii h GLN 1130CO 0.04 0.50 -0.25 1.49 -0.67 0.00 0.00 178.83 179.94 2wii h GLU 1131N 0.01 0.00 -0.02 1.46 4.81 -1.29 -3.06 114.58 116.50 2wii h GLU 1131Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2wii h GLU 1131Cb 0.87 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.25 2wii h GLU 1131CO 0.06 0.25 -0.23 0.00 -0.73 0.00 0.00 179.01 178.36 2wii n ALA 1132N -2.20 3.01 0.05 2.92 0.00 -0.88 -4.47 120.51 118.94 2wii n ALA 1132Ca 0.01 -0.61 -0.11 0.00 0.00 0.00 0.00 53.44 52.73 2wii n ALA 1132Cb 0.51 -0.88 -0.05 0.00 0.00 0.00 0.00 19.45 19.04 2wii n ALA 1132CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2wii h LYS 1133N 3.09 -0.21 0.00 0.00 3.64 -1.02 0.11 116.57 122.17 2wii h LYS 1133Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2wii h LYS 1133Cb 0.79 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.65 2wii h LYS 1133CO 0.00 -0.14 0.05 -0.44 -2.27 0.00 0.00 179.45 176.65 2wii h ASP 1134N -0.22 0.00 0.00 4.20 3.32 -1.79 -0.56 116.42 121.37 2wii h ASP 1134Ca 0.05 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.79 2wii h ASP 1134Cb 0.29 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 2wii h ASP 1134CO -0.14 0.00 -2.19 -0.38 -1.72 0.00 0.00 179.24 174.80 2wii n ILE 1135N -2.77 1.20 -0.01 0.35 5.41 -0.69 -4.69 119.36 118.16 2wii n ILE 1135Ca -0.02 -0.55 0.03 0.00 1.00 0.00 0.00 62.75 63.20 2wii n ILE 1135Cb 0.11 -1.01 0.07 0.00 -0.71 0.00 0.00 39.64 38.09 2wii n ILE 1135CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2wii h GLU 1137N 1.11 0.07 0.00 0.00 4.81 -1.30 0.17 114.58 119.45 2wii h GLU 1137Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 2wii h GLU 1137Cb 0.53 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 2wii h GLU 1137CO 0.00 0.58 -0.16 1.49 -0.73 0.00 0.00 179.01 180.20 2wii h GLU 1138N 0.05 0.00 0.00 1.92 4.22 -1.82 -3.31 114.58 115.64 2wii h GLU 1138Ca -0.00 0.00 -0.37 0.00 0.08 0.00 0.00 59.36 59.07 2wii h GLU 1138Cb 0.96 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.14 2wii h GLU 1138CO 0.07 0.16 -2.38 1.04 -2.18 0.00 0.00 179.01 175.72 2wii n GLN 1139N -3.15 0.69 -3.74 1.92 6.02 -1.11 -4.84 117.38 113.17 2wii n GLN 1139Ca 0.03 -0.00 -0.38 0.00 -0.01 0.00 0.00 57.00 56.64 2wii n GLN 1139Cb 0.58 -1.52 -0.12 0.00 1.02 0.00 0.00 30.24 30.20 2wii n GLN 1139CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2wii s VAL 1140N -2.49 3.66 0.26 5.09 1.01 0.59 -4.96 120.40 123.56 2wii s VAL 1140Ca -0.10 -1.50 0.15 0.00 0.00 0.00 0.00 61.98 60.52 2wii s VAL 1140Cb 0.06 -3.24 0.07 0.00 0.00 0.00 0.00 36.38 33.27 2wii s VAL 1140CO 0.82 -0.41 1.72 0.78 0.00 0.00 0.00 175.10 178.02 2wii h ASN 1141N 8.20 0.00 0.89 3.32 2.35 -1.86 -3.10 115.58 125.38 2wii h ASN 1141Ca -0.20 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.55 2wii h ASN 1141Cb 1.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.44 2wii h ASN 1141CO 0.67 0.45 -0.24 -1.54 -1.65 0.00 0.00 177.43 175.12 2wii n SER 1142N -3.75 0.36 0.02 5.81 3.41 -1.26 -4.23 113.62 113.98 2wii n SER 1142Ca -0.01 0.23 -0.10 0.00 -0.26 0.00 0.00 58.87 58.73 2wii n SER 1142Cb 0.51 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 64.21 2wii n SER 1142CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2wii h LEU 1143N 0.00 -0.54 -0.82 1.04 5.85 -1.91 0.61 115.31 119.55 2wii h LEU 1143Ca 0.00 0.09 0.09 0.00 0.84 0.00 0.00 57.88 58.90 2wii h LEU 1143Cb 0.57 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.76 2wii h LEU 1143CO 0.00 -0.23 0.47 -0.65 -0.34 0.00 0.00 178.44 177.69 2wii h PRO 1144N -0.25 0.77 -0.36 5.25 0.11 -1.81 0.07 132.00 135.77 2wii h PRO 1144Ca 0.08 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 65.99 2wii h PRO 1144Cb 0.36 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.29 2wii h PRO 1144CO -0.22 0.51 -0.37 0.78 -0.21 0.00 0.00 178.00 178.48 2wii h GLY 1145N 0.79 0.94 0.99 -0.55 0.00 -1.72 -2.47 103.07 101.05 2wii h GLY 1145Ca 0.39 -0.94 -0.01 0.00 0.00 0.00 0.00 47.33 46.78 2wii h GLY 1145CO -0.24 0.85 0.33 0.23 0.00 0.00 0.00 176.54 177.70 2wii h SER 1146N 0.71 0.68 -0.51 0.19 0.87 0.03 0.14 113.55 115.65 2wii h SER 1146Ca 0.06 -0.07 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2wii h SER 1146Cb 0.94 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.71 2wii h SER 1146CO 0.09 0.55 0.25 0.40 -0.53 0.00 0.00 176.83 177.59 2wii h ILE 1147N 0.75 1.19 -0.62 2.23 2.04 -0.97 -0.57 117.51 121.56 2wii h ILE 1147Ca 0.20 -0.52 -0.09 0.00 1.00 0.00 0.00 64.86 65.45 2wii h ILE 1147Cb 0.00 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 2wii h ILE 1147CO -0.04 0.21 0.04 0.74 0.00 0.00 0.00 178.15 179.10 2wii h THR 1148N 0.68 1.26 -0.16 -0.27 2.02 -1.15 -1.77 112.91 113.52 2wii h THR 1148Ca 0.18 -1.10 -0.17 0.00 0.77 0.00 0.00 66.41 66.08 2wii h THR 1148Cb 0.10 0.74 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 2wii h THR 1148CO -0.02 0.40 -0.61 0.50 0.37 0.00 0.00 175.52 176.16 2wii h LYS 1149N 0.98 0.53 -0.41 6.66 3.11 -0.77 -1.40 116.57 125.27 2wii h LYS 1149Ca 0.18 -0.36 -0.09 0.00 -2.81 0.00 0.00 60.65 57.57 2wii h LYS 1149Cb 0.51 0.05 -0.02 0.00 -1.00 0.00 0.00 32.23 31.77 2wii h LYS 1149CO 0.02 0.98 -0.12 0.00 -2.81 0.00 0.00 179.45 177.52 2wii h ALA 1150N 0.94 1.02 -0.26 5.00 0.00 -1.00 -2.81 119.26 122.15 2wii h ALA 1150Ca -0.00 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 2wii h ALA 1150Cb 1.16 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 2wii h ALA 1150CO 0.11 0.59 -0.35 0.78 0.00 0.00 0.00 179.25 180.39 2wii h GLY 1151N 0.97 0.62 0.81 0.00 0.00 -1.10 -2.87 103.07 101.50 2wii h GLY 1151Ca 0.11 -0.58 0.06 0.00 0.00 0.00 0.00 47.33 46.92 2wii h GLY 1151CO 0.04 0.53 0.65 -0.55 0.00 0.00 0.00 176.54 177.20 2wii h ASP 1152N 0.48 1.05 -0.23 0.19 3.32 -1.00 0.12 116.42 120.35 2wii h ASP 1152Ca 0.05 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.01 2wii h ASP 1152Cb 0.83 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.15 2wii h ASP 1152CO 0.07 0.68 -0.21 0.15 -1.72 0.00 0.00 179.24 178.22 2wii h PHE 1153N 1.19 0.66 -0.55 4.55 3.57 -1.39 -2.43 116.94 122.55 2wii h PHE 1153Ca 0.42 -0.19 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 2wii h PHE 1153Cb 0.11 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.69 2wii h PHE 1153CO -0.00 0.87 0.18 -0.07 -2.23 0.00 0.00 178.31 177.06 2wii h LEU 1154N 0.26 0.80 -1.15 0.59 3.38 -1.26 -2.50 115.31 115.43 2wii h LEU 1154Ca 0.04 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 57.82 2wii h LEU 1154Cb 0.75 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 2wii h LEU 1154CO 0.05 0.79 0.57 -0.08 0.09 0.00 0.00 178.44 179.87 2wii h GLU 1155N 0.77 1.14 0.05 1.13 4.57 -0.73 -1.27 114.58 120.24 2wii h GLU 1155Ca 0.18 -0.07 -0.23 0.00 -1.18 0.00 0.00 59.36 58.06 2wii h GLU 1155Cb 0.28 -0.26 -0.00 0.00 -0.16 0.00 0.00 28.75 28.60 2wii h GLU 1155CO -0.01 0.75 -1.04 0.00 -1.18 0.00 0.00 179.01 177.54 2wii h ALA 1156N 1.46 0.32 -0.32 2.92 0.00 -1.27 -3.33 119.26 119.04 2wii h ALA 1156Ca 0.32 -0.80 0.00 0.00 0.00 0.00 0.00 54.91 54.43 2wii h ALA 1156Cb -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.61 2wii h ALA 1156CO -0.07 0.95 0.00 0.09 0.00 0.00 0.00 179.25 180.23 2wii n ASN 1157N -3.59 3.63 -0.03 0.00 4.13 -0.96 -4.63 115.26 113.80 2wii n ASN 1157Ca -0.06 -2.62 -0.16 0.00 1.68 0.00 0.00 54.58 53.42 2wii n ASN 1157Cb 0.91 -0.44 -0.08 0.00 -1.54 0.00 0.00 39.78 38.63 2wii n ASN 1157CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 2wii h TYR 1158N 2.04 0.85 0.00 3.10 3.20 -1.35 -3.25 116.97 121.57 2wii h TYR 1158Ca 0.00 -0.37 -0.02 0.00 3.14 0.00 0.00 58.73 61.48 2wii h TYR 1158Cb 1.20 -0.13 -0.00 0.00 1.54 0.00 0.00 36.73 39.33 2wii h TYR 1158CO 0.43 1.17 -0.09 0.52 -1.64 0.00 0.00 178.16 178.54 2wii h MET 1159N 0.29 0.00 0.00 1.82 2.86 -1.84 -2.43 114.93 115.63 2wii h MET 1159Ca -0.04 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 2wii h MET 1159Cb 1.23 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.88 2wii h MET 1159CO 0.12 0.09 -0.13 -0.91 1.06 0.00 0.00 176.91 177.15 2wii h ASN 1160N 0.00 0.00 -2.86 1.22 2.35 -1.89 -3.46 115.58 110.94 2wii h ASN 1160Ca -0.00 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.16 2wii h ASN 1160Cb 0.23 0.00 0.12 0.00 0.05 0.00 0.00 38.32 38.72 2wii h ASN 1160CO 0.01 0.13 0.17 0.18 -1.65 0.00 0.00 177.43 176.27 2wii n LEU 1161N -3.15 2.33 -0.04 1.61 4.77 -0.92 -4.94 117.00 116.66 2wii n LEU 1161Ca 0.03 1.10 -0.05 0.00 -0.03 0.00 0.00 56.01 57.05 2wii n LEU 1161Cb 0.53 -1.34 -0.04 0.00 -2.33 0.00 0.00 43.42 40.25 2wii n LEU 1161CO 0.34 -1.40 -0.75 0.00 -1.33 0.00 0.00 177.39 174.26 2wii n GLN 1162N 0.41 0.37 -2.77 3.23 1.13 -1.26 -5.03 117.38 113.46 2wii n GLN 1162Ca 0.09 0.04 -0.40 0.00 -1.94 0.00 0.00 57.00 54.79 2wii n GLN 1162Cb 0.36 -1.15 -0.06 0.00 0.11 0.00 0.00 30.24 29.50 2wii n GLN 1162CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2wii s ARG 1163N -2.15 4.80 0.25 -1.09 0.52 -1.26 -4.96 118.95 115.05 2wii s ARG 1163Ca -0.10 1.45 -0.05 0.00 -0.52 0.00 0.00 55.73 56.51 2wii s ARG 1163Cb 0.03 -3.30 0.28 0.00 0.52 0.00 0.00 34.95 32.48 2wii s ARG 1163CO 0.18 0.46 1.86 0.77 0.02 0.00 0.00 175.30 178.59 2wii h SER 1164N 4.46 1.03 0.13 0.23 0.02 -1.95 -2.76 113.55 114.70 2wii h SER 1164Ca -0.45 -0.11 0.02 0.00 -0.84 0.00 0.00 61.79 60.41 2wii h SER 1164Cb 1.20 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 2wii h SER 1164CO 0.69 0.85 -0.25 0.22 -1.14 0.00 0.00 176.83 177.20 2wii h TYR 1165N 1.13 -0.67 -0.72 3.45 3.20 -1.88 -0.09 116.97 121.38 2wii h TYR 1165Ca 0.28 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.18 2wii h TYR 1165Cb 0.09 0.28 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 2wii h TYR 1165CO 0.01 -0.35 0.47 1.15 -1.64 0.00 0.00 178.16 177.80 2wii h THR 1166N -0.46 1.15 -0.95 1.81 2.02 -1.95 -1.14 112.91 113.38 2wii h THR 1166Ca 0.03 -0.32 0.01 0.00 0.77 0.00 0.00 66.41 66.89 2wii h THR 1166Cb 0.48 0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 2wii h THR 1166CO -0.14 0.17 0.63 0.58 0.37 0.00 0.00 175.52 177.14 2wii h VAL 1167N 0.94 1.24 -0.08 3.16 2.07 -1.17 0.10 116.25 122.52 2wii h VAL 1167Ca 0.28 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 2wii h VAL 1167Cb -0.05 -0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 29.56 2wii h VAL 1167CO -0.08 0.24 -0.07 0.00 0.02 0.00 0.00 177.57 177.67 2wii h ALA 1168N 1.41 0.12 -0.13 1.67 0.00 -0.32 -0.37 119.26 121.62 2wii h ALA 1168Ca 0.35 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.81 2wii h ALA 1168Cb -0.15 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2wii h ALA 1168CO -0.08 -0.08 -0.64 0.97 0.00 0.00 0.00 179.25 179.43 2wii h ILE 1169N -0.22 1.34 -0.06 0.00 2.10 -1.09 -2.53 117.51 117.05 2wii h ILE 1169Ca 0.01 -1.95 -0.22 0.00 1.08 0.00 0.00 64.86 63.79 2wii h ILE 1169Cb 0.57 1.93 0.00 0.00 -1.09 0.00 0.00 36.82 38.23 2wii h ILE 1169CO 0.02 0.60 -0.85 0.00 -1.08 0.00 0.00 178.15 176.83 2wii h ALA 1170N 0.95 0.40 -0.90 0.18 0.00 -0.86 -2.85 119.26 116.17 2wii h ALA 1170Ca -0.01 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.24 2wii h ALA 1170Cb 1.19 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 2wii h ALA 1170CO 0.11 0.76 0.54 0.78 0.00 0.00 0.00 179.25 181.44 2wii h GLY 1171N 1.02 1.32 1.13 0.00 0.00 -1.01 -1.57 103.07 103.95 2wii h GLY 1171Ca -0.06 -0.56 -0.11 0.00 0.00 0.00 0.00 47.33 46.60 2wii h GLY 1171CO 0.16 0.54 -0.09 -1.82 0.00 0.00 0.00 176.54 175.32 2wii h TYR 1172N 1.25 1.14 -0.35 5.60 3.20 -1.44 0.93 116.97 127.30 2wii h TYR 1172Ca 0.32 -0.23 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 2wii h TYR 1172Cb -0.04 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 37.93 2wii h TYR 1172CO 0.01 1.04 0.18 0.00 -1.64 0.00 0.00 178.16 177.75 2wii h ALA 1173N 0.97 0.44 -0.47 1.82 0.00 -1.22 -2.28 119.26 118.52 2wii h ALA 1173Ca 0.14 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2wii h ALA 1173Cb 0.66 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2wii h ALA 1173CO 0.05 -0.01 -0.24 -0.07 0.00 0.00 0.00 179.25 178.98 2wii h LEU 1174N 0.43 1.02 -2.01 0.00 3.38 -1.19 -2.99 115.31 113.95 2wii h LEU 1174Ca 0.12 -0.41 0.01 0.00 0.09 0.00 0.00 57.88 57.69 2wii h LEU 1174Cb 0.09 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 2wii h LEU 1174CO -0.02 1.20 0.02 0.00 0.09 0.00 0.00 178.44 179.74 2wii h ALA 1175N 0.85 2.01 -0.13 1.53 0.00 -0.63 -0.87 119.26 122.02 2wii h ALA 1175Ca 0.10 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 2wii h ALA 1175Cb 0.82 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 2wii h ALA 1175CO 0.07 -0.03 -0.12 1.96 0.00 0.00 0.00 179.25 181.13 2wii h GLN 1176N 0.00 0.21 -0.01 0.00 4.20 -1.25 -1.48 115.11 116.77 2wii h GLN 1176Ca 0.01 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2wii h GLN 1176Cb 0.05 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2wii h GLN 1176CO -0.00 0.34 -0.34 -1.33 -0.67 0.00 0.00 178.83 176.83 2wii n MET 1177N -4.30 0.97 -2.41 1.46 2.81 -0.46 -4.93 117.12 110.25 2wii n MET 1177Ca -0.01 -0.67 -0.11 0.00 -1.81 0.00 0.00 57.70 55.10 2wii n MET 1177Cb 0.25 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.28 2wii n MET 1177CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wii n GLY 1178N 1.37 -0.02 0.93 3.03 0.00 -0.56 -4.92 105.19 105.02 2wii n GLY 1178Ca 0.11 -0.37 0.08 0.00 0.00 0.00 0.00 46.02 45.84 2wii n GLY 1178CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wii n ARG 1179N -2.24 2.89 -3.21 1.61 1.74 -0.46 -4.76 116.66 112.23 2wii n ARG 1179Ca -0.10 -2.33 -0.45 0.00 -0.77 0.00 0.00 57.85 54.20 2wii n ARG 1179Cb 0.58 -1.43 -0.01 0.00 -1.02 0.00 0.00 32.46 30.59 2wii n ARG 1179CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2wii s LEU 1180N -1.14 6.00 0.10 0.55 2.96 -1.24 -4.89 118.68 121.01 2wii s LEU 1180Ca 0.34 -3.20 0.02 0.00 -0.22 0.00 0.00 54.13 51.07 2wii s LEU 1180Cb 0.19 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2wii s LEU 1180CO 0.21 -0.50 -0.08 -0.54 -1.32 0.00 0.00 176.35 174.13 2wii s LYS 1181N -0.07 0.84 6.16 1.98 1.02 -1.26 -4.49 119.74 123.92 2wii s LYS 1181Ca 0.32 -1.26 0.00 0.00 0.02 0.00 0.00 55.97 55.05 2wii s LYS 1181Cb -0.08 -0.33 0.00 0.00 -0.52 0.00 0.00 37.83 36.90 2wii s LYS 1181CO -0.06 0.02 0.00 0.41 -0.92 0.00 0.00 175.35 174.80 2wii n GLY 1182N 0.19 1.83 0.36 -3.33 0.00 -1.26 -3.34 105.19 99.65 2wii n GLY 1182Ca -0.14 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.44 2wii n GLY 1182CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2wii h PRO 1183N 0.00 0.90 -0.64 1.61 0.11 -1.99 -1.20 132.00 130.80 2wii h PRO 1183Ca 0.00 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2wii h PRO 1183Cb 0.00 -0.20 -0.03 0.00 0.11 0.00 0.00 31.00 30.88 2wii h PRO 1183CO 0.00 0.60 0.30 -0.07 -0.21 0.00 0.00 178.00 178.61 2wii h LEU 1184N 0.93 0.85 -0.46 2.35 4.07 -1.94 0.25 115.31 121.36 2wii h LEU 1184Ca 0.41 -0.14 -0.06 0.00 0.08 0.00 0.00 57.88 58.18 2wii h LEU 1184Cb 0.36 -0.22 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 2wii h LEU 1184CO -0.17 0.75 0.07 0.25 -1.08 0.00 0.00 178.44 178.26 2wii h LEU 1185N 0.88 0.73 -0.23 1.67 5.85 -1.44 -1.64 115.31 121.14 2wii h LEU 1185Ca 0.22 -0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.68 2wii h LEU 1185Cb 0.14 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2wii h LEU 1185CO -0.03 0.81 0.13 -1.13 -0.34 0.00 0.00 178.44 177.89 2wii h ASN 1186N 0.62 0.22 -0.44 1.25 -1.24 -0.96 -1.72 115.58 113.32 2wii h ASN 1186Ca 0.14 0.00 0.03 0.00 0.71 0.00 0.00 56.30 57.18 2wii h ASN 1186Cb 0.39 -0.05 -0.04 0.00 0.73 0.00 0.00 38.32 39.36 2wii h ASN 1186CO 0.01 0.16 0.22 0.50 -1.29 0.00 0.00 177.43 177.04 2wii h LYS 1187N 0.28 0.43 -0.55 6.67 3.64 -0.85 0.59 116.57 126.78 2wii h LYS 1187Ca 0.09 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.49 2wii h LYS 1187Cb -0.01 -0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.66 2wii h LYS 1187CO -0.04 0.29 0.27 0.35 -2.27 0.00 0.00 179.45 178.05 2wii h PHE 1188N 0.45 0.50 -0.11 1.91 3.57 -1.03 -0.62 116.94 121.61 2wii h PHE 1188Ca 0.19 0.02 -0.20 0.00 3.53 0.00 0.00 57.97 61.50 2wii h PHE 1188Cb 0.08 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 38.68 2wii h PHE 1188CO -0.10 0.23 -0.76 -0.07 -2.23 0.00 0.00 178.31 175.39 2wii h LEU 1189N 0.53 0.71 -0.68 0.59 3.38 -0.92 -3.22 115.31 115.69 2wii h LEU 1189Ca 0.25 -0.46 -0.10 0.00 0.09 0.00 0.00 57.88 57.65 2wii h LEU 1189Cb 0.17 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2wii h LEU 1189CO -0.18 1.23 -0.50 0.71 0.09 0.00 0.00 178.44 179.80 2wii h THR 1190N 0.40 1.07 -0.52 0.22 1.35 -0.68 -3.11 112.91 111.65 2wii h THR 1190Ca -0.04 -1.92 0.00 0.00 -0.55 0.00 0.00 66.41 63.91 2wii h THR 1190Cb 1.36 2.13 -0.03 0.00 -1.73 0.00 0.00 68.15 69.88 2wii h THR 1190CO 0.14 0.49 0.34 0.74 -0.25 0.00 0.00 175.52 176.99 2wii h THR 1191N 0.00 1.14 -2.74 6.82 2.02 -1.12 -3.42 112.91 115.61 2wii h THR 1191Ca -0.00 -0.25 -0.52 0.00 0.77 0.00 0.00 66.41 66.40 2wii h THR 1191Cb 1.09 0.37 0.05 0.00 -1.74 0.00 0.00 68.15 67.91 2wii h THR 1191CO 0.06 0.13 0.95 0.00 0.37 0.00 0.00 175.52 177.04 2wii s ALA 1192N -5.61 3.85 -0.03 6.16 0.00 -1.18 -4.86 121.76 120.09 2wii s ALA 1192Ca -0.09 1.47 -0.23 0.00 0.00 0.00 0.00 51.96 53.10 2wii s ALA 1192Cb 0.17 -3.66 -0.04 0.00 0.00 0.00 0.00 23.12 19.59 2wii s ALA 1192CO 0.75 -0.87 0.69 0.21 0.00 0.00 0.00 175.76 176.54 2wii s LYS 1193N 1.27 4.43 -1.26 0.00 2.20 0.00 -3.70 119.74 122.67 2wii s LYS 1193Ca 0.73 0.89 0.00 0.00 -0.36 0.00 0.00 55.97 57.23 2wii s LYS 1193Cb -0.46 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.45 2wii s LYS 1193CO 0.32 0.17 0.00 -0.25 -0.36 0.00 0.00 175.35 175.23 2wii n ASP 1194N 3.36 -5.32 -1.72 1.43 9.92 -1.26 -2.73 116.55 120.23 2wii n ASP 1194Ca -0.03 0.29 -0.20 0.00 -0.53 0.00 0.00 54.79 54.33 2wii n ASP 1194Cb 0.51 -3.87 -0.07 0.00 -0.64 0.00 0.00 41.12 37.05 2wii n ASP 1194CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2wii n LYS 1195N -1.47 -1.46 0.00 -1.24 5.02 -1.24 -4.76 118.16 113.00 2wii n LYS 1195Ca -0.12 1.16 0.00 0.00 -2.02 0.00 0.00 58.31 57.33 2wii n LYS 1195Cb 0.54 -5.58 0.00 0.00 -0.02 0.00 0.00 35.03 29.97 2wii n LYS 1195CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2wii n ASN 1196N -1.41 0.04 -3.51 4.39 6.94 -1.11 -4.43 115.26 116.18 2wii n ASN 1196Ca -0.21 -0.10 -0.17 0.00 -0.02 0.00 0.00 54.58 54.08 2wii n ASN 1196Cb 0.67 0.21 -0.05 0.00 -2.36 0.00 0.00 39.78 38.25 2wii n ASN 1196CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2wii s ARG 1197N -0.22 1.10 -0.36 -3.83 1.70 -1.19 -4.14 118.95 112.01 2wii s ARG 1197Ca 0.00 0.10 -0.04 0.00 -0.47 0.00 0.00 55.73 55.32 2wii s ARG 1197Cb 0.00 0.51 0.07 0.00 -0.57 0.00 0.00 34.95 34.97 2wii s ARG 1197CO 0.00 -0.37 0.13 -1.58 -1.08 0.00 0.00 175.30 172.39 2wii s TRP 1198N -1.72 3.38 0.17 5.89 0.51 -1.26 -0.82 118.94 125.10 2wii s TRP 1198Ca -0.09 -1.92 0.07 0.00 -2.12 0.00 0.00 56.10 52.05 2wii s TRP 1198Cb -0.00 -2.64 -0.04 0.00 -0.81 0.00 0.00 33.47 29.97 2wii s TRP 1198CO 0.05 -0.85 -0.15 -1.83 -0.51 0.00 0.00 176.95 173.66 2wii s GLU 1199N 1.27 1.23 0.03 4.98 -1.05 -1.26 -4.12 118.70 119.78 2wii s GLU 1199Ca 0.01 -1.45 -0.01 0.00 -0.15 0.00 0.00 54.97 53.37 2wii s GLU 1199Cb -0.21 -1.11 -0.03 0.00 -0.44 0.00 0.00 34.13 32.35 2wii s GLU 1199CO -0.01 0.20 -0.02 -0.51 0.95 0.00 0.00 175.26 175.87 2wii s ASP 1200N -2.93 0.31 -0.04 0.83 1.01 -1.26 -4.66 116.67 109.94 2wii s ASP 1200Ca 0.17 -0.65 -0.32 0.00 0.71 0.00 0.00 52.55 52.46 2wii s ASP 1200Cb -0.03 0.14 -0.10 0.00 1.01 0.00 0.00 42.92 43.94 2wii s ASP 1200CO 0.06 -0.41 1.94 -2.65 0.21 0.00 0.00 175.17 174.32 2wii n PRO 1201N 1.08 2.48 -0.29 8.23 -0.02 -1.26 -4.70 135.00 140.51 2wii n PRO 1201Ca -0.21 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2wii n PRO 1201Cb 0.57 -2.83 0.00 0.00 -0.02 0.00 0.00 33.50 31.22 2wii n PRO 1201CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wii n GLY 1202N 4.54 0.46 3.77 -1.23 0.00 -1.26 -5.11 105.19 106.37 2wii n GLY 1202Ca 0.22 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.37 2wii n GLY 1202CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wii s LYS 1203N -2.00 4.21 0.38 1.61 1.02 -1.26 -4.93 119.74 118.77 2wii s LYS 1203Ca 0.00 2.16 0.14 0.00 0.02 0.00 0.00 55.97 58.29 2wii s LYS 1203Cb 0.00 -2.94 0.74 0.00 -0.52 0.00 0.00 37.83 35.11 2wii s LYS 1203CO 0.00 -0.29 1.83 1.96 -0.92 0.00 0.00 175.35 177.93 2wii h GLN 1204N 3.11 0.00 -0.36 1.68 1.08 -1.99 -3.06 115.11 115.56 2wii h GLN 1204Ca -0.49 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 56.75 2wii h GLN 1204Cb 1.23 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.64 2wii h GLN 1204CO 0.64 0.37 0.25 -0.07 -0.95 0.00 0.00 178.83 179.07 2wii h LEU 1205N 0.00 0.28 -0.65 1.46 3.38 -1.95 0.33 115.31 118.16 2wii h LEU 1205Ca -0.00 -0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 2wii h LEU 1205Cb 0.67 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2wii h LEU 1205CO 0.05 0.19 -0.27 1.88 0.09 0.00 0.00 178.44 180.38 2wii h TYR 1206N 0.33 0.87 -0.07 1.13 0.05 -1.91 -1.56 116.97 115.82 2wii h TYR 1206Ca 0.15 -0.21 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 2wii h TYR 1206Cb 0.20 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 37.73 2wii h TYR 1206CO -0.00 0.95 -0.01 -0.91 -1.05 0.00 0.00 178.16 177.13 2wii h ASN 1207N 0.65 0.12 -0.95 3.88 2.35 -1.10 0.30 115.58 120.84 2wii h ASN 1207Ca 0.08 -0.36 0.06 0.00 -0.55 0.00 0.00 56.30 55.53 2wii h ASN 1207Cb 0.79 -0.03 -0.06 0.00 0.05 0.00 0.00 38.32 39.06 2wii h ASN 1207CO 0.07 0.45 0.61 0.58 -1.65 0.00 0.00 177.43 177.49 2wii h VAL 1208N -0.21 1.09 -0.20 2.81 2.07 -1.20 0.12 116.25 120.74 2wii h VAL 1208Ca 0.02 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.11 2wii h VAL 1208Cb 0.40 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 2wii h VAL 1208CO 0.01 0.20 -0.02 -0.08 0.02 0.00 0.00 177.57 177.70 2wii h GLU 1209N 1.12 0.37 -0.44 1.57 4.81 -1.11 -2.06 114.58 118.84 2wii h GLU 1209Ca 0.41 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.48 2wii h GLU 1209Cb 0.14 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.47 2wii h GLU 1209CO -0.16 0.59 0.16 0.00 -0.73 0.00 0.00 179.01 178.87 2wii h ALA 1210N 0.76 0.58 -0.10 2.92 0.00 0.02 -2.28 119.26 121.17 2wii h ALA 1210Ca 0.05 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2wii h ALA 1210Cb 0.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2wii h ALA 1210CO 0.01 0.20 -0.18 1.15 0.00 0.00 0.00 179.25 180.44 2wii h THR 1211N 0.58 1.18 -0.43 0.00 2.02 -0.77 -1.20 112.91 114.29 2wii h THR 1211Ca 0.15 -0.82 -0.07 0.00 0.77 0.00 0.00 66.41 66.44 2wii h THR 1211Cb 0.22 1.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.92 2wii h THR 1211CO -0.01 0.25 -0.01 0.28 0.37 0.00 0.00 175.52 176.40 2wii h SER 1212N 0.15 0.75 -0.71 4.18 0.02 -0.99 0.69 113.55 117.64 2wii h SER 1212Ca 0.03 -0.31 0.01 0.00 -0.84 0.00 0.00 61.79 60.67 2wii h SER 1212Cb 0.40 -0.20 -0.04 0.00 0.14 0.00 0.00 62.40 62.71 2wii h SER 1212CO 0.03 0.88 0.47 1.88 -1.14 0.00 0.00 176.83 178.95 2wii h TYR 1213N 0.59 0.89 -0.83 3.45 0.05 -0.89 -1.68 116.97 118.56 2wii h TYR 1213Ca 0.12 0.02 -0.03 0.00 0.05 0.00 0.00 58.73 58.89 2wii h TYR 1213Cb 0.50 -0.30 -0.04 0.00 1.01 0.00 0.00 36.73 37.91 2wii h TYR 1213CO 0.04 0.56 0.41 0.00 -1.05 0.00 0.00 178.16 178.12 2wii h ALA 1214N 1.26 1.06 -0.48 3.88 0.00 -0.91 -1.11 119.26 122.96 2wii h ALA 1214Ca 0.26 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2wii h ALA 1214Cb -0.11 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 2wii h ALA 1214CO -0.06 0.62 0.26 1.25 0.00 0.00 0.00 179.25 181.33 2wii h LEU 1215N 1.17 0.60 -1.17 0.00 5.85 -0.46 0.72 115.31 122.01 2wii h LEU 1215Ca 0.28 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.89 2wii h LEU 1215Cb 0.10 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 2wii h LEU 1215CO -0.04 0.52 0.23 -0.07 -0.34 0.00 0.00 178.44 178.74 2wii h LEU 1216N 0.64 0.74 -0.26 2.25 3.38 -0.97 -0.51 115.31 120.58 2wii h LEU 1216Ca 0.17 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 2wii h LEU 1216Cb 0.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2wii h LEU 1216CO -0.03 0.66 -0.02 0.00 0.09 0.00 0.00 178.44 179.14 2wii h ALA 1217N 1.45 0.36 -0.68 1.53 0.00 -0.65 -1.33 119.26 119.94 2wii h ALA 1217Ca 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2wii h ALA 1217Cb 0.15 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.81 2wii h ALA 1217CO -0.02 0.12 0.43 -0.07 0.00 0.00 0.00 179.25 179.71 2wii h LEU 1218N 0.25 0.80 -1.15 0.00 3.38 -0.49 0.13 115.31 118.23 2wii h LEU 1218Ca 0.07 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2wii h LEU 1218Cb 0.47 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2wii h LEU 1218CO 0.02 0.61 0.15 -0.07 0.09 0.00 0.00 178.44 179.24 2wii h LEU 1219N 0.92 0.69 -0.83 1.67 3.38 -1.04 -0.68 115.31 119.43 2wii h LEU 1219Ca 0.25 -0.10 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 2wii h LEU 1219Cb -0.06 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2wii h LEU 1219CO -0.05 0.66 -0.15 -0.61 0.09 0.00 0.00 178.44 178.39 2wii h GLN 1220N 0.73 0.72 0.00 1.13 5.75 -0.35 -2.57 115.11 120.52 2wii h GLN 1220Ca 0.17 -0.25 0.00 0.00 -0.15 0.00 0.00 58.65 58.42 2wii h GLN 1220Cb 0.23 -0.06 0.00 0.00 1.07 0.00 0.00 27.48 28.72 2wii h GLN 1220CO -0.01 0.83 0.00 1.28 -2.65 0.00 0.00 178.83 178.28 2wii n LEU 1221N -4.15 0.62 -0.77 -2.39 4.77 0.39 -4.89 117.00 110.57 2wii n LEU 1221Ca 0.01 0.59 -0.10 0.00 -0.03 0.00 0.00 56.01 56.48 2wii n LEU 1221Cb 0.38 -0.44 -0.04 0.00 -2.33 0.00 0.00 43.42 40.99 2wii n LEU 1221CO 0.43 -0.29 -0.10 0.29 -1.33 0.00 0.00 177.39 176.39 2wii n LYS 1222N -2.12 -0.73 -2.49 3.23 4.76 -0.34 -4.93 118.16 115.53 2wii n LYS 1222Ca 0.04 0.85 -0.40 0.00 -2.87 0.00 0.00 58.31 55.93 2wii n LYS 1222Cb 0.34 -4.78 -0.02 0.00 -1.84 0.00 0.00 35.03 28.72 2wii n LYS 1222CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2wii s ASP 1223N -2.86 6.40 0.39 4.39 -1.08 -0.87 -4.79 116.67 118.25 2wii s ASP 1223Ca 0.00 -1.72 0.17 0.00 -0.52 0.00 0.00 52.55 50.48 2wii s ASP 1223Cb 0.00 -2.57 0.80 0.00 -1.46 0.00 0.00 42.92 39.69 2wii s ASP 1223CO 0.00 -1.61 1.81 -0.26 0.52 0.00 0.00 175.17 175.64 2wii h PHE 1224N 9.20 0.00 0.00 -5.34 0.04 -1.92 -3.01 116.94 115.91 2wii h PHE 1224Ca 0.27 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.95 2wii h PHE 1224Cb 0.96 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.10 2wii h PHE 1224CO 1.32 0.35 -0.44 -0.44 -0.60 0.00 0.00 178.31 178.50 2wii h ASP 1225N 0.00 0.00 0.51 2.17 3.32 -1.99 -3.23 116.42 117.19 2wii h ASP 1225Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 2wii h ASP 1225Cb 0.73 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 2wii h ASP 1225CO 0.05 0.44 -1.59 0.33 -1.72 0.00 0.00 179.24 176.75 2wii n PHE 1226N -3.80 0.62 0.05 4.55 -0.00 -1.15 -4.51 117.46 113.23 2wii n PHE 1226Ca -0.01 0.20 -0.13 0.00 -0.00 0.00 0.00 57.45 57.51 2wii n PHE 1226Cb 0.50 -0.91 -0.08 0.00 -0.00 0.00 0.00 39.48 38.98 2wii n PHE 1226CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2wii h VAL 1227N 0.00 1.06 -0.49 -2.13 2.07 -1.56 -3.29 116.25 111.91 2wii h VAL 1227Ca -0.14 -0.42 0.10 0.00 0.82 0.00 0.00 66.70 67.06 2wii h VAL 1227Cb 1.41 1.33 -0.10 0.00 -1.52 0.00 0.00 31.29 32.41 2wii h VAL 1227CO 0.02 0.10 -0.23 -0.65 0.02 0.00 0.00 177.57 176.84 2wii h PRO 1228N -0.27 -0.12 -0.87 1.57 0.11 -1.79 0.75 132.00 131.37 2wii h PRO 1228Ca -0.01 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.11 2wii h PRO 1228Cb 0.24 0.03 -0.04 0.00 0.11 0.00 0.00 31.00 31.33 2wii h PRO 1228CO 0.01 -0.08 0.53 -1.35 -0.21 0.00 0.00 178.00 176.90 2wii h PRO 1229N -0.12 1.18 -0.20 1.05 0.11 -1.86 -0.05 132.00 132.10 2wii h PRO 1229Ca 0.23 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 2wii h PRO 1229Cb 0.48 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 2wii h PRO 1229CO -0.56 0.82 0.05 0.28 -0.21 0.00 0.00 178.00 178.38 2wii h VAL 1230N 1.20 1.20 -0.79 3.15 2.07 -1.22 -2.01 116.25 119.86 2wii h VAL 1230Ca 0.31 -0.66 -0.04 0.00 0.82 0.00 0.00 66.70 67.13 2wii h VAL 1230Cb -0.06 1.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 2wii h VAL 1230CO -0.06 0.21 0.33 0.58 0.02 0.00 0.00 177.57 178.64 2wii h VAL 1231N 0.14 1.26 -0.58 2.57 2.07 -0.65 -2.38 116.25 118.68 2wii h VAL 1231Ca 0.06 -0.80 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2wii h VAL 1231Cb 0.27 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 2wii h VAL 1231CO 0.00 0.33 0.33 0.03 0.02 0.00 0.00 177.57 178.28 2wii h ARG 1232N 1.14 0.78 -0.31 1.57 3.08 -0.88 -2.17 114.38 117.59 2wii h ARG 1232Ca 0.26 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 60.17 2wii h ARG 1232Cb 0.20 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2wii h ARG 1232CO -0.02 0.56 -0.09 2.35 -1.07 0.00 0.00 179.97 181.70 2wii h TRP 1233N 0.79 0.69 -0.65 3.04 7.01 -0.88 -2.13 115.95 123.82 2wii h TRP 1233Ca 0.21 -0.15 0.00 0.00 2.11 0.00 0.00 58.89 61.06 2wii h TRP 1233Cb -0.01 -0.17 -0.03 0.00 -2.10 0.00 0.00 29.16 26.85 2wii h TRP 1233CO 0.00 0.80 0.43 -0.07 -2.79 0.00 0.00 178.44 176.81 2wii h LEU 1234N 0.38 0.75 -0.98 0.65 3.38 -1.15 -2.37 115.31 115.97 2wii h LEU 1234Ca 0.08 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.94 2wii h LEU 1234Cb 0.58 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2wii h LEU 1234CO 0.03 0.56 -0.08 0.78 0.09 0.00 0.00 178.44 179.81 2wii h ASN 1235N 0.88 0.63 1.20 -0.43 2.35 -1.35 -2.83 115.58 116.03 2wii h ASN 1235Ca 0.24 -0.16 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 2wii h ASN 1235Cb -0.09 -0.17 -0.00 0.00 0.05 0.00 0.00 38.32 38.11 2wii h ASN 1235CO -0.05 0.75 -0.10 -0.33 -1.65 0.00 0.00 177.43 176.06 2wii h GLU 1236N 0.60 0.00 0.00 0.81 5.08 -1.03 -2.62 114.58 117.43 2wii h GLU 1236Ca 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 2wii h GLU 1236Cb 0.50 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2wii h GLU 1236CO 0.03 0.10 0.00 1.96 -1.00 0.00 0.00 179.01 180.09 2wii h GLN 1237N 0.00 0.00 -6.23 2.33 1.08 -1.17 -3.46 115.11 107.66 2wii h GLN 1237Ca -0.00 0.00 -0.47 0.00 -1.45 0.00 0.00 58.65 56.73 2wii h GLN 1237Cb 0.72 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.14 2wii h GLN 1237CO 0.01 0.00 -0.75 0.54 -0.95 0.00 0.00 178.83 177.69 2wii n ARG 1238N -2.94 -5.86 -3.99 1.46 1.74 -0.99 -4.96 116.66 101.12 2wii n ARG 1238Ca -0.00 0.63 -0.35 0.00 -0.77 0.00 0.00 57.85 57.36 2wii n ARG 1238Cb 0.22 -5.55 -0.10 0.00 -1.02 0.00 0.00 32.46 26.01 2wii n ARG 1238CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2wii s TYR 1239N -3.30 3.20 -0.16 -1.55 5.04 -1.26 -4.99 117.35 114.33 2wii s TYR 1239Ca 0.66 -0.03 0.15 0.00 -2.44 0.00 0.00 57.07 55.41 2wii s TYR 1239Cb -0.33 -2.10 0.43 0.00 0.35 0.00 0.00 41.96 40.31 2wii s TYR 1239CO 0.81 0.05 1.20 0.66 -1.34 0.00 0.00 175.55 176.94 2wii n TYR 1240N 3.79 0.22 -0.56 4.97 4.01 -1.26 -5.04 117.16 123.28 2wii n TYR 1240Ca -0.16 -1.31 0.07 0.00 -0.16 0.00 0.00 57.90 56.34 2wii n TYR 1240Cb 0.52 -0.23 -0.02 0.00 -0.31 0.00 0.00 39.34 39.30 2wii n TYR 1240CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2wii n GLY 1241N -0.66 -1.85 0.00 2.72 0.00 -1.26 -4.90 105.19 99.25 2wii n GLY 1241Ca 0.17 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.82 2wii n GLY 1241CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wii n GLY 1242N -2.71 -0.11 0.00 -0.02 0.00 -1.26 -5.01 105.19 96.08 2wii n GLY 1242Ca -0.01 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.30 2wii n GLY 1242CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wii n GLY 1243N 0.03 -4.28 3.72 -0.02 0.00 -1.26 -4.72 105.19 98.66 2wii n GLY 1243Ca 0.00 -2.12 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 2wii n GLY 1243CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2wii s TYR 1244N -0.96 3.52 -1.23 1.61 5.04 -1.26 -3.66 117.35 120.41 2wii s TYR 1244Ca 0.00 1.45 -0.03 0.00 -2.44 0.00 0.00 57.07 56.05 2wii s TYR 1244Cb 0.00 -3.33 0.00 0.00 0.35 0.00 0.00 41.96 38.98 2wii s TYR 1244CO 0.00 -0.89 1.04 0.41 -1.34 0.00 0.00 175.55 174.77 2wii n GLY 1245N 2.80 -0.40 0.00 8.97 0.00 -1.26 -4.92 105.19 110.37 2wii n GLY 1245Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.22 2wii n GLY 1245CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wii n SER 1246N -3.05 1.55 -0.01 1.61 3.41 -1.24 -4.80 113.62 111.08 2wii n SER 1246Ca -0.20 -1.59 -0.09 0.00 -0.26 0.00 0.00 58.87 56.73 2wii n SER 1246Cb 0.64 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.56 2wii n SER 1246CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2wii h THR 1247N 0.10 0.65 -0.23 6.66 2.02 -1.85 0.17 112.91 120.43 2wii h THR 1247Ca 0.00 0.00 -0.14 0.00 0.77 0.00 0.00 66.41 67.04 2wii h THR 1247Cb 0.33 0.65 -0.00 0.00 -1.74 0.00 0.00 68.15 67.40 2wii h THR 1247CO 0.00 0.00 -0.40 1.56 0.37 0.00 0.00 175.52 177.05 2wii h GLN 1248N -0.13 0.68 -0.46 6.66 1.08 -1.87 -2.15 115.11 118.92 2wii h GLN 1248Ca 0.10 -0.42 -0.03 0.00 -1.45 0.00 0.00 58.65 56.85 2wii h GLN 1248Cb 0.27 0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.73 2wii h GLN 1248CO -0.23 1.04 0.19 0.00 -0.95 0.00 0.00 178.83 178.88 2wii h ALA 1249N 0.63 0.60 -0.44 3.87 0.00 -1.79 -0.63 119.26 121.51 2wii h ALA 1249Ca 0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.74 2wii h ALA 1249Cb 0.99 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2wii h ALA 1249CO 0.09 0.20 0.12 1.15 0.00 0.00 0.00 179.25 180.81 2wii h THR 1250N 0.60 1.23 -0.27 0.00 2.02 -0.70 -0.98 112.91 114.82 2wii h THR 1250Ca 0.15 -0.78 -0.16 0.00 0.77 0.00 0.00 66.41 66.39 2wii h THR 1250Cb 0.19 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2wii h THR 1250CO -0.01 0.28 -0.48 0.15 0.37 0.00 0.00 175.52 175.82 2wii h PHE 1251N 0.57 0.89 0.19 3.16 3.04 -1.27 -3.20 116.94 120.32 2wii h PHE 1251Ca 0.14 -0.29 -0.26 0.00 3.98 0.00 0.00 57.97 61.53 2wii h PHE 1251Cb 0.30 -0.18 0.03 0.00 2.56 0.00 0.00 35.95 38.66 2wii h PHE 1251CO 0.02 1.06 -1.18 0.52 -2.02 0.00 0.00 178.31 176.70 2wii h MET 1252N 0.57 0.40 -0.85 1.11 2.86 -1.07 -2.99 114.93 114.97 2wii h MET 1252Ca 0.03 -0.69 -0.02 0.00 -2.06 0.00 0.00 59.70 56.95 2wii h MET 1252Cb 1.04 0.26 -0.04 0.00 0.06 0.00 0.00 31.60 32.92 2wii h MET 1252CO 0.10 1.33 0.44 -0.24 1.06 0.00 0.00 176.91 179.60 2wii h VAL 1253N -0.13 1.25 0.00 -2.22 3.04 -1.28 -0.77 116.25 116.15 2wii h VAL 1253Ca -0.21 -0.67 -0.14 0.00 -1.01 0.00 0.00 66.70 64.67 2wii h VAL 1253Cb 1.90 0.13 -0.02 0.00 -2.01 0.00 0.00 31.29 31.29 2wii h VAL 1253CO 0.20 0.29 -0.74 -0.26 -1.01 0.00 0.00 177.57 176.05 2wii h PHE 1254N 1.20 0.00 -0.21 3.17 0.04 -1.69 -2.32 116.94 117.13 2wii h PHE 1254Ca 0.30 0.00 -0.18 0.00 2.80 0.00 0.00 57.97 60.88 2wii h PHE 1254Cb 0.07 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.22 2wii h PHE 1254CO 0.01 0.65 -0.60 0.37 -0.60 0.00 0.00 178.31 178.14 2wii h GLN 1255N 0.00 0.69 -0.17 1.51 4.15 -1.32 -1.23 115.11 118.73 2wii h GLN 1255Ca -0.03 -0.47 -0.07 0.00 0.77 0.00 0.00 58.65 58.86 2wii h GLN 1255Cb 1.52 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 29.27 2wii h GLN 1255CO 0.08 1.09 -0.17 0.00 -1.93 0.00 0.00 178.83 177.90 2wii h ALA 1256N 0.81 0.25 -0.37 3.38 0.00 -1.16 -1.89 119.26 120.28 2wii h ALA 1256Ca -0.00 -0.34 -0.08 0.00 0.00 0.00 0.00 54.91 54.49 2wii h ALA 1256Cb 1.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2wii h ALA 1256CO 0.12 0.16 -0.10 -0.07 0.00 0.00 0.00 179.25 179.36 2wii h LEU 1257N 0.07 0.62 -0.59 0.00 3.38 -1.46 -1.20 115.31 116.14 2wii h LEU 1257Ca 0.03 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.73 2wii h LEU 1257Cb 0.71 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 2wii h LEU 1257CO 0.04 0.75 -0.03 0.00 0.09 0.00 0.00 178.44 179.29 2wii h ALA 1258N 1.31 0.80 -0.54 1.53 0.00 -1.19 -2.41 119.26 118.76 2wii h ALA 1258Ca 0.11 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.58 2wii h ALA 1258Cb 0.52 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2wii h ALA 1258CO 0.03 0.67 -0.11 0.37 0.00 0.00 0.00 179.25 180.22 2wii h GLN 1259N 0.97 1.03 -0.86 0.00 5.75 -1.05 -1.99 115.11 118.95 2wii h GLN 1259Ca 0.16 -0.38 0.04 0.00 -0.15 0.00 0.00 58.65 58.33 2wii h GLN 1259Cb 0.60 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 29.03 2wii h GLN 1259CO 0.04 1.07 0.55 -0.92 -2.65 0.00 0.00 178.83 176.91 2wii h TYR 1260N 0.91 1.02 -0.11 3.99 3.20 -1.04 0.62 116.97 125.57 2wii h TYR 1260Ca 0.14 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.92 2wii h TYR 1260Cb 0.67 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2wii h TYR 1260CO 0.05 0.57 -0.46 1.96 -1.64 0.00 0.00 178.16 178.64 2wii h GLN 1261N 1.04 0.26 -0.26 1.82 1.08 -1.27 -1.94 115.11 115.85 2wii h GLN 1261Ca 0.35 -0.13 -0.20 0.00 -1.45 0.00 0.00 58.65 57.22 2wii h GLN 1261Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2wii h GLN 1261CO -0.13 0.67 -0.60 -0.22 -0.95 0.00 0.00 178.83 177.59 2wii h LYS 1262N 0.21 0.86 -0.00 1.46 3.64 -0.51 -3.19 116.57 119.05 2wii h LYS 1262Ca 0.01 -0.58 -0.17 0.00 -1.27 0.00 0.00 60.65 58.64 2wii h LYS 1262Cb 0.89 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 2wii h LYS 1262CO 0.07 1.21 -0.78 -0.44 -2.27 0.00 0.00 179.45 177.24 2wii h ASP 1263N 0.64 0.02 -1.94 4.20 3.32 -0.89 -3.46 116.42 118.31 2wii h ASP 1263Ca -0.00 -0.02 -0.64 0.00 0.02 0.00 0.00 57.03 56.39 2wii h ASP 1263Cb 1.22 -0.01 0.04 0.00 0.22 0.00 0.00 39.33 40.80 2wii h ASP 1263CO 0.13 0.80 0.85 0.00 -1.72 0.00 0.00 179.24 179.30 2wii n ALA 1264N -2.40 0.46 -1.77 3.45 0.00 -0.73 -4.93 120.51 114.58 2wii n ALA 1264Ca -0.01 0.40 -0.37 0.00 0.00 0.00 0.00 53.44 53.45 2wii n ALA 1264Cb 0.75 -2.32 -0.02 0.00 0.00 0.00 0.00 19.45 17.86 2wii n ALA 1264CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2wii s PRO 1265N 2.36 3.95 0.21 0.00 0.02 -1.26 -4.96 135.00 135.33 2wii s PRO 1265Ca 0.88 1.73 -0.09 0.00 0.02 0.00 0.00 61.00 63.54 2wii s PRO 1265Cb -0.81 -2.53 0.25 0.00 0.02 0.00 0.00 34.50 31.43 2wii s PRO 1265CO 0.49 -0.38 1.79 0.22 -0.33 0.00 0.00 177.00 178.80 2wii h ASP 1266N 2.35 0.47 -5.09 2.53 3.58 -1.98 -3.44 116.42 114.84 2wii h ASP 1266Ca -0.49 0.04 -0.03 0.00 0.42 0.00 0.00 57.03 56.97 2wii h ASP 1266Cb 1.24 -0.05 -0.11 0.00 1.72 0.00 0.00 39.33 42.13 2wii h ASP 1266CO 0.61 0.30 0.00 -1.38 -2.88 0.00 0.00 179.24 175.89 2wii s HIS 1267N -6.09 -0.15 0.23 0.28 -3.43 -1.26 -4.13 115.29 100.74 2wii s HIS 1267Ca -0.13 -0.18 -0.30 0.00 -0.80 0.00 0.00 55.06 53.65 2wii s HIS 1267Cb 0.16 0.35 -0.10 0.00 -1.43 0.00 0.00 32.58 31.57 2wii s HIS 1267CO 0.75 -0.85 1.40 -0.65 -2.00 0.00 0.00 174.74 173.40 2wii s GLN 1268N -3.85 4.30 0.21 -0.38 -0.21 -1.01 -4.82 119.66 113.90 2wii s GLN 1268Ca 0.07 2.22 -0.32 0.00 0.02 0.00 0.00 55.36 57.36 2wii s GLN 1268Cb -0.00 -3.14 -0.13 0.00 1.00 0.00 0.00 33.01 30.74 2wii s GLN 1268CO -0.06 -0.37 1.61 -1.91 -2.12 0.00 0.00 175.29 172.44 2wii n GLU 1269N 2.50 2.47 -3.77 2.91 2.13 -1.26 -4.73 120.64 120.88 2wii n GLU 1269Ca 0.07 0.89 -0.30 0.00 0.66 0.00 0.00 57.16 58.47 2wii n GLU 1269Cb 0.41 -2.67 -0.15 0.00 0.27 0.00 0.00 31.44 29.30 2wii n GLU 1269CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2wii s LEU 1270N 0.63 2.66 -0.41 4.31 2.96 -1.26 -3.12 118.68 124.46 2wii s LEU 1270Ca 0.73 -1.80 0.07 0.00 -0.22 0.00 0.00 54.13 52.90 2wii s LEU 1270Cb -0.58 -1.00 0.22 0.00 0.50 0.00 0.00 46.19 45.34 2wii s LEU 1270CO 0.39 -0.40 0.52 -3.20 -1.32 0.00 0.00 176.35 172.35 2wii n ASN 1271N 4.64 -0.52 -4.85 3.68 2.85 0.26 -2.38 115.26 118.95 2wii n ASN 1271Ca -0.00 -2.68 -0.33 0.00 -0.11 0.00 0.00 54.58 51.46 2wii n ASN 1271Cb 0.41 -0.24 -0.06 0.00 1.24 0.00 0.00 39.78 41.14 2wii n ASN 1271CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2wii s LEU 1272N -0.68 4.20 -0.50 1.20 1.43 -0.63 -3.42 118.68 120.28 2wii s LEU 1272Ca 0.34 1.13 0.04 0.00 -1.03 0.00 0.00 54.13 54.61 2wii s LEU 1272Cb 0.13 -3.69 0.13 0.00 0.03 0.00 0.00 46.19 42.79 2wii s LEU 1272CO -0.15 -0.06 0.24 -0.62 0.23 0.00 0.00 176.35 176.00 2wii s ASP 1273N -2.09 4.30 -0.19 2.29 2.15 0.37 -1.72 116.67 121.78 2wii s ASP 1273Ca 0.46 -2.90 -0.09 0.00 0.43 0.00 0.00 52.55 50.46 2wii s ASP 1273Cb -0.13 -1.59 -0.05 0.00 -0.30 0.00 0.00 42.92 40.86 2wii s ASP 1273CO 0.20 -0.25 0.11 -0.69 -0.17 0.00 0.00 175.17 174.37 2wii s VAL 1274N -0.12 5.26 -0.02 1.11 1.01 -0.93 -2.13 120.40 124.58 2wii s VAL 1274Ca 0.16 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.31 2wii s VAL 1274Cb -0.25 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.74 2wii s VAL 1274CO -0.01 0.46 -0.12 -0.94 0.00 0.00 0.00 175.10 174.49 2wii s SER 1275N 0.23 1.45 -0.13 3.32 1.04 0.50 0.55 113.70 120.66 2wii s SER 1275Ca 0.07 -0.23 -0.06 0.00 0.48 0.00 0.00 55.95 56.22 2wii s SER 1275Cb -0.11 -0.22 -0.04 0.00 0.10 0.00 0.00 66.02 65.74 2wii s SER 1275CO -0.01 0.14 0.08 -0.76 0.98 0.00 0.00 173.24 173.66 2wii s LEU 1276N -0.17 3.98 -0.53 2.42 1.43 0.65 -1.58 118.68 124.87 2wii s LEU 1276Ca 0.03 0.26 0.02 0.00 -1.03 0.00 0.00 54.13 53.40 2wii s LEU 1276Cb -0.06 -1.96 0.14 0.00 0.03 0.00 0.00 46.19 44.33 2wii s LEU 1276CO -0.00 0.33 0.29 -1.58 0.23 0.00 0.00 176.35 175.62 2wii s GLN 1277N -0.57 2.11 -0.16 1.70 2.00 0.12 -2.19 119.66 122.68 2wii s GLN 1277Ca 0.11 -2.51 -0.20 0.00 -2.00 0.00 0.00 55.36 50.77 2wii s GLN 1277Cb -0.12 -3.44 -0.03 0.00 0.80 0.00 0.00 33.01 30.21 2wii s GLN 1277CO 0.02 -1.11 0.57 -0.51 -0.50 0.00 0.00 175.29 173.76 2wii s LEU 1278N -0.08 4.20 0.61 3.68 1.43 -1.26 -2.53 118.68 124.73 2wii s LEU 1278Ca 0.16 0.83 0.34 0.00 -1.03 0.00 0.00 54.13 54.43 2wii s LEU 1278Cb -0.23 -2.81 1.84 0.00 0.03 0.00 0.00 46.19 45.02 2wii s LEU 1278CO -0.02 -0.16 2.03 -0.65 0.23 0.00 0.00 176.35 177.79 2wii h PRO 1279N 7.19 0.00 -0.40 1.29 0.11 -1.93 -0.30 132.00 137.96 2wii h PRO 1279Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2wii h PRO 1279Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2wii h PRO 1279CO 0.76 0.00 0.00 -1.13 -0.21 0.00 0.00 178.00 177.42 2wii n SER 1280N -2.83 3.64 -4.67 -2.05 3.41 -1.26 -4.96 113.62 104.89 2wii n SER 1280Ca -0.02 -2.38 -0.33 0.00 -0.26 0.00 0.00 58.87 55.88 2wii n SER 1280Cb 0.21 -0.41 -0.09 0.00 -0.26 0.00 0.00 64.21 63.67 2wii n SER 1280CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2wii s ARG 1281N -1.70 2.80 0.07 4.33 1.81 -0.12 -5.04 118.95 121.10 2wii s ARG 1281Ca 0.36 -0.58 -0.24 0.00 -1.72 0.00 0.00 55.73 53.54 2wii s ARG 1281Cb 0.23 -2.68 -0.16 0.00 -0.45 0.00 0.00 34.95 31.89 2wii s ARG 1281CO 0.16 0.64 1.63 0.66 -0.68 0.00 0.00 175.30 177.71 2wii h SER 1282N 4.50 -0.04 -4.40 0.23 4.64 -1.93 -3.46 113.55 113.09 2wii h SER 1282Ca -0.49 -0.10 -0.28 0.00 -0.47 0.00 0.00 61.79 60.45 2wii h SER 1282Cb 1.18 0.01 -0.15 0.00 -0.31 0.00 0.00 62.40 63.13 2wii h SER 1282CO 0.57 0.07 -0.68 -0.94 -0.87 0.00 0.00 176.83 174.97 2wii s SER 1283N -5.25 1.34 0.46 4.97 1.04 -1.26 -5.14 113.70 109.86 2wii s SER 1283Ca -0.14 -1.10 -0.24 0.00 0.48 0.00 0.00 55.95 54.95 2wii s SER 1283Cb 0.05 0.08 -0.07 0.00 0.10 0.00 0.00 66.02 66.18 2wii s SER 1283CO 0.66 -0.49 1.29 -1.59 0.98 0.00 0.00 173.24 174.09 2wii s LYS 1284N -3.86 3.69 -0.35 4.02 -2.85 -1.26 -4.91 119.74 114.23 2wii s LYS 1284Ca 0.19 2.10 -0.11 0.00 -1.00 0.00 0.00 55.97 57.15 2wii s LYS 1284Cb 0.05 -2.54 0.01 0.00 -2.06 0.00 0.00 37.83 33.29 2wii s LYS 1284CO 0.01 -0.70 0.19 0.42 0.10 0.00 0.00 175.35 175.37 2wii s ILE 1285N -1.34 4.69 -0.01 3.79 1.01 -0.93 -4.95 121.20 123.46 2wii s ILE 1285Ca 0.62 -0.61 -0.01 0.00 0.00 0.00 0.00 60.65 60.65 2wii s ILE 1285Cb -0.37 -3.51 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2wii s ILE 1285CO 0.45 -0.09 0.11 0.28 0.00 0.00 0.00 174.94 175.69 2wii s THR 1286N 1.60 4.91 -0.10 2.92 -1.32 -1.26 -0.25 115.64 122.13 2wii s THR 1286Ca 0.04 -0.34 0.00 0.00 -1.21 0.00 0.00 61.69 60.18 2wii s THR 1286Cb -0.18 -3.26 0.02 0.00 -1.51 0.00 0.00 72.50 67.57 2wii s THR 1286CO 0.07 0.35 -0.09 -1.00 -2.21 0.00 0.00 174.62 171.74 2wii s HIS 1287N -1.23 1.52 -0.64 9.09 3.76 0.19 -4.97 115.29 123.01 2wii s HIS 1287Ca 0.24 -0.73 -0.20 0.00 -0.15 0.00 0.00 55.06 54.22 2wii s HIS 1287Cb -0.12 -1.22 0.10 0.00 1.11 0.00 0.00 32.58 32.45 2wii s HIS 1287CO 0.15 -0.47 0.82 1.03 -0.85 0.00 0.00 174.74 175.42 2wii s ARG 1288N 1.46 3.11 -0.33 1.40 1.81 -1.26 -2.19 118.95 122.94 2wii s ARG 1288Ca 0.01 -1.22 -0.21 0.00 -1.72 0.00 0.00 55.73 52.59 2wii s ARG 1288Cb -0.13 -4.30 -0.00 0.00 -0.45 0.00 0.00 34.95 30.06 2wii s ARG 1288CO -0.06 -1.64 0.66 0.42 -0.68 0.00 0.00 175.30 174.00 2wii s ILE 1289N 3.07 4.89 0.34 1.52 1.01 -0.70 -5.00 121.20 126.33 2wii s ILE 1289Ca 0.16 0.76 0.09 0.00 0.00 0.00 0.00 60.65 61.66 2wii s ILE 1289Cb -0.20 -4.06 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 2wii s ILE 1289CO 0.06 -0.25 0.01 -1.00 0.00 0.00 0.00 174.94 173.76 2wii s HIS 1290N 2.72 2.54 0.19 3.97 3.76 -1.26 -1.60 115.29 125.61 2wii s HIS 1290Ca 0.26 -0.45 -0.12 0.00 -0.15 0.00 0.00 55.06 54.60 2wii s HIS 1290Cb -0.14 -1.51 0.18 0.00 1.11 0.00 0.00 32.58 32.22 2wii s HIS 1290CO 0.14 0.47 1.77 2.35 -0.85 0.00 0.00 174.74 178.61 2wii h TRP 1291N 1.80 0.41 0.00 1.40 2.91 -1.88 -0.74 115.95 119.85 2wii h TRP 1291Ca -0.43 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 59.60 2wii h TRP 1291Cb 1.25 -0.11 -0.00 0.00 -0.51 0.00 0.00 29.16 29.79 2wii h TRP 1291CO 0.70 0.17 -0.08 1.05 -1.03 0.00 0.00 178.44 179.25 2wii h GLU 1292N 0.44 0.00 -0.10 2.65 9.09 -1.97 -2.68 114.58 122.01 2wii h GLU 1292Ca 0.25 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.57 2wii h GLU 1292Cb 0.22 0.00 -0.10 0.00 -1.65 0.00 0.00 28.75 27.22 2wii h GLU 1292CO -0.21 0.08 -0.60 -1.13 0.05 0.00 0.00 179.01 177.19 2wii n SER 1293N -3.46 2.06 -0.07 3.06 3.41 -0.79 -4.82 113.62 113.02 2wii n SER 1293Ca -0.02 -3.69 -0.10 0.00 -0.26 0.00 0.00 58.87 54.81 2wii n SER 1293Cb 0.22 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 63.65 2wii n SER 1293CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wii h ALA 1294N 1.18 0.32 0.00 7.33 0.00 -0.80 -2.83 119.26 124.45 2wii h ALA 1294Ca 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2wii h ALA 1294Cb 1.16 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2wii h ALA 1294CO 0.11 -0.14 0.00 0.66 0.00 0.00 0.00 179.25 179.88 2wii h SER 1295N 0.27 0.00 -2.07 0.00 4.64 -1.84 0.27 113.55 114.82 2wii h SER 1295Ca 0.09 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.79 2wii h SER 1295Cb 0.09 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.23 2wii h SER 1295CO -0.01 0.00 0.84 -0.11 -0.87 0.00 0.00 176.83 176.68 2wii n LEU 1296N -3.05 2.93 -4.50 5.97 7.94 -1.07 -4.84 117.00 120.38 2wii n LEU 1296Ca 0.00 1.06 -0.43 0.00 -1.11 0.00 0.00 56.01 55.53 2wii n LEU 1296Cb 0.29 -1.36 -0.05 0.00 0.53 0.00 0.00 43.42 42.84 2wii n LEU 1296CO 0.26 -0.34 0.62 -0.22 -1.11 0.00 0.00 177.39 176.60 2wii s LEU 1297N 1.92 4.35 -0.16 -1.96 1.98 -1.26 -4.50 118.68 119.05 2wii s LEU 1297Ca 0.85 -0.50 -0.14 0.00 -2.89 0.00 0.00 54.13 51.45 2wii s LEU 1297Cb -0.75 -2.73 -0.05 0.00 0.66 0.00 0.00 46.19 43.33 2wii s LEU 1297CO 0.45 -1.12 0.31 -0.13 -1.89 0.00 0.00 176.35 173.97 2wii s ARG 1298N 3.54 4.26 0.07 1.98 0.52 -0.32 -4.95 118.95 124.06 2wii s ARG 1298Ca 0.26 0.12 0.07 0.00 -0.52 0.00 0.00 55.73 55.66 2wii s ARG 1298Cb -0.14 -3.43 -0.03 0.00 0.52 0.00 0.00 34.95 31.86 2wii s ARG 1298CO 0.17 0.22 -0.20 0.45 0.02 0.00 0.00 175.30 175.96 2wii s SER 1299N 0.52 2.36 -0.04 0.23 0.15 -1.26 -0.35 113.70 115.31 2wii s SER 1299Ca 0.17 -0.59 0.01 0.00 0.70 0.00 0.00 55.95 56.24 2wii s SER 1299Cb -0.13 -0.16 0.02 0.00 -1.71 0.00 0.00 66.02 64.05 2wii s SER 1299CO 0.04 0.09 -0.04 -1.61 1.20 0.00 0.00 173.24 172.92 2wii s GLU 1300N -1.52 0.79 -0.06 5.44 0.41 -0.78 -4.94 118.70 118.04 2wii s GLU 1300Ca 0.06 -0.10 0.03 0.00 -0.41 0.00 0.00 54.97 54.55 2wii s GLU 1300Cb -0.09 -0.80 -0.03 0.00 -1.78 0.00 0.00 34.13 31.43 2wii s GLU 1300CO 0.03 -0.08 -0.14 -1.21 -0.49 0.00 0.00 175.26 173.38 2wii s GLU 1301N 0.89 2.57 -0.02 1.61 8.01 -1.26 -0.31 118.70 130.19 2wii s GLU 1301Ca -0.12 -0.68 0.00 0.00 0.01 0.00 0.00 54.97 54.19 2wii s GLU 1301Cb -0.14 -2.41 0.02 0.00 -4.31 0.00 0.00 34.13 27.28 2wii s GLU 1301CO 0.00 0.61 0.00 -0.08 0.01 0.00 0.00 175.26 175.80 2wii s THR 1302N -0.69 0.10 0.22 3.63 -1.32 -0.73 -4.97 115.64 111.87 2wii s THR 1302Ca 0.10 0.06 -0.01 0.00 -1.21 0.00 0.00 61.69 60.64 2wii s THR 1302Cb -0.11 -0.17 -0.02 0.00 -1.51 0.00 0.00 72.50 70.69 2wii s THR 1302CO 0.01 0.09 1.57 0.11 -2.21 0.00 0.00 174.62 174.19 2wii h LYS 1303N 6.86 0.52 -6.78 7.08 1.79 -1.89 -0.77 116.57 123.38 2wii h LYS 1303Ca -0.38 -0.29 -0.49 0.00 -2.18 0.00 0.00 60.65 57.31 2wii h LYS 1303Cb 1.15 0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.81 2wii h LYS 1303CO 0.49 0.88 0.39 -1.21 -1.08 0.00 0.00 179.45 178.92 2wii s GLU 1304N -4.12 4.76 -1.20 3.15 0.41 -1.26 -4.38 118.70 116.05 2wii s GLU 1304Ca -0.07 1.57 -0.10 0.00 -0.41 0.00 0.00 54.97 55.97 2wii s GLU 1304Cb 0.12 -3.20 0.21 0.00 -1.78 0.00 0.00 34.13 29.48 2wii s GLU 1304CO 0.83 0.39 1.56 -1.71 -0.49 0.00 0.00 175.26 175.84 2wii n ASN 1305N 1.29 5.43 -4.03 -0.19 5.15 -1.26 -4.77 115.26 116.89 2wii n ASN 1305Ca -0.01 -3.11 -0.19 0.00 -0.60 0.00 0.00 54.58 50.66 2wii n ASN 1305Cb 0.47 -1.46 -0.15 0.00 -0.53 0.00 0.00 39.78 38.11 2wii n ASN 1305CO 0.00 0.00 0.00 -0.70 1.40 0.00 0.00 177.26 177.96 2wii s GLU 1306N -0.04 0.80 0.69 1.20 2.12 -1.26 -4.78 118.70 117.43 2wii s GLU 1306Ca 0.38 -0.34 -0.17 0.00 0.36 0.00 0.00 54.97 55.21 2wii s GLU 1306Cb 0.02 -0.77 0.01 0.00 0.26 0.00 0.00 34.13 33.65 2wii s GLU 1306CO 0.01 0.19 1.13 0.41 -0.54 0.00 0.00 175.26 176.47 2wii n GLY 1307N 2.90 0.04 3.37 -1.50 0.00 -1.26 -4.73 105.19 104.00 2wii n GLY 1307Ca -0.14 -0.27 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 2wii n GLY 1307CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wii s PHE 1308N -1.66 0.61 -0.05 1.61 -0.12 -0.91 -4.47 117.98 112.98 2wii s PHE 1308Ca 0.77 -0.93 0.05 0.00 -0.05 0.00 0.00 56.93 56.77 2wii s PHE 1308Cb -0.36 -0.13 -0.02 0.00 -0.63 0.00 0.00 43.02 41.88 2wii s PHE 1308CO 0.46 -0.77 -0.19 0.99 -0.05 0.00 0.00 175.22 175.66 2wii s THR 1309N -4.04 2.65 -0.19 -4.49 2.01 -1.05 -0.73 115.64 109.80 2wii s THR 1309Ca 0.25 -0.87 0.01 0.00 0.31 0.00 0.00 61.69 61.38 2wii s THR 1309Cb 0.03 -2.00 0.02 0.00 0.01 0.00 0.00 72.50 70.56 2wii s THR 1309CO 0.06 0.58 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.70 2wii s VAL 1310N -0.56 2.11 -0.14 3.82 1.01 0.36 -0.70 120.40 126.30 2wii s VAL 1310Ca 0.08 -1.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 2wii s VAL 1310Cb -0.11 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 2wii s VAL 1310CO 0.01 0.46 -0.12 -0.89 0.00 0.00 0.00 175.10 174.56 2wii s THR 1311N 1.27 3.06 0.02 3.92 2.01 -0.61 -0.35 115.64 124.95 2wii s THR 1311Ca 0.03 -0.65 0.04 0.00 0.31 0.00 0.00 61.69 61.42 2wii s THR 1311Cb -0.14 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.06 2wii s THR 1311CO -0.12 0.51 -0.12 0.00 -0.69 0.00 0.00 174.62 174.21 2wii s ALA 1312N 0.50 0.98 -0.06 7.40 0.00 -0.26 -0.37 121.76 129.96 2wii s ALA 1312Ca -0.08 -0.64 -0.22 0.00 0.00 0.00 0.00 51.96 51.02 2wii s ALA 1312Cb -0.16 -0.18 0.05 0.00 0.00 0.00 0.00 23.12 22.83 2wii s ALA 1312CO 0.04 0.20 0.49 -1.83 0.00 0.00 0.00 175.76 174.66 2wii s GLU 1313N -0.74 0.81 0.00 0.00 -1.05 -0.91 -0.50 118.70 116.32 2wii s GLU 1313Ca 0.02 0.13 0.00 0.00 -0.15 0.00 0.00 54.97 54.97 2wii s GLU 1313Cb -0.06 0.38 0.00 0.00 -0.44 0.00 0.00 34.13 34.00 2wii s GLU 1313CO 0.00 -0.22 0.00 0.41 0.95 0.00 0.00 175.26 176.40 2wii n GLY 1314N 1.38 0.62 3.93 -3.83 0.00 -1.26 -0.48 105.19 105.54 2wii n GLY 1314Ca -0.19 -2.26 -0.27 0.00 0.00 0.00 0.00 46.02 43.30 2wii n GLY 1314CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2wii s LYS 1315N -0.66 3.54 0.00 1.61 1.02 -1.22 -3.97 119.74 120.07 2wii s LYS 1315Ca 0.00 -0.25 0.00 0.00 0.02 0.00 0.00 55.97 55.74 2wii s LYS 1315Cb 0.00 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.57 2wii s LYS 1315CO 0.00 0.29 0.00 0.41 -0.92 0.00 0.00 175.35 175.13 2wii n GLY 1316N -1.04 0.97 3.37 -3.33 0.00 -1.18 -0.57 105.19 103.41 2wii n GLY 1316Ca -0.04 -2.10 -0.25 0.00 0.00 0.00 0.00 46.02 43.63 2wii n GLY 1316CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wii s GLN 1317N -1.44 1.36 0.34 1.61 -0.21 -1.26 -4.56 119.66 115.49 2wii s GLN 1317Ca 0.00 -1.41 -0.02 0.00 0.02 0.00 0.00 55.36 53.95 2wii s GLN 1317Cb 0.00 -1.62 0.00 0.00 1.00 0.00 0.00 33.01 32.39 2wii s GLN 1317CO 0.00 0.35 0.46 0.20 -2.12 0.00 0.00 175.29 174.18 2wii s GLY 1318N -2.47 1.49 -0.02 3.09 0.00 0.55 -0.21 107.32 109.75 2wii s GLY 1318Ca 0.16 -1.52 0.04 0.00 0.00 0.00 0.00 44.72 43.40 2wii s GLY 1318CO 0.07 -1.01 -0.13 -0.51 0.00 0.00 0.00 173.10 171.52 2wii s THR 1319N -3.13 1.04 -0.17 0.90 -4.23 0.57 -1.08 115.64 109.55 2wii s THR 1319Ca 0.31 -0.55 0.01 0.00 -1.18 0.00 0.00 61.69 60.28 2wii s THR 1319Cb -0.00 -0.88 0.03 0.00 1.34 0.00 0.00 72.50 72.98 2wii s THR 1319CO 0.20 0.30 -0.13 -0.22 -0.54 0.00 0.00 174.62 174.23 2wii s LEU 1320N -0.17 1.93 -0.06 4.79 2.96 0.30 -2.37 118.68 126.06 2wii s LEU 1320Ca 0.02 -0.64 0.03 0.00 -0.22 0.00 0.00 54.13 53.32 2wii s LEU 1320Cb -0.07 -1.22 0.01 0.00 0.50 0.00 0.00 46.19 45.41 2wii s LEU 1320CO 0.00 -0.08 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.36 2wii s SER 1321N 1.44 1.97 -0.22 3.68 0.01 -0.59 -0.37 113.70 119.62 2wii s SER 1321Ca 0.03 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 56.96 2wii s SER 1321Cb -0.14 -0.85 0.03 0.00 0.21 0.00 0.00 66.02 65.27 2wii s SER 1321CO -0.10 0.07 -0.14 -0.69 0.41 0.00 0.00 173.24 172.79 2wii s VAL 1322N 0.51 2.37 -0.02 3.43 1.01 -0.09 -0.30 120.40 127.31 2wii s VAL 1322Ca -0.13 -1.07 0.06 0.00 0.00 0.00 0.00 61.98 60.84 2wii s VAL 1322Cb -0.15 -2.14 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 2wii s VAL 1322CO 0.04 0.34 -0.19 -0.69 0.00 0.00 0.00 175.10 174.59 2wii s VAL 1323N 1.27 1.56 -0.21 2.92 1.01 -0.70 0.22 120.40 126.47 2wii s VAL 1323Ca 0.01 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 2wii s VAL 1323Cb -0.15 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.93 2wii s VAL 1323CO -0.09 0.44 -0.12 -0.89 0.00 0.00 0.00 175.10 174.45 2wii s THR 1324N -0.33 2.69 -0.14 3.92 2.01 -0.10 0.17 115.64 123.86 2wii s THR 1324Ca 0.04 -0.77 -0.17 0.00 0.31 0.00 0.00 61.69 61.10 2wii s THR 1324Cb -0.09 -2.21 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 2wii s THR 1324CO 0.00 0.45 0.41 -0.04 -0.69 0.00 0.00 174.62 174.75 2wii s MET 1325N 1.37 4.31 0.24 4.92 -1.94 -0.16 -0.80 119.30 127.24 2wii s MET 1325Ca 0.05 0.32 -0.19 0.00 -1.71 0.00 0.00 55.69 54.16 2wii s MET 1325Cb -0.14 -3.43 0.02 0.00 2.01 0.00 0.00 34.83 33.29 2wii s MET 1325CO -0.08 0.18 0.61 1.52 -0.01 0.00 0.00 175.02 177.24 2wii s TYR 1326N 0.59 -0.08 -0.37 -0.03 -0.85 -0.57 -1.62 117.35 114.42 2wii s TYR 1326Ca 0.22 -0.32 -0.15 0.00 -0.52 0.00 0.00 57.07 56.31 2wii s TYR 1326Cb -0.14 0.51 -0.00 0.00 0.38 0.00 0.00 41.96 42.71 2wii s TYR 1326CO 0.08 -1.08 0.32 -1.01 -1.52 0.00 0.00 175.55 172.33 2wii s HIS 1327N -3.92 3.22 -0.14 -3.49 3.76 -1.26 -0.94 115.29 112.52 2wii s HIS 1327Ca 0.12 -0.28 -0.11 0.00 -0.15 0.00 0.00 55.06 54.64 2wii s HIS 1327Cb -0.03 -2.62 -0.05 0.00 1.11 0.00 0.00 32.58 30.99 2wii s HIS 1327CO 0.04 -0.49 0.23 0.00 -0.85 0.00 0.00 174.74 173.67 2wii s ALA 1328N 1.86 3.70 0.01 -1.40 0.00 -0.93 -0.39 121.76 124.62 2wii s ALA 1328Ca 0.08 -0.52 -0.35 0.00 0.00 0.00 0.00 51.96 51.17 2wii s ALA 1328Cb -0.18 -2.23 -0.14 0.00 0.00 0.00 0.00 23.12 20.58 2wii s ALA 1328CO 0.11 0.30 1.68 1.63 0.00 0.00 0.00 175.76 179.48 2wii n LYS 1329N 2.91 1.94 -3.13 0.00 5.02 -0.08 -2.02 118.16 122.79 2wii n LYS 1329Ca -0.15 0.71 -0.42 0.00 -2.02 0.00 0.00 58.31 56.42 2wii n LYS 1329Cb 0.53 -2.48 -0.07 0.00 -0.02 0.00 0.00 35.03 32.99 2wii n LYS 1329CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wii s ALA 1330N 2.31 3.42 0.30 7.82 0.00 -1.26 -4.93 121.76 129.42 2wii s ALA 1330Ca 0.87 -1.00 0.01 0.00 0.00 0.00 0.00 51.96 51.84 2wii s ALA 1330Cb -0.76 -3.19 0.47 0.00 0.00 0.00 0.00 23.12 19.64 2wii s ALA 1330CO 0.47 -1.46 1.81 1.57 0.00 0.00 0.00 175.76 178.15 2wii h LYS 1331N 8.60 0.65 -7.15 0.00 2.10 -2.01 -3.44 116.57 115.31 2wii h LYS 1331Ca -0.26 -0.16 -0.45 0.00 -2.00 0.00 0.00 60.65 57.78 2wii h LYS 1331Cb 1.11 -0.08 0.07 0.00 -0.90 0.00 0.00 32.23 32.43 2wii h LYS 1331CO 0.84 0.67 0.14 -0.51 -2.00 0.00 0.00 179.45 178.60 2wii s ASP 1332N -6.69 4.85 -0.11 7.07 1.01 -1.26 -4.93 116.67 116.60 2wii s ASP 1332Ca -0.08 0.21 -0.29 0.00 0.71 0.00 0.00 52.55 53.09 2wii s ASP 1332Cb 0.15 -0.88 -0.01 0.00 1.01 0.00 0.00 42.92 43.19 2wii s ASP 1332CO 0.79 -1.52 1.00 -1.10 0.21 0.00 0.00 175.17 174.55 2wii s GLN 1333N -5.10 4.41 0.15 8.23 -1.52 -1.26 -4.93 119.66 119.63 2wii s GLN 1333Ca 0.60 1.38 0.02 0.00 -1.95 0.00 0.00 55.36 55.41 2wii s GLN 1333Cb -0.10 -3.55 -0.07 0.00 -0.22 0.00 0.00 33.01 29.08 2wii s GLN 1333CO 0.43 -0.32 1.33 -0.07 -0.25 0.00 0.00 175.29 176.41 2wii h LEU 1334N 8.06 0.23-10.19 2.90 4.07 -1.96 -3.44 115.31 114.98 2wii h LEU 1334Ca -0.31 -0.20 -0.49 0.00 0.08 0.00 0.00 57.88 56.96 2wii h LEU 1334Cb 1.14 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.82 2wii h LEU 1334CO 0.86 1.05 -0.17 0.42 -1.08 0.00 0.00 178.44 179.52 2wii s THR 1335N -3.06 5.08 -1.30 0.22 -4.23 -1.26 -4.49 115.64 106.59 2wii s THR 1335Ca -0.02 -0.26 -0.01 0.00 -1.18 0.00 0.00 61.69 60.22 2wii s THR 1335Cb 0.10 -3.82 -0.00 0.00 1.34 0.00 0.00 72.50 70.12 2wii s THR 1335CO 0.83 -0.48 0.69 0.00 -0.54 0.00 0.00 174.62 175.12 2wii h ASN 1337N -1.85 0.00 0.00 0.00 -1.24 -1.82 -3.39 115.58 107.28 2wii h ASN 1337Ca -0.61 0.00 -0.22 0.00 0.71 0.00 0.00 56.30 56.17 2wii h ASN 1337Cb 1.36 0.00 -0.04 0.00 0.73 0.00 0.00 38.32 40.37 2wii h ASN 1337CO 0.56 0.42 -1.84 0.29 -1.29 0.00 0.00 177.43 175.57 2wii n LYS 1338N -3.02 1.73 -5.15 6.67 4.76 -1.26 -4.87 118.16 117.02 2wii n LYS 1338Ca -0.02 0.01 -0.30 0.00 -2.87 0.00 0.00 58.31 55.13 2wii n LYS 1338Cb 0.73 -1.31 -0.16 0.00 -1.84 0.00 0.00 35.03 32.45 2wii n LYS 1338CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 2wii s PHE 1339N -2.30 2.20 -0.22 2.13 0.40 -1.26 -0.54 117.98 118.40 2wii s PHE 1339Ca -0.09 -0.61 -0.13 0.00 -0.60 0.00 0.00 56.93 55.50 2wii s PHE 1339Cb 0.04 -1.45 -0.04 0.00 0.51 0.00 0.00 43.02 42.08 2wii s PHE 1339CO 0.47 -0.17 0.29 -0.51 0.70 0.00 0.00 175.22 176.01 2wii s ASP 1340N -0.19 6.29 -0.08 1.36 1.01 -0.17 -4.71 116.67 120.18 2wii s ASP 1340Ca -0.01 0.33 0.02 0.00 0.71 0.00 0.00 52.55 53.60 2wii s ASP 1340Cb -0.12 -2.18 0.02 0.00 1.01 0.00 0.00 42.92 41.65 2wii s ASP 1340CO 0.02 -0.02 -0.11 -0.22 0.21 0.00 0.00 175.17 175.05 2wii s LEU 1341N 1.21 1.56 -0.21 1.23 0.20 -1.26 -1.49 118.68 119.91 2wii s LEU 1341Ca 0.14 -0.31 0.00 0.00 0.69 0.00 0.00 54.13 54.66 2wii s LEU 1341Cb -0.14 -0.84 0.05 0.00 -0.43 0.00 0.00 46.19 44.83 2wii s LEU 1341CO 0.06 0.00 -0.06 -0.54 -0.29 0.00 0.00 176.35 175.52 2wii s LYS 1342N 0.89 1.65 -0.18 1.98 1.02 0.52 -4.96 119.74 120.66 2wii s LYS 1342Ca -0.10 -0.85 -0.05 0.00 0.02 0.00 0.00 55.97 54.99 2wii s LYS 1342Cb -0.15 -2.43 -0.03 0.00 -0.52 0.00 0.00 37.83 34.71 2wii s LYS 1342CO 0.01 -0.53 -0.01 0.08 -0.92 0.00 0.00 175.35 173.98 2wii s VAL 1343N 1.46 3.96 -0.02 3.17 1.01 -1.26 -0.36 120.40 128.36 2wii s VAL 1343Ca -0.03 -0.32 0.06 0.00 0.00 0.00 0.00 61.98 61.69 2wii s VAL 1343Cb -0.18 -2.77 -0.01 0.00 0.00 0.00 0.00 36.38 33.42 2wii s VAL 1343CO -0.07 0.46 -0.20 0.28 0.00 0.00 0.00 175.10 175.57 2wii s THR 1344N 0.70 1.60 -0.10 3.92 -1.32 -0.76 -4.93 115.64 114.75 2wii s THR 1344Ca -0.01 -0.86 0.01 0.00 -1.21 0.00 0.00 61.69 59.63 2wii s THR 1344Cb -0.14 -1.33 0.02 0.00 -1.51 0.00 0.00 72.50 69.53 2wii s THR 1344CO 0.02 0.45 -0.13 -0.51 -2.21 0.00 0.00 174.62 172.24 2wii s ILE 1345N -0.41 1.34 0.01 5.08 1.10 -1.26 -1.97 121.20 125.09 2wii s ILE 1345Ca 0.06 -0.54 0.01 0.00 -0.51 0.00 0.00 60.65 59.67 2wii s ILE 1345Cb -0.08 -1.25 -0.01 0.00 0.15 0.00 0.00 42.46 41.27 2wii s ILE 1345CO -0.00 0.41 -0.04 -0.54 -2.11 0.00 0.00 174.94 172.66 2wii s LYS 1346N 1.08 0.32 0.31 3.50 1.02 -1.03 -4.87 119.74 120.07 2wii s LYS 1346Ca -0.05 -0.37 -0.29 0.00 0.02 0.00 0.00 55.97 55.28 2wii s LYS 1346Cb -0.15 -0.17 -0.13 0.00 -0.52 0.00 0.00 37.83 36.87 2wii s LYS 1346CO -0.02 0.04 1.29 -2.30 -0.92 0.00 0.00 175.35 173.44 2wii n PRO 1347N 2.34 2.03 -2.94 -1.68 -0.02 -1.26 -0.52 135.00 132.94 2wii n PRO 1347Ca -0.17 0.71 -0.38 0.00 -2.02 0.00 0.00 63.50 61.64 2wii n PRO 1347Cb 0.57 -2.30 -0.06 0.00 -0.02 0.00 0.00 33.50 31.69 2wii n PRO 1347CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wii s ALA 1348N -0.82 3.38 0.00 3.55 0.00 -0.50 -4.70 121.76 122.68 2wii s ALA 1348Ca 0.59 0.38 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2wii s ALA 1348Cb -0.60 -3.00 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2wii s ALA 1348CO 0.59 0.27 0.04 -2.30 0.00 0.00 0.00 175.76 174.35 2wii n PRO 1349N 1.14 0.03 0.00 0.00 -0.02 -1.26 -4.91 135.00 129.98 2wii n PRO 1349Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.45 2wii n PRO 1349Cb 0.49 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 2wii n PRO 1349CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2wii n LYS 1359N 1.51 0.00 -3.56 -0.52 5.02 -1.23 -5.13 118.16 114.25 2wii n LYS 1359Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 2wii n LYS 1359Cb 0.01 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.99 2wii n LYS 1359CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 2wii s ASN 1360N 0.00 -0.27 0.00 4.39 3.84 -1.26 -4.96 114.94 116.68 2wii s ASN 1360Ca 0.00 0.10 0.01 0.00 0.21 0.00 0.00 52.86 53.18 2wii s ASN 1360Cb 0.00 0.26 -0.01 0.00 -0.55 0.00 0.00 41.25 40.96 2wii s ASN 1360CO 0.00 -0.39 -0.02 -0.89 -2.79 0.00 0.00 177.10 173.01 2wii s THR 1361N -2.27 0.17 0.10 -5.21 2.01 -1.26 -0.65 115.64 108.53 2wii s THR 1361Ca 0.05 -0.25 -0.04 0.00 0.31 0.00 0.00 61.69 61.77 2wii s THR 1361Cb -0.01 -0.18 -0.03 0.00 0.01 0.00 0.00 72.50 72.29 2wii s THR 1361CO -0.05 -0.05 0.08 -0.04 -0.69 0.00 0.00 174.62 173.87 2wii s MET 1362N -0.32 0.82 -0.23 4.92 -1.94 -0.56 -1.40 119.30 120.58 2wii s MET 1362Ca -0.02 -1.22 -0.06 0.00 -1.71 0.00 0.00 55.69 52.68 2wii s MET 1362Cb -0.02 0.27 -0.02 0.00 2.01 0.00 0.00 34.83 37.06 2wii s MET 1362CO -0.00 -0.22 0.03 0.42 -0.01 0.00 0.00 175.02 175.23 2wii s ILE 1363N -3.95 3.98 -0.37 2.53 1.01 0.32 -0.68 121.20 124.04 2wii s ILE 1363Ca 0.13 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.37 2wii s ILE 1363Cb 0.07 -2.84 0.01 0.00 0.01 0.00 0.00 42.46 39.71 2wii s ILE 1363CO -0.06 0.38 0.23 -0.22 0.00 0.00 0.00 174.94 175.27 2wii s LEU 1364N 1.49 4.68 -0.18 2.97 2.96 -0.75 -2.48 118.68 127.38 2wii s LEU 1364Ca 0.06 -0.78 -0.01 0.00 -0.22 0.00 0.00 54.13 53.17 2wii s LEU 1364Cb -0.15 -2.08 -0.00 0.00 0.50 0.00 0.00 46.19 44.46 2wii s LEU 1364CO 0.01 -0.34 -0.12 -0.70 -1.32 0.00 0.00 176.35 173.88 2wii s GLU 1365N 1.63 3.27 -0.15 1.98 2.12 -0.83 -2.11 118.70 124.60 2wii s GLU 1365Ca 0.04 -0.71 -0.02 0.00 0.36 0.00 0.00 54.97 54.64 2wii s GLU 1365Cb -0.18 -2.75 -0.02 0.00 0.26 0.00 0.00 34.13 31.44 2wii s GLU 1365CO 0.08 -0.05 -0.09 0.42 -0.54 0.00 0.00 175.26 175.08 2wii s ILE 1366N 1.02 3.32 -0.08 -3.70 1.01 0.16 -1.83 121.20 121.10 2wii s ILE 1366Ca -0.01 -0.55 0.02 0.00 0.00 0.00 0.00 60.65 60.11 2wii s ILE 1366Cb -0.15 -2.43 -0.02 0.00 0.01 0.00 0.00 42.46 39.87 2wii s ILE 1366CO -0.02 0.50 -0.15 0.00 0.00 0.00 0.00 174.94 175.26 2wii s THR 1368N -0.21 0.04 -0.06 0.00 -1.32 -1.07 -0.36 115.64 112.66 2wii s THR 1368Ca 0.00 -0.36 -0.06 0.00 -1.21 0.00 0.00 61.69 60.07 2wii s THR 1368Cb -0.13 -0.26 0.02 0.00 -1.51 0.00 0.00 72.50 70.61 2wii s THR 1368CO 0.03 -0.20 0.17 -0.60 -2.21 0.00 0.00 174.62 171.82 2wii s ARG 1369N -0.63 0.20 -0.11 7.08 3.52 -0.56 -0.46 118.95 128.00 2wii s ARG 1369Ca -0.07 0.24 -0.20 0.00 -0.13 0.00 0.00 55.73 55.57 2wii s ARG 1369Cb -0.04 0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.40 2wii s ARG 1369CO 0.00 -0.03 0.56 -0.47 -0.81 0.00 0.00 175.30 174.56 2wii s TYR 1370N 0.11 3.52 -0.95 5.12 5.04 -0.59 -1.00 117.35 128.61 2wii s TYR 1370Ca -0.00 1.01 -0.17 0.00 -2.44 0.00 0.00 57.07 55.46 2wii s TYR 1370Cb -0.01 -2.66 0.16 0.00 0.35 0.00 0.00 41.96 39.80 2wii s TYR 1370CO 0.00 0.11 1.10 1.03 -1.34 0.00 0.00 175.55 176.44 2wii s ARG 1371N 0.81 3.68 0.19 4.97 0.52 0.30 -4.28 118.95 125.13 2wii s ARG 1371Ca 0.30 -2.04 -0.23 0.00 -0.52 0.00 0.00 55.73 53.24 2wii s ARG 1371Cb -0.16 -4.83 0.06 0.00 0.52 0.00 0.00 34.95 30.54 2wii s ARG 1371CO 0.13 -1.66 0.95 0.20 0.02 0.00 0.00 175.30 174.94 2wii s GLY 1372N 3.18 -0.08 0.21 -3.53 0.00 -1.26 -4.84 107.32 101.01 2wii s GLY 1372Ca 0.31 -0.10 -0.02 0.00 0.00 0.00 0.00 44.72 44.91 2wii s GLY 1372CO -0.08 0.60 1.57 -0.55 0.00 0.00 0.00 173.10 174.63 2wii h ASP 1373N 2.00 0.61 -1.81 1.64 3.32 -1.97 -3.45 116.42 116.76 2wii h ASP 1373Ca -0.25 -0.29 -0.61 0.00 0.02 0.00 0.00 57.03 55.90 2wii h ASP 1373Cb 1.23 -0.17 -0.12 0.00 0.22 0.00 0.00 39.33 40.48 2wii h ASP 1373CO 0.29 0.97 -0.63 -1.10 -1.72 0.00 0.00 179.24 177.05 2wii s GLN 1374N -4.19 1.95 0.68 3.56 -1.52 -1.26 -5.07 119.66 113.81 2wii s GLN 1374Ca -0.07 -1.95 -0.16 0.00 -1.95 0.00 0.00 55.36 51.22 2wii s GLN 1374Cb 0.12 -1.75 0.01 0.00 -0.22 0.00 0.00 33.01 31.18 2wii s GLN 1374CO 0.83 0.05 1.16 -0.51 -0.25 0.00 0.00 175.29 176.58 2wii s ASP 1375N -3.69 4.73 0.41 5.90 1.11 -1.26 -4.75 116.67 119.11 2wii s ASP 1375Ca 0.34 2.21 -0.17 0.00 0.18 0.00 0.00 52.55 55.12 2wii s ASP 1375Cb 0.05 -2.57 -0.09 0.00 1.07 0.00 0.00 42.92 41.37 2wii s ASP 1375CO 0.18 -1.90 0.86 0.00 1.18 0.00 0.00 175.17 175.49 2wii s ALA 1376N -2.07 3.18 1.00 5.23 0.00 -1.01 -4.97 121.76 123.12 2wii s ALA 1376Ca 0.72 0.16 0.00 0.00 0.00 0.00 0.00 51.96 52.83 2wii s ALA 1376Cb -0.26 -2.95 0.00 0.00 0.00 0.00 0.00 23.12 19.91 2wii s ALA 1376CO 0.42 0.11 0.00 0.25 0.00 0.00 0.00 175.76 176.54 2wii n THR 1377N -0.81 0.00 -1.70 0.00 -2.24 -1.26 -3.14 114.28 105.13 2wii n THR 1377Ca 0.05 0.00 -0.59 0.00 -2.27 0.00 0.00 64.05 61.24 2wii n THR 1377Cb 0.54 -1.91 -0.08 0.00 -2.10 0.00 0.00 70.33 66.78 2wii n THR 1377CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 2wii n MET 1378N -0.91 0.86 -4.38 -0.78 2.81 -0.94 -4.39 117.12 109.38 2wii n MET 1378Ca 0.00 0.31 -0.24 0.00 -1.81 0.00 0.00 57.70 55.96 2wii n MET 1378Cb 0.00 -1.95 -0.09 0.00 -0.71 0.00 0.00 33.22 30.48 2wii n MET 1378CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 2wii s SER 1379N 3.03 4.04 -0.07 7.83 0.01 -0.09 -1.93 113.70 126.52 2wii s SER 1379Ca 0.98 -0.83 0.03 0.00 1.31 0.00 0.00 55.95 57.44 2wii s SER 1379Cb -1.16 -0.56 -0.02 0.00 0.21 0.00 0.00 66.02 64.48 2wii s SER 1379CO 0.67 0.03 -0.14 -0.63 0.41 0.00 0.00 173.24 173.59 2wii s ILE 1380N -2.35 3.10 -0.74 1.44 1.09 -0.20 -1.16 121.20 122.39 2wii s ILE 1380Ca 0.30 -0.70 -0.02 0.00 -1.10 0.00 0.00 60.65 59.13 2wii s ILE 1380Cb -0.06 -2.23 0.19 0.00 -1.06 0.00 0.00 42.46 39.30 2wii s ILE 1380CO 0.17 0.58 0.59 -0.76 -0.10 0.00 0.00 174.94 175.41 2wii s LEU 1381N -0.54 5.38 -0.64 2.97 1.43 -0.08 -3.10 118.68 124.10 2wii s LEU 1381Ca 0.07 -3.25 -0.27 0.00 -1.03 0.00 0.00 54.13 49.65 2wii s LEU 1381Cb -0.12 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.25 2wii s LEU 1381CO 0.01 -0.29 1.36 -0.62 0.23 0.00 0.00 176.35 177.05 2wii s ASP 1382N 0.28 6.13 -0.10 2.29 -1.08 -0.47 -2.19 116.67 121.54 2wii s ASP 1382Ca 0.22 -0.03 -0.00 0.00 -0.52 0.00 0.00 52.55 52.21 2wii s ASP 1382Cb -0.14 -2.55 -0.03 0.00 -1.46 0.00 0.00 42.92 38.74 2wii s ASP 1382CO -0.08 -1.77 -0.09 -0.63 0.52 0.00 0.00 175.17 173.12 2wii s ILE 1383N 5.98 3.51 -0.14 4.11 1.01 0.25 -1.08 121.20 134.84 2wii s ILE 1383Ca 0.45 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.60 2wii s ILE 1383Cb -0.09 -2.46 0.01 0.00 0.01 0.00 0.00 42.46 39.93 2wii s ILE 1383CO 0.21 0.56 -0.22 -0.94 0.00 0.00 0.00 174.94 174.55 2wii s SER 1384N -0.27 3.17 0.60 3.58 1.04 -0.13 -0.51 113.70 121.18 2wii s SER 1384Ca 0.03 -0.58 -0.16 0.00 0.48 0.00 0.00 55.95 55.72 2wii s SER 1384Cb -0.13 -1.45 -0.03 0.00 0.10 0.00 0.00 66.02 64.51 2wii s SER 1384CO 0.03 0.09 1.08 -0.04 0.98 0.00 0.00 173.24 175.38 2wii s MET 1385N 0.74 3.19 0.44 4.02 -1.94 0.53 -2.69 119.30 123.59 2wii s MET 1385Ca -0.09 1.33 -0.24 0.00 -1.71 0.00 0.00 55.69 54.99 2wii s MET 1385Cb -0.16 -2.01 -0.08 0.00 2.01 0.00 0.00 34.83 34.60 2wii s MET 1385CO -0.00 -0.93 1.16 -1.64 -0.01 0.00 0.00 175.02 173.60 2wii s MET 1386N -3.92 3.85 -0.24 2.03 -1.94 -1.26 -4.70 119.30 113.12 2wii s MET 1386Ca 0.66 1.78 -0.37 0.00 -1.71 0.00 0.00 55.69 56.05 2wii s MET 1386Cb -0.18 -2.48 -0.13 0.00 2.01 0.00 0.00 34.83 34.04 2wii s MET 1386CO 0.36 -0.48 1.91 0.25 -0.01 0.00 0.00 175.02 177.06 2wii n THR 1387N -0.33 0.37 -0.30 2.05 -2.24 -1.23 -0.39 114.28 112.21 2wii n THR 1387Ca 0.06 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 2wii n THR 1387Cb 0.48 -1.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.14 2wii n THR 1387CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2wii n GLY 1388N 4.91 0.85 3.38 3.38 0.00 -1.26 -4.81 105.19 111.64 2wii n GLY 1388Ca 0.29 -0.01 -0.25 0.00 0.00 0.00 0.00 46.02 46.06 2wii n GLY 1388CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2wii s PHE 1389N -2.00 2.09 -0.13 1.61 0.08 0.47 -1.04 117.98 119.07 2wii s PHE 1389Ca 0.00 -0.40 -0.16 0.00 0.12 0.00 0.00 56.93 56.48 2wii s PHE 1389Cb 0.00 -1.04 0.04 0.00 -0.57 0.00 0.00 43.02 41.45 2wii s PHE 1389CO 0.00 0.42 0.44 0.00 -0.10 0.00 0.00 175.22 175.98 2wii s ALA 1390N -1.78 -1.09 0.91 5.36 0.00 -0.67 -4.61 121.76 119.88 2wii s ALA 1390Ca 0.18 1.08 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 2wii s ALA 1390Cb -0.07 -0.52 0.14 0.00 0.00 0.00 0.00 23.12 22.67 2wii s ALA 1390CO 0.08 -0.23 1.12 -2.14 0.00 0.00 0.00 175.76 174.59 2wii s PRO 1391N -0.18 1.07 -0.09 0.00 0.02 -1.26 -0.84 135.00 133.72 2wii s PRO 1391Ca -0.03 1.36 -0.21 0.00 0.02 0.00 0.00 61.00 62.14 2wii s PRO 1391Cb -0.03 -1.75 -0.04 0.00 0.02 0.00 0.00 34.50 32.70 2wii s PRO 1391CO 0.02 -2.53 0.59 0.34 -0.33 0.00 0.00 177.00 175.08 2wii s ASP 1392N -2.84 6.84 0.26 2.53 2.15 -0.64 -4.75 116.67 120.21 2wii s ASP 1392Ca 0.66 1.00 -0.04 0.00 0.43 0.00 0.00 52.55 54.60 2wii s ASP 1392Cb -0.22 -2.35 0.32 0.00 -0.30 0.00 0.00 42.92 40.38 2wii s ASP 1392CO 0.58 -0.05 1.92 0.71 -0.17 0.00 0.00 175.17 178.16 2wii h THR 1393N 4.72 1.20 -0.29 1.71 1.35 -1.94 -2.36 112.91 117.30 2wii h THR 1393Ca -0.41 -0.44 -0.03 0.00 -0.55 0.00 0.00 66.41 64.98 2wii h THR 1393Cb 1.19 -0.20 -0.01 0.00 -1.73 0.00 0.00 68.15 67.40 2wii h THR 1393CO 0.75 0.23 0.08 0.44 -0.25 0.00 0.00 175.52 176.77 2wii h ASP 1394N 1.29 0.43 -0.34 5.36 3.32 -2.00 -2.53 116.42 121.96 2wii h ASP 1394Ca 0.39 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 2wii h ASP 1394Cb -0.05 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 2wii h ASP 1394CO -0.11 0.54 -0.05 0.44 -1.72 0.00 0.00 179.24 178.35 2wii h ASP 1395N 0.30 0.71 -0.68 6.45 3.32 -1.91 -2.96 116.42 121.64 2wii h ASP 1395Ca 0.09 -0.18 -0.06 0.00 0.02 0.00 0.00 57.03 56.90 2wii h ASP 1395Cb 0.28 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.61 2wii h ASP 1395CO -0.00 0.81 0.18 -0.07 -1.72 0.00 0.00 179.24 178.44 2wii h LEU 1396N 0.68 1.02 -1.17 1.55 3.38 -1.30 -2.41 115.31 117.06 2wii h LEU 1396Ca 0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 2wii h LEU 1396Cb 0.49 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2wii h LEU 1396CO 0.03 0.98 0.40 0.11 0.09 0.00 0.00 178.44 180.05 2wii h LYS 1397N 1.02 0.97 -0.10 1.13 1.57 -1.29 0.15 116.57 120.02 2wii h LYS 1397Ca 0.22 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 58.77 2wii h LYS 1397Cb 0.34 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 2wii h LYS 1397CO -0.00 0.70 -0.52 0.37 -0.57 0.00 0.00 179.45 179.43 2wii h GLN 1398N 0.98 0.27 -0.01 3.15 -0.00 -1.36 -2.64 115.11 115.51 2wii h GLN 1398Ca 0.25 -0.16 -0.21 0.00 -0.00 0.00 0.00 58.65 58.54 2wii h GLN 1398Cb -0.00 0.01 -0.00 0.00 0.00 0.00 0.00 27.48 27.49 2wii h GLN 1398CO -0.04 0.73 -0.87 -0.07 0.00 0.00 0.00 178.83 178.57 2wii h LEU 1399N 0.21 0.41 -1.49 -2.39 3.38 -0.92 -3.22 115.31 111.30 2wii h LEU 1399Ca 0.01 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 2wii h LEU 1399Cb 0.99 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 2wii h LEU 1399CO 0.08 1.10 -0.00 0.00 0.09 0.00 0.00 178.44 179.71 2wii h ALA 1400N 0.87 1.59 -1.94 1.53 0.00 -0.46 -3.41 119.26 117.44 2wii h ALA 1400Ca -0.06 -0.14 -0.58 0.00 0.00 0.00 0.00 54.91 54.13 2wii h ALA 1400Cb 1.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2wii h ALA 1400CO 0.14 0.31 1.40 -0.80 0.00 0.00 0.00 179.25 180.30 2wii s ASN 1401N -6.84 5.64 0.00 0.00 0.01 -1.02 -4.58 114.94 108.15 2wii s ASN 1401Ca -0.06 1.66 0.00 0.00 -0.71 0.00 0.00 52.86 53.75 2wii s ASN 1401Cb 0.16 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.30 2wii s ASN 1401CO 0.73 -1.85 0.00 0.61 -1.51 0.00 0.00 177.10 175.08 2wii n GLY 1402N 5.61 1.48 2.14 0.66 0.00 -1.26 -4.71 105.19 109.11 2wii n GLY 1402Ca 0.27 0.28 -0.03 0.00 0.00 0.00 0.00 46.02 46.54 2wii n GLY 1402CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2wii n VAL 1403N 0.00 -0.09 -2.17 1.61 3.14 -1.26 -0.04 118.33 119.53 2wii n VAL 1403Ca 0.00 0.00 -0.19 0.00 -2.96 0.00 0.00 64.34 61.19 2wii n VAL 1403Cb 0.00 -0.34 -0.03 0.00 -1.06 0.00 0.00 33.84 32.41 2wii n VAL 1403CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 2wii n ASP 1404N -0.95 -5.39 -3.95 6.55 9.92 -1.26 -4.96 116.55 116.51 2wii n ASP 1404Ca -0.03 0.15 -0.28 0.00 -0.53 0.00 0.00 54.79 54.10 2wii n ASP 1404Cb 0.41 -4.58 -0.17 0.00 -0.64 0.00 0.00 41.12 36.14 2wii n ASP 1404CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2wii s ARG 1405N -4.64 1.80 -0.13 -1.24 1.81 0.95 -1.20 118.95 116.30 2wii s ARG 1405Ca 0.00 -0.36 -0.00 0.00 -1.72 0.00 0.00 55.73 53.64 2wii s ARG 1405Cb 0.00 -1.77 -0.02 0.00 -0.45 0.00 0.00 34.95 32.71 2wii s ARG 1405CO 0.00 -0.26 -0.12 -0.47 -0.68 0.00 0.00 175.30 173.77 2wii s TYR 1406N 1.63 2.83 -0.20 -0.53 5.04 0.14 -4.39 117.35 121.87 2wii s TYR 1406Ca 0.05 -0.62 0.00 0.00 -2.44 0.00 0.00 57.07 54.06 2wii s TYR 1406Cb -0.13 -1.86 0.05 0.00 0.35 0.00 0.00 41.96 40.37 2wii s TYR 1406CO -0.09 -0.20 -0.08 0.42 -1.34 0.00 0.00 175.55 174.26 2wii s ILE 1407N 0.36 1.44 0.43 3.14 1.01 -1.26 -1.34 121.20 124.98 2wii s ILE 1407Ca -0.10 -0.93 -0.24 0.00 0.00 0.00 0.00 60.65 59.38 2wii s ILE 1407Cb -0.16 -1.59 -0.10 0.00 0.01 0.00 0.00 42.46 40.62 2wii s ILE 1407CO 0.05 0.10 1.09 -1.54 0.00 0.00 0.00 174.94 174.64 2wii n SER 1408N 4.74 1.64 -0.29 3.58 3.41 -1.26 -4.83 113.62 120.61 2wii n SER 1408Ca -0.13 1.04 0.10 0.00 -0.26 0.00 0.00 58.87 59.62 2wii n SER 1408Cb 0.46 -1.40 0.33 0.00 -0.26 0.00 0.00 64.21 63.35 2wii n SER 1408CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2wii h LYS 1409N 1.64 0.77 -0.98 4.33 3.64 -1.99 -0.85 116.57 123.13 2wii h LYS 1409Ca -0.46 -0.05 0.20 0.00 -1.27 0.00 0.00 60.65 59.07 2wii h LYS 1409Cb 1.33 -0.17 -0.09 0.00 -0.41 0.00 0.00 32.23 32.88 2wii h LYS 1409CO 0.57 0.51 0.61 -0.92 -2.27 0.00 0.00 179.45 177.96 2wii h TYR 1410N 0.79 0.87 -0.23 1.91 3.20 -2.01 0.27 116.97 121.78 2wii h TYR 1410Ca 0.45 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 62.15 2wii h TYR 1410Cb 0.60 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.61 2wii h TYR 1410CO -0.00 0.20 -0.64 0.93 -1.64 0.00 0.00 178.16 177.01 2wii h GLU 1411N 0.63 0.82 -0.17 1.82 4.39 -1.50 -3.24 114.58 117.33 2wii h GLU 1411Ca 0.54 -0.58 -0.08 0.00 0.34 0.00 0.00 59.36 59.59 2wii h GLU 1411Cb 1.02 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.75 2wii h GLU 1411CO -0.30 1.20 -0.23 -0.07 -1.16 0.00 0.00 179.01 178.45 2wii h LEU 1412N 0.60 0.30 -0.33 1.33 3.38 -0.83 -3.23 115.31 116.54 2wii h LEU 1412Ca -0.01 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.77 2wii h LEU 1412Cb 1.25 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 2wii h LEU 1412CO 0.14 0.54 -0.19 0.44 0.09 0.00 0.00 178.44 179.45 2wii h ASP 1413N 0.28 0.73 -1.53 -0.43 5.19 -1.22 -3.45 116.42 115.98 2wii h ASP 1413Ca 0.05 -0.42 -0.71 0.00 -0.62 0.00 0.00 57.03 55.32 2wii h ASP 1413Cb 0.56 -0.20 0.05 0.00 0.18 0.00 0.00 39.33 39.91 2wii h ASP 1413CO 0.04 1.00 0.47 0.29 -3.12 0.00 0.00 179.24 177.92 2wii n LYS 1414N -4.32 0.94 -0.82 3.56 5.02 -1.22 -4.92 118.16 116.40 2wii n LYS 1414Ca -0.03 0.34 -0.28 0.00 -2.02 0.00 0.00 58.31 56.32 2wii n LYS 1414Cb 0.41 -1.96 0.23 0.00 -0.02 0.00 0.00 35.03 33.69 2wii n LYS 1414CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2wii s ALA 1415N 0.98 0.05 0.63 7.82 0.00 -1.26 -4.86 121.76 125.13 2wii s ALA 1415Ca 0.88 -0.34 0.35 0.00 0.00 0.00 0.00 51.96 52.86 2wii s ALA 1415Cb -1.04 -3.15 1.91 0.00 0.00 0.00 0.00 23.12 20.84 2wii s ALA 1415CO 0.52 -3.53 2.07 0.27 0.00 0.00 0.00 175.76 175.10 2wii h PHE 1416N -2.41 0.00 -3.55 0.00 -5.15 -1.93 -3.41 116.94 100.49 2wii h PHE 1416Ca -0.58 0.00 -0.52 0.00 -0.20 0.00 0.00 57.97 56.67 2wii h PHE 1416Cb 1.34 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 37.48 2wii h PHE 1416CO -0.03 0.00 0.17 0.45 -2.00 0.00 0.00 178.31 176.90 2wii s SER 1417N -4.67 7.31 -1.42 -0.68 0.15 -1.26 -4.16 113.70 108.97 2wii s SER 1417Ca -0.04 1.60 -0.06 0.00 0.70 0.00 0.00 55.95 58.15 2wii s SER 1417Cb 0.10 -2.48 0.04 0.00 -1.71 0.00 0.00 66.02 61.97 2wii s SER 1417CO 0.32 0.16 0.81 0.47 1.20 0.00 0.00 173.24 176.19 2wii n ASP 1418N 1.34 -2.75 -3.49 5.45 8.00 -1.26 -4.94 116.55 118.90 2wii n ASP 1418Ca -0.05 -0.82 -0.27 0.00 0.71 0.00 0.00 54.79 54.37 2wii n ASP 1418Cb 0.49 -3.89 -0.09 0.00 -0.02 0.00 0.00 41.12 37.62 2wii n ASP 1418CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2wii n ARG 1419N -4.47 2.14 -0.09 -1.24 0.63 -1.26 -4.85 116.66 107.52 2wii n ARG 1419Ca -0.14 -4.45 0.12 0.00 -0.92 0.00 0.00 57.85 52.46 2wii n ARG 1419Cb 0.61 -2.14 0.19 0.00 0.45 0.00 0.00 32.46 31.57 2wii n ARG 1419CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 2wii n ASN 1420N 1.18 3.07 -3.98 6.15 0.23 -1.26 -4.52 115.26 116.12 2wii n ASN 1420Ca 0.27 -1.96 -0.20 0.00 -0.53 0.00 0.00 54.58 52.16 2wii n ASN 1420Cb 0.41 -0.12 -0.16 0.00 -2.08 0.00 0.00 39.78 37.84 2wii n ASN 1420CO 0.00 0.00 0.00 0.42 -0.93 0.00 0.00 177.26 176.75 2wii s THR 1421N -1.76 0.74 -0.01 5.53 -4.23 -1.26 -0.35 115.64 114.30 2wii s THR 1421Ca 0.34 -0.32 -0.01 0.00 -1.18 0.00 0.00 61.69 60.52 2wii s THR 1421Cb 0.21 -0.67 0.00 0.00 1.34 0.00 0.00 72.50 73.38 2wii s THR 1421CO 0.31 0.24 0.02 -0.22 -0.54 0.00 0.00 174.62 174.43 2wii s LEU 1422N 0.33 1.94 -0.13 4.79 2.96 0.33 -5.00 118.68 123.90 2wii s LEU 1422Ca -0.05 -0.01 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2wii s LEU 1422Cb -0.10 0.09 0.01 0.00 0.50 0.00 0.00 46.19 46.70 2wii s LEU 1422CO 0.01 -0.04 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.18 2wii s ILE 1423N -0.16 1.78 -0.24 6.68 1.01 -1.26 -0.59 121.20 128.43 2wii s ILE 1423Ca -0.02 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 59.83 2wii s ILE 1423Cb -0.01 -1.61 0.04 0.00 0.01 0.00 0.00 42.46 40.89 2wii s ILE 1423CO -0.00 0.50 -0.10 -0.63 0.00 0.00 0.00 174.94 174.71 2wii s ILE 1424N 1.01 2.52 -0.09 2.92 1.01 -0.93 -4.71 121.20 122.93 2wii s ILE 1424Ca -0.04 -1.20 -0.20 0.00 0.00 0.00 0.00 60.65 59.20 2wii s ILE 1424Cb -0.15 -2.30 -0.04 0.00 0.01 0.00 0.00 42.46 39.98 2wii s ILE 1424CO -0.04 0.19 0.57 -0.31 0.00 0.00 0.00 174.94 175.35 2wii s TYR 1425N 1.25 3.55 -0.12 3.97 1.51 -0.45 -0.90 117.35 126.16 2wii s TYR 1425Ca -0.02 1.05 -0.00 0.00 -1.01 0.00 0.00 57.07 57.09 2wii s TYR 1425Cb -0.17 -2.65 -0.02 0.00 -0.11 0.00 0.00 41.96 39.01 2wii s TYR 1425CO -0.06 0.15 -0.11 -0.51 -1.11 0.00 0.00 175.55 173.91 2wii s LEU 1426N 0.63 2.86 0.34 -1.29 1.43 -0.30 0.23 118.68 122.57 2wii s LEU 1426Ca 0.31 -0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 2wii s LEU 1426Cb -0.16 -1.64 0.59 0.00 0.03 0.00 0.00 46.19 45.00 2wii s LEU 1426CO 0.14 0.21 2.00 0.44 0.23 0.00 0.00 176.35 179.37 2wii h ASP 1427N 6.35 0.79 -4.01 2.29 5.19 -1.46 -0.22 116.42 125.35 2wii h ASP 1427Ca -0.32 -0.02 0.16 0.00 -0.62 0.00 0.00 57.03 56.23 2wii h ASP 1427Cb 1.20 -0.20 -0.22 0.00 0.18 0.00 0.00 39.33 40.29 2wii h ASP 1427CO 0.56 0.57 0.68 -1.59 -3.12 0.00 0.00 179.24 176.34 2wii s LYS 1428N -5.78 0.45 0.08 3.56 -2.85 -1.26 -2.23 119.74 111.71 2wii s LYS 1428Ca -0.10 -0.00 0.10 0.00 -1.00 0.00 0.00 55.97 54.96 2wii s LYS 1428Cb 0.18 0.21 -0.03 0.00 -2.06 0.00 0.00 37.83 36.12 2wii s LYS 1428CO 0.77 -0.16 -0.26 0.14 0.10 0.00 0.00 175.35 175.94 2wii s VAL 1429N -1.67 2.21 0.37 1.79 -7.23 -1.19 -4.98 120.40 109.71 2wii s VAL 1429Ca 0.04 -1.55 -0.25 0.00 -1.81 0.00 0.00 61.98 58.41 2wii s VAL 1429Cb -0.01 -1.92 -0.10 0.00 0.56 0.00 0.00 36.38 34.92 2wii s VAL 1429CO -0.03 0.24 1.00 -0.55 -0.31 0.00 0.00 175.10 175.45 2wii s SER 1430N -1.62 7.01 0.00 4.85 0.15 -1.26 -2.40 113.70 120.43 2wii s SER 1430Ca 0.13 1.93 0.19 0.00 0.70 0.00 0.00 55.95 58.90 2wii s SER 1430Cb -0.10 -2.58 0.16 0.00 -1.71 0.00 0.00 66.02 61.79 2wii s SER 1430CO 0.04 -0.31 1.11 0.00 1.20 0.00 0.00 173.24 175.28 2wii n HIS 1431N 0.13 0.01 -0.06 3.44 1.44 -1.26 -1.54 115.22 117.39 2wii n HIS 1431Ca 0.04 -0.01 -0.18 0.00 -2.01 0.00 0.00 57.72 55.57 2wii n HIS 1431Cb 0.50 -0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.48 2wii n HIS 1431CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 2wii n SER 1432N 1.07 1.73 -3.56 4.39 7.64 -1.26 -4.80 113.62 118.83 2wii n SER 1432Ca 0.11 0.09 -0.12 0.00 1.01 0.00 0.00 58.87 59.96 2wii n SER 1432Cb 0.48 -0.43 -0.04 0.00 -1.01 0.00 0.00 64.21 63.20 2wii n SER 1432CO 0.00 0.00 0.00 -1.83 -3.01 0.00 0.00 175.04 170.20 2wii s GLU 1433N -2.54 1.75 0.17 1.43 -1.05 -1.26 -5.13 118.70 112.07 2wii s GLU 1433Ca -0.24 -1.55 -0.30 0.00 -0.15 0.00 0.00 54.97 52.74 2wii s GLU 1433Cb 0.08 0.45 -0.07 0.00 -0.44 0.00 0.00 34.13 34.15 2wii s GLU 1433CO 0.72 -0.73 1.04 -0.51 0.95 0.00 0.00 175.26 176.73 2wii s ASP 1434N -3.14 7.39 -0.45 0.83 1.11 -1.26 -4.52 116.67 116.63 2wii s ASP 1434Ca 0.27 1.99 -0.15 0.00 0.18 0.00 0.00 52.55 54.85 2wii s ASP 1434Cb -0.00 -2.60 0.06 0.00 1.07 0.00 0.00 42.92 41.44 2wii s ASP 1434CO 0.15 -0.12 0.35 -1.81 1.18 0.00 0.00 175.17 174.92 2wii s ASP 1435N -0.25 6.08 -0.15 0.27 1.01 0.40 -4.90 116.67 119.12 2wii s ASP 1435Ca 0.47 -1.23 -0.05 0.00 0.71 0.00 0.00 52.55 52.46 2wii s ASP 1435Cb -0.27 -2.15 -0.04 0.00 1.01 0.00 0.00 42.92 41.47 2wii s ASP 1435CO 0.33 -0.58 0.03 0.00 0.21 0.00 0.00 175.17 175.16 2wii s LEU 1437N -0.05 2.36 -0.00 0.00 0.05 -0.78 -5.00 118.68 115.25 2wii s LEU 1437Ca 0.05 -0.73 -0.11 0.00 0.05 0.00 0.00 54.13 53.39 2wii s LEU 1437Cb -0.12 -0.21 0.01 0.00 -2.05 0.00 0.00 46.19 43.82 2wii s LEU 1437CO 0.02 -0.27 0.22 0.00 -0.55 0.00 0.00 176.35 175.77 2wii s ALA 1438N -2.17 -0.54 0.15 1.48 0.00 -1.26 -0.66 121.76 118.75 2wii s ALA 1438Ca -0.00 0.06 -0.13 0.00 0.00 0.00 0.00 51.96 51.89 2wii s ALA 1438Cb -0.05 0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2wii s ALA 1438CO -0.01 -0.24 0.37 -0.59 0.00 0.00 0.00 175.76 175.28 2wii s PHE 1439N -1.46 0.03 0.34 0.00 -0.71 -0.89 -5.01 117.98 110.28 2wii s PHE 1439Ca -0.14 -0.39 -0.12 0.00 -1.04 0.00 0.00 56.93 55.25 2wii s PHE 1439Cb -0.06 0.16 -0.07 0.00 -1.21 0.00 0.00 43.02 41.83 2wii s PHE 1439CO 0.02 -0.74 0.71 0.15 -1.34 0.00 0.00 175.22 174.03 2wii s LYS 1440N -3.87 3.86 -0.02 1.99 1.02 -1.26 -1.81 119.74 119.65 2wii s LYS 1440Ca 0.09 0.50 0.05 0.00 0.02 0.00 0.00 55.97 56.62 2wii s LYS 1440Cb 0.02 -2.46 -0.01 0.00 -0.52 0.00 0.00 37.83 34.86 2wii s LYS 1440CO -0.06 0.11 -0.16 0.14 -0.92 0.00 0.00 175.35 174.45 2wii s VAL 1441N -2.12 1.28 -0.05 3.17 -7.23 0.14 -1.62 120.40 113.97 2wii s VAL 1441Ca 0.51 -0.67 0.06 0.00 -1.81 0.00 0.00 61.98 60.07 2wii s VAL 1441Cb -0.10 -1.07 -0.01 0.00 0.56 0.00 0.00 36.38 35.75 2wii s VAL 1441CO 0.24 0.36 -0.24 -1.00 -0.31 0.00 0.00 175.10 174.16 2wii s HIS 1442N -0.25 2.28 -0.11 2.82 0.09 -0.02 -1.50 115.29 118.59 2wii s HIS 1442Ca 0.04 -0.63 -0.26 0.00 -0.00 0.00 0.00 55.06 54.21 2wii s HIS 1442Cb -0.07 -1.49 -0.02 0.00 -0.00 0.00 0.00 32.58 30.99 2wii s HIS 1442CO 0.00 -0.17 0.85 -1.14 -0.00 0.00 0.00 174.74 174.27 2wii s GLN 1443N -0.22 4.39 -0.08 1.40 0.74 0.17 -1.67 119.66 124.39 2wii s GLN 1443Ca -0.01 1.09 0.06 0.00 0.05 0.00 0.00 55.36 56.55 2wii s GLN 1443Cb -0.13 -3.52 -0.09 0.00 1.10 0.00 0.00 33.01 30.37 2wii s GLN 1443CO 0.02 -0.19 0.00 0.98 -0.55 0.00 0.00 175.29 175.56 2wii n TYR 1444N 4.65 0.00 -4.44 1.67 9.36 -0.21 -3.54 117.16 124.66 2wii n TYR 1444Ca 0.04 0.00 -0.30 0.00 3.32 0.00 0.00 57.90 60.96 2wii n TYR 1444Cb 0.50 -0.38 -0.12 0.00 -0.63 0.00 0.00 39.34 38.71 2wii n TYR 1444CO 0.00 0.00 0.00 0.12 0.22 0.00 0.00 176.86 177.20 2wii s PHE 1445N -2.19 2.50 -0.16 2.98 5.36 -1.13 -4.81 117.98 120.53 2wii s PHE 1445Ca -0.06 -0.28 0.00 0.00 -0.96 0.00 0.00 56.93 55.63 2wii s PHE 1445Cb 0.03 -1.37 0.00 0.00 -0.34 0.00 0.00 43.02 41.34 2wii s PHE 1445CO 0.30 0.33 -0.15 1.21 -1.46 0.00 0.00 175.22 175.44 2wii s ASN 1446N -1.90 3.62 0.04 6.13 3.84 -1.26 -4.59 114.94 120.83 2wii s ASN 1446Ca 0.16 -0.49 -0.00 0.00 0.21 0.00 0.00 52.86 52.74 2wii s ASN 1446Cb -0.10 -1.56 -0.03 0.00 -0.55 0.00 0.00 41.25 39.01 2wii s ASN 1446CO 0.08 0.07 -0.04 0.54 -2.79 0.00 0.00 177.10 174.96 2wii s VAL 1447N 0.88 0.26 -0.08 -5.21 0.11 -1.26 -5.08 120.40 110.02 2wii s VAL 1447Ca -0.04 -1.45 -0.24 0.00 -2.93 0.00 0.00 61.98 57.32 2wii s VAL 1447Cb -0.15 -1.02 -0.19 0.00 -1.53 0.00 0.00 36.38 33.48 2wii s VAL 1447CO -0.01 -0.76 0.89 1.05 -3.33 0.00 0.00 175.10 172.94 2wii h GLU 1448N 3.77 -0.08 -5.03 1.54 4.11 -2.00 -3.42 114.58 113.48 2wii h GLU 1448Ca -0.34 0.01 -0.66 0.00 0.07 0.00 0.00 59.36 58.44 2wii h GLU 1448Cb 1.17 0.02 -0.17 0.00 0.50 0.00 0.00 28.75 30.27 2wii h GLU 1448CO 0.55 0.53 -0.21 -0.51 0.07 0.00 0.00 179.01 179.44 2wii s LEU 1449N -8.78 4.46 -0.27 3.06 2.01 -1.26 -5.06 118.68 112.84 2wii s LEU 1449Ca -0.15 -0.22 -0.10 0.00 0.01 0.00 0.00 54.13 53.68 2wii s LEU 1449Cb -0.00 -2.42 -0.04 0.00 0.01 0.00 0.00 46.19 43.73 2wii s LEU 1449CO 0.57 -0.41 0.16 -0.63 1.01 0.00 0.00 176.35 177.05 2wii s ILE 1450N 2.14 5.07 0.17 -0.59 1.01 -1.26 -5.02 121.20 122.72 2wii s ILE 1450Ca 0.14 0.09 -0.30 0.00 0.00 0.00 0.00 60.65 60.57 2wii s ILE 1450Cb -0.16 -3.40 -0.08 0.00 0.01 0.00 0.00 42.46 38.83 2wii s ILE 1450CO 0.12 0.28 1.24 -1.10 0.00 0.00 0.00 174.94 175.48 2wii s GLN 1451N 1.65 4.45 0.54 2.79 -0.21 -1.26 -4.95 119.66 122.66 2wii s GLN 1451Ca 0.07 1.92 -0.22 0.00 0.02 0.00 0.00 55.36 57.15 2wii s GLN 1451Cb -0.16 -3.24 -0.05 0.00 1.00 0.00 0.00 33.01 30.56 2wii s GLN 1451CO 0.09 -0.18 1.32 -2.14 -2.12 0.00 0.00 175.29 172.26 2wii s PRO 1452N 0.08 3.22 0.74 2.91 0.02 -1.26 -3.50 135.00 137.20 2wii s PRO 1452Ca 0.55 2.14 -0.08 0.00 0.02 0.00 0.00 61.00 63.63 2wii s PRO 1452Cb -0.33 -2.26 0.08 0.00 0.02 0.00 0.00 34.50 32.01 2wii s PRO 1452CO 0.35 -1.10 1.07 0.20 -0.33 0.00 0.00 177.00 177.19 2wii s GLY 1453N -1.06 1.68 0.02 0.52 0.00 0.45 -4.83 107.32 104.09 2wii s GLY 1453Ca 0.71 -0.91 -0.00 0.00 0.00 0.00 0.00 44.72 44.52 2wii s GLY 1453CO 0.45 -0.46 -0.03 0.00 0.00 0.00 0.00 173.10 173.06 2wii s ALA 1454N -3.35 0.11 -0.05 3.20 0.00 -1.09 -1.35 121.76 119.22 2wii s ALA 1454Ca 0.62 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.05 2wii s ALA 1454Cb -0.10 0.13 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2wii s ALA 1454CO 0.46 -0.14 -0.03 0.08 0.00 0.00 0.00 175.76 176.13 2wii s VAL 1455N -1.32 0.47 -0.10 0.00 1.01 0.79 -0.96 120.40 120.30 2wii s VAL 1455Ca -0.14 -0.04 0.03 0.00 0.00 0.00 0.00 61.98 61.82 2wii s VAL 1455Cb -0.09 -0.54 0.01 0.00 0.00 0.00 0.00 36.38 35.76 2wii s VAL 1455CO -0.01 0.23 -0.18 -0.75 0.00 0.00 0.00 175.10 174.39 2wii s LYS 1456N 1.23 2.46 -0.03 2.72 2.20 -0.24 -0.51 119.74 127.56 2wii s LYS 1456Ca -0.06 -0.66 0.06 0.00 -0.36 0.00 0.00 55.97 54.94 2wii s LYS 1456Cb -0.14 -1.97 -0.02 0.00 -1.51 0.00 0.00 37.83 34.19 2wii s LYS 1456CO -0.02 0.05 -0.20 0.14 -0.36 0.00 0.00 175.35 174.96 2wii s VAL 1457N 0.66 2.56 -0.18 4.02 -7.23 -0.72 -1.36 120.40 118.16 2wii s VAL 1457Ca -0.13 -0.94 -0.30 0.00 -1.81 0.00 0.00 61.98 58.80 2wii s VAL 1457Cb -0.16 -1.96 0.14 0.00 0.56 0.00 0.00 36.38 34.96 2wii s VAL 1457CO 0.03 0.57 1.05 -0.72 -0.31 0.00 0.00 175.10 175.72 2wii s TYR 1458N -0.69 -0.32 0.48 2.82 -0.85 -1.18 -1.65 117.35 115.97 2wii s TYR 1458Ca 0.11 0.54 -0.20 0.00 -0.52 0.00 0.00 57.07 56.99 2wii s TYR 1458Cb -0.10 0.46 -0.08 0.00 0.38 0.00 0.00 41.96 42.61 2wii s TYR 1458CO 0.00 -0.30 1.04 0.00 -1.52 0.00 0.00 175.55 174.77 2wii s ALA 1459N -1.13 2.88 0.26 9.51 0.00 -1.25 -1.03 121.76 131.00 2wii s ALA 1459Ca -0.00 0.62 -0.03 0.00 0.00 0.00 0.00 51.96 52.55 2wii s ALA 1459Cb -0.01 -3.26 0.39 0.00 0.00 0.00 0.00 23.12 20.25 2wii s ALA 1459CO 0.00 -0.31 1.87 0.10 0.00 0.00 0.00 175.76 177.42 2wii h TYR 1460N 1.62 1.14 0.00 0.00 -0.00 -1.71 -2.42 116.97 115.59 2wii h TYR 1460Ca -0.49 0.03 -0.06 0.00 0.00 0.00 0.00 58.73 58.21 2wii h TYR 1460Cb 1.22 -0.37 -0.01 0.00 0.00 0.00 0.00 36.73 37.57 2wii h TYR 1460CO 0.57 0.59 -0.29 0.10 -0.00 0.00 0.00 178.16 179.12 2wii h TYR 1461N 1.12 0.00 -3.28 0.10 -0.00 -1.93 -3.41 116.97 109.57 2wii h TYR 1461Ca 0.42 0.00 -0.50 0.00 0.00 0.00 0.00 58.73 58.65 2wii h TYR 1461Cb 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 36.73 36.52 2wii h TYR 1461CO -0.01 0.29 -0.77 1.21 -0.00 0.00 0.00 178.16 178.87 2wii s ASN 1462N -6.44 2.42 -0.04 0.10 3.84 -0.91 -4.99 114.94 108.92 2wii s ASN 1462Ca -0.01 -0.51 0.11 0.00 0.21 0.00 0.00 52.86 52.66 2wii s ASN 1462Cb 0.12 -0.65 -0.23 0.00 -0.55 0.00 0.00 41.25 39.94 2wii s ASN 1462CO 0.66 -0.23 0.69 0.25 -2.79 0.00 0.00 177.10 175.68 2wii h LEU 1463N 8.23 0.03 -0.34 3.21 5.85 -1.81 -3.31 115.31 127.17 2wii h LEU 1463Ca -0.20 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.44 2wii h LEU 1463Cb 1.12 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 2wii h LEU 1463CO 0.33 1.06 0.18 -0.33 -0.34 0.00 0.00 178.44 179.35 2wii h GLU 1464N 0.01 0.48 -5.61 1.25 5.08 -1.94 -3.31 114.58 110.54 2wii h GLU 1464Ca -0.28 -0.06 -0.62 0.00 -1.00 0.00 0.00 59.36 57.40 2wii h GLU 1464Cb 2.00 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 31.09 2wii h GLU 1464CO 0.08 0.41 2.11 0.39 -1.00 0.00 0.00 179.01 181.00 2wii n GLU 1465N -4.77 2.87 -4.46 2.33 1.02 -1.26 -4.90 120.64 111.47 2wii n GLU 1465Ca -0.01 -3.06 -0.23 0.00 -0.02 0.00 0.00 57.16 53.84 2wii n GLU 1465Cb 0.08 -3.51 -0.09 0.00 -0.02 0.00 0.00 31.44 27.90 2wii n GLU 1465CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2wii s SER 1466N 4.52 2.40 -0.05 1.62 1.04 -1.25 -4.49 113.70 117.50 2wii s SER 1466Ca 0.56 -1.53 -0.01 0.00 0.48 0.00 0.00 55.95 55.44 2wii s SER 1466Cb 0.04 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.45 2wii s SER 1466CO 0.08 -0.79 0.03 0.00 0.98 0.00 0.00 173.24 173.54 2wii s THR 1468N 1.91 3.52 -0.06 0.00 2.01 -1.26 -1.76 115.64 120.00 2wii s THR 1468Ca 0.02 -0.48 0.05 0.00 0.31 0.00 0.00 61.69 61.59 2wii s THR 1468Cb -0.12 -2.54 -0.01 0.00 0.01 0.00 0.00 72.50 69.84 2wii s THR 1468CO -0.04 0.49 -0.22 -0.13 -0.69 0.00 0.00 174.62 174.03 2wii s ARG 1469N 0.62 2.36 -0.08 4.92 1.81 0.33 -4.94 118.95 123.97 2wii s ARG 1469Ca -0.04 -0.79 -0.05 0.00 -1.72 0.00 0.00 55.73 53.13 2wii s ARG 1469Cb -0.15 -1.96 -0.04 0.00 -0.45 0.00 0.00 34.95 32.35 2wii s ARG 1469CO 0.03 0.29 0.15 -0.06 -0.68 0.00 0.00 175.30 175.03 2wii s PHE 1470N 0.03 3.58 0.07 -0.53 0.40 -1.26 -0.15 117.98 120.12 2wii s PHE 1470Ca -0.07 0.47 0.05 0.00 -0.60 0.00 0.00 56.93 56.78 2wii s PHE 1470Cb -0.14 -1.90 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 2wii s PHE 1470CO 0.04 0.71 -0.14 1.52 0.70 0.00 0.00 175.22 178.05 2wii s TYR 1471N -1.13 1.19 -0.21 0.36 -0.85 -0.46 -4.96 117.35 111.30 2wii s TYR 1471Ca 0.19 -0.47 -0.28 0.00 -0.52 0.00 0.00 57.07 55.99 2wii s TYR 1471Cb -0.12 -0.67 0.12 0.00 0.38 0.00 0.00 41.96 41.67 2wii s TYR 1471CO 0.09 0.05 0.97 -1.58 -1.52 0.00 0.00 175.55 173.56 2wii s HIS 1472N -1.35 -0.46 1.17 -3.49 2.46 -1.26 -0.41 115.29 111.94 2wii s HIS 1472Ca -0.02 0.97 -0.18 0.00 0.47 0.00 0.00 55.06 56.31 2wii s HIS 1472Cb -0.10 0.40 0.21 0.00 -0.13 0.00 0.00 32.58 32.97 2wii s HIS 1472CO 0.02 -0.32 0.42 -2.30 -2.47 0.00 0.00 174.74 170.09 2wii n PRO 1473N 1.48 -2.67 -1.25 2.88 -0.02 -1.26 -4.02 135.00 130.13 2wii n PRO 1473Ca -0.12 -0.78 -0.06 0.00 -2.02 0.00 0.00 63.50 60.51 2wii n PRO 1473Cb 0.57 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 32.29 2wii n PRO 1473CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2wii n GLU 1474N -3.16 -0.45 -4.25 -0.52 -0.58 -1.26 -5.02 120.64 105.39 2wii n GLU 1474Ca 0.05 0.70 -0.23 0.00 -0.42 0.00 0.00 57.16 57.26 2wii n GLU 1474Cb 0.52 -4.48 -0.17 0.00 -0.57 0.00 0.00 31.44 26.74 2wii n GLU 1474CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 2wii s LYS 1475N -2.67 1.22 0.00 3.49 -0.14 -1.26 -5.06 119.74 115.32 2wii s LYS 1475Ca 0.00 -0.22 0.00 0.00 -1.36 0.00 0.00 55.97 54.39 2wii s LYS 1475Cb 0.00 -1.15 0.00 0.00 -1.68 0.00 0.00 37.83 35.00 2wii s LYS 1475CO 0.00 -0.08 0.00 -0.85 -0.76 0.00 0.00 175.35 173.66 2wii n GLU 1476N 4.16 1.26 -4.18 1.68 0.28 -1.26 -4.87 120.64 117.71 2wii n GLU 1476Ca -0.21 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.63 2wii n GLU 1476Cb 0.51 -0.93 -0.14 0.00 1.43 0.00 0.00 31.44 32.31 2wii n GLU 1476CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2wii n ARG 1485N 2.83 0.63 -1.58 0.00 1.74 -1.26 -4.70 116.66 114.32 2wii n ARG 1485Ca -0.14 -0.14 -0.58 0.00 -0.77 0.00 0.00 57.85 56.22 2wii n ARG 1485Cb 0.58 -1.42 -0.09 0.00 -1.02 0.00 0.00 32.46 30.52 2wii n ARG 1485CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2wii n ASP 1486N -2.17 1.84 -0.29 0.55 8.00 -1.26 -4.78 116.55 118.44 2wii n ASP 1486Ca -0.06 0.89 0.17 0.00 0.71 0.00 0.00 54.79 56.50 2wii n ASP 1486Cb 0.53 -1.08 0.45 0.00 -0.02 0.00 0.00 41.12 41.00 2wii n ASP 1486CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2wii h GLU 1487N 8.24 0.52 0.00 -1.24 4.57 -1.93 0.50 114.58 125.24 2wii h GLU 1487Ca -0.35 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 57.73 2wii h GLU 1487Cb 1.35 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.81 2wii h GLU 1487CO 1.00 0.34 -0.33 1.25 -1.18 0.00 0.00 179.01 180.09 2wii h LEU 1488N 0.53 0.00 0.24 1.64 5.85 -1.90 -0.60 115.31 121.07 2wii h LEU 1488Ca 0.52 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.91 2wii h LEU 1488Cb 1.10 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.17 2wii h LEU 1488CO -0.25 0.33 -1.43 0.00 -0.34 0.00 0.00 178.44 176.76 2wii h ARG 1490N 0.08 0.91 -0.54 0.00 3.08 -0.73 -3.20 114.38 113.99 2wii h ARG 1490Ca -0.25 -0.51 -0.04 0.00 0.07 0.00 0.00 59.98 59.25 2wii h ARG 1490Cb 2.10 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 32.16 2wii h ARG 1490CO 0.25 1.16 0.19 0.00 -1.07 0.00 0.00 179.97 180.50 2wii h ALA 1492N 1.44 1.13 -0.59 0.00 0.00 -1.58 -3.01 119.26 116.65 2wii h ALA 1492Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2wii h ALA 1492Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2wii h ALA 1492CO -0.01 0.20 0.00 -0.85 0.00 0.00 0.00 179.25 178.59 2wii n GLU 1493N -3.47 4.13 0.01 0.00 0.28 -1.06 -4.41 120.64 116.13 2wii n GLU 1493Ca -0.01 -2.98 -0.10 0.00 -0.16 0.00 0.00 57.16 53.91 2wii n GLU 1493Cb 0.33 -2.03 0.05 0.00 1.43 0.00 0.00 31.44 31.22 2wii n GLU 1493CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2wii h GLU 1494N 3.84 0.53 -0.62 3.44 5.08 -1.60 -3.24 114.58 122.01 2wii h GLU 1494Ca 0.00 -0.35 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2wii h GLU 1494Cb 1.65 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.95 2wii h GLU 1494CO 0.33 0.97 0.00 0.09 -1.00 0.00 0.00 179.01 179.40 2wii n ASN 1495N -3.94 5.12 -0.16 1.42 3.02 -1.26 -4.42 115.26 115.03 2wii n ASN 1495Ca -0.03 -2.63 -0.08 0.00 -0.03 0.00 0.00 54.58 51.81 2wii n ASN 1495Cb 0.63 -0.62 0.01 0.00 -0.61 0.00 0.00 39.78 39.19 2wii n ASN 1495CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2wii s PHE 1497N -5.98 -0.03 -0.36 0.00 -0.12 -1.23 -3.86 117.98 106.39 2wii s PHE 1497Ca -0.13 -0.23 -0.28 0.00 -0.05 0.00 0.00 56.93 56.24 2wii s PHE 1497Cb 0.12 0.62 -0.07 0.00 -0.63 0.00 0.00 43.02 43.06 2wii s PHE 1497CO 0.75 -0.65 2.31 -0.89 -0.05 0.00 0.00 175.22 176.69 2wii n ILE 1498N -0.59 0.15 -2.70 -4.49 5.41 -0.75 -4.86 119.36 111.53 2wii n ILE 1498Ca -0.05 -0.56 -0.42 0.00 1.00 0.00 0.00 62.75 62.72 2wii n ILE 1498Cb 0.61 -2.49 -0.03 0.00 -0.71 0.00 0.00 39.64 37.02 2wii n ILE 1498CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2wii s GLN 1499N 7.18 4.37 -0.14 0.38 -1.52 -1.26 -4.74 119.66 123.92 2wii s GLN 1499Ca 1.02 1.34 -0.32 0.00 -1.95 0.00 0.00 55.36 55.45 2wii s GLN 1499Cb -0.36 -3.57 0.13 0.00 -0.22 0.00 0.00 33.01 28.99 2wii s GLN 1499CO 0.34 -0.40 1.10 0.21 -0.25 0.00 0.00 175.29 176.29 2wii s LYS 1500N 2.33 0.47 -0.16 2.91 2.20 -1.26 -5.16 119.74 121.07 2wii s LYS 1500Ca 0.46 -0.13 -0.07 0.00 -0.36 0.00 0.00 55.97 55.87 2wii s LYS 1500Cb -0.17 0.22 -0.04 0.00 -1.51 0.00 0.00 37.83 36.32 2wii s LYS 1500CO 0.14 -0.20 0.09 -1.12 -0.36 0.00 0.00 175.35 173.90 2wii s SER 1501N -2.08 5.88 0.55 1.43 0.01 -1.26 -4.98 113.70 113.25 2wii s SER 1501Ca 0.07 0.20 0.27 0.00 1.31 0.00 0.00 55.95 57.80 2wii s SER 1501Cb -0.01 -1.96 1.47 0.00 0.21 0.00 0.00 66.02 65.73 2wii s SER 1501CO -0.05 0.25 1.99 -2.24 0.41 0.00 0.00 173.24 173.59 2wii h ASP 1502N 6.16 0.00 -0.04 2.44 3.04 -2.01 -0.54 116.42 125.46 2wii h ASP 1502Ca -0.43 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 53.35 2wii h ASP 1502Cb 1.18 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.47 2wii h ASP 1502CO 0.67 0.00 0.01 0.44 -2.04 0.00 0.00 179.24 178.33 2wii h ASP 1503N 0.00 0.06 0.41 4.15 3.32 -2.04 -2.77 116.42 119.55 2wii h ASP 1503Ca 0.22 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2wii h ASP 1503Cb 0.97 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 2wii h ASP 1503CO -0.00 0.27 -0.24 0.11 -1.72 0.00 0.00 179.24 177.65 2wii h LYS 1504N -0.14 0.00 -6.64 3.56 1.57 -1.54 -3.43 116.57 109.95 2wii h LYS 1504Ca 0.01 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.27 2wii h LYS 1504Cb 0.23 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.56 2wii h LYS 1504CO -0.00 0.24 0.61 0.08 -0.57 0.00 0.00 179.45 179.82 2wii s VAL 1505N -4.18 3.45 0.34 0.50 1.01 -0.78 -5.04 120.40 115.70 2wii s VAL 1505Ca -0.03 1.17 0.10 0.00 0.00 0.00 0.00 61.98 63.22 2wii s VAL 1505Cb 0.14 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.71 2wii s VAL 1505CO 0.66 0.16 -0.09 0.42 0.00 0.00 0.00 175.10 176.25 2wii s THR 1506N 0.25 2.33 0.08 3.92 -4.23 -1.26 -4.94 115.64 111.79 2wii s THR 1506Ca 0.56 -2.19 -0.29 0.00 -1.18 0.00 0.00 61.69 58.59 2wii s THR 1506Cb -0.34 -2.63 -0.17 0.00 1.34 0.00 0.00 72.50 70.69 2wii s THR 1506CO 0.36 -0.22 1.67 0.25 -0.54 0.00 0.00 174.62 176.14 2wii h LEU 1507N 2.02 -0.46 -1.56 4.79 6.46 -1.96 -2.28 115.31 122.32 2wii h LEU 1507Ca -0.42 0.02 0.10 0.00 -0.12 0.00 0.00 57.88 57.46 2wii h LEU 1507Cb 1.25 0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 41.26 2wii h LEU 1507CO 0.69 -0.32 0.44 -0.33 -0.62 0.00 0.00 178.44 178.30 2wii h GLU 1508N -0.53 0.48 -0.45 1.25 5.08 -1.97 -1.75 114.58 116.68 2wii h GLU 1508Ca -0.05 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 2wii h GLU 1508Cb 0.41 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2wii h GLU 1508CO 0.08 0.32 0.20 1.49 -1.00 0.00 0.00 179.01 180.10 2wii h GLU 1509N 0.49 0.66 -0.42 2.33 4.81 -1.84 -1.93 114.58 118.69 2wii h GLU 1509Ca 0.31 -0.11 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 2wii h GLU 1509Cb 0.55 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 2wii h GLU 1509CO -0.10 0.58 0.11 0.00 -0.73 0.00 0.00 179.01 178.88 2wii h ARG 1510N 0.59 0.66 -0.92 1.92 3.08 -0.79 -1.52 114.38 117.39 2wii h ARG 1510Ca 0.15 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 2wii h ARG 1510Cb 0.16 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 2wii h ARG 1510CO -0.02 0.67 0.54 -0.07 -1.07 0.00 0.00 179.97 180.02 2wii h LEU 1511N 0.53 1.12 -0.21 3.04 3.38 -1.36 0.23 115.31 122.05 2wii h LEU 1511Ca 0.13 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 2wii h LEU 1511Cb 0.30 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 2wii h LEU 1511CO -0.00 0.87 0.03 -0.78 0.09 0.00 0.00 178.44 178.65 2wii h ASP 1512N 1.28 0.33 -0.14 -0.43 3.58 -1.13 -2.78 116.42 117.13 2wii h ASP 1512Ca 0.33 -0.27 -0.19 0.00 0.42 0.00 0.00 57.03 57.33 2wii h ASP 1512Cb -0.03 -0.09 0.01 0.00 1.72 0.00 0.00 39.33 40.94 2wii h ASP 1512CO -0.06 0.51 -0.64 0.11 -2.88 0.00 0.00 179.24 176.28 2wii h LYS 1513N 0.13 0.68 -0.32 0.28 1.57 -1.03 -3.30 116.57 114.59 2wii h LYS 1513Ca 0.06 -0.55 -0.14 0.00 -1.87 0.00 0.00 60.65 58.16 2wii h LYS 1513Cb 0.33 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 2wii h LYS 1513CO 0.00 1.16 -0.36 0.00 -0.57 0.00 0.00 179.45 179.69 2wii h ALA 1514N 0.52 0.77 0.00 3.86 0.00 -0.60 -3.04 119.26 120.78 2wii h ALA 1514Ca -0.04 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2wii h ALA 1514Cb 1.28 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2wii h ALA 1514CO 0.13 0.65 0.00 0.00 0.00 0.00 0.00 179.25 180.04 2wii n GLU 1516N -2.54 1.40 -0.27 0.00 -0.58 -1.15 -4.83 120.64 112.67 2wii n GLU 1516Ca 0.03 0.50 0.18 0.00 -0.42 0.00 0.00 57.16 57.45 2wii n GLU 1516Cb 0.35 -1.99 0.47 0.00 -0.57 0.00 0.00 31.44 29.70 2wii n GLU 1516CO 0.00 0.00 0.00 -1.00 -0.48 0.00 0.00 177.13 175.65 2wii h PRO 1517N 3.18 0.48 -0.58 3.49 0.13 -1.91 -1.33 132.00 135.46 2wii h PRO 1517Ca -0.43 -0.03 0.11 0.00 -0.87 0.00 0.00 66.00 64.78 2wii h PRO 1517Cb 1.33 -0.11 -0.08 0.00 0.13 0.00 0.00 31.00 32.27 2wii h PRO 1517CO 0.69 0.32 0.11 0.78 -0.23 0.00 0.00 178.00 179.67 2wii h GLY 1518N 0.49 0.72 -5.18 1.56 0.00 -1.94 -3.39 103.07 95.33 2wii h GLY 1518Ca 0.50 -0.02 -0.54 0.00 0.00 0.00 0.00 47.33 47.28 2wii h GLY 1518CO -0.22 -0.11 1.12 0.14 0.00 0.00 0.00 176.54 177.46 2wii s VAL 1519N -6.12 3.15 -0.24 4.60 1.01 -0.50 -4.27 120.40 118.04 2wii s VAL 1519Ca -0.13 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.29 2wii s VAL 1519Cb 0.17 -3.23 -0.20 0.00 0.00 0.00 0.00 36.38 33.12 2wii s VAL 1519CO 0.74 -0.02 -0.11 -0.67 0.00 0.00 0.00 175.10 175.03 2wii n ASP 1520N 6.72 1.26 -4.14 3.32 2.03 -0.41 -4.88 116.55 120.44 2wii n ASP 1520Ca 0.18 -0.08 -0.18 0.00 0.52 0.00 0.00 54.79 55.23 2wii n ASP 1520Cb 0.41 0.10 -0.12 0.00 -0.72 0.00 0.00 41.12 40.79 2wii n ASP 1520CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 2wii s TYR 1521N -2.51 1.11 -0.15 -0.67 -0.85 -1.22 -3.06 117.35 109.99 2wii s TYR 1521Ca -0.26 -0.44 -0.04 0.00 -0.52 0.00 0.00 57.07 55.81 2wii s TYR 1521Cb 0.08 -0.63 0.07 0.00 0.38 0.00 0.00 41.96 41.86 2wii s TYR 1521CO 0.69 0.03 0.22 0.08 -1.52 0.00 0.00 175.55 175.04 2wii s VAL 1522N -1.21 -0.34 0.05 -3.49 1.01 0.11 -2.85 120.40 113.69 2wii s VAL 1522Ca -0.03 0.14 0.06 0.00 0.00 0.00 0.00 61.98 62.15 2wii s VAL 1522Cb -0.10 -0.50 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 2wii s VAL 1522CO 0.02 -0.01 -0.17 -0.31 0.00 0.00 0.00 175.10 174.63 2wii s TYR 1523N 2.35 1.45 -0.46 5.22 2.02 0.28 -1.05 117.35 127.16 2wii s TYR 1523Ca 0.04 -0.38 -0.20 0.00 -0.37 0.00 0.00 57.07 56.16 2wii s TYR 1523Cb -0.14 -0.84 0.03 0.00 -0.40 0.00 0.00 41.96 40.62 2wii s TYR 1523CO -0.09 0.08 0.61 0.21 -1.57 0.00 0.00 175.55 174.78 2wii s LYS 1524N -1.36 3.19 0.18 -0.62 2.20 -0.60 -1.65 119.74 121.08 2wii s LYS 1524Ca 0.03 -0.61 0.09 0.00 -0.36 0.00 0.00 55.97 55.12 2wii s LYS 1524Cb -0.09 -4.00 -0.04 0.00 -1.51 0.00 0.00 37.83 32.19 2wii s LYS 1524CO 0.02 -1.06 -0.09 0.95 -0.36 0.00 0.00 175.35 174.80 2wii s THR 1525N 2.66 3.21 -0.13 3.43 -4.23 -0.00 -1.03 115.64 119.55 2wii s THR 1525Ca 0.18 -1.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.09 2wii s THR 1525Cb -0.16 -2.58 0.01 0.00 1.34 0.00 0.00 72.50 71.11 2wii s THR 1525CO 0.16 -0.10 -0.18 -0.60 -0.54 0.00 0.00 174.62 173.36 2wii s ARG 1526N -2.79 2.60 -0.56 3.99 3.52 -0.64 -0.29 118.95 124.78 2wii s ARG 1526Ca 0.25 -0.70 -0.27 0.00 -0.13 0.00 0.00 55.73 54.87 2wii s ARG 1526Cb -0.09 -2.16 -0.01 0.00 -1.56 0.00 0.00 34.95 31.14 2wii s ARG 1526CO 0.15 -0.05 1.68 -1.17 -0.81 0.00 0.00 175.30 175.10 2wii s LEU 1527N 0.93 3.35 -0.02 -0.88 2.96 0.18 -0.65 118.68 124.55 2wii s LEU 1527Ca -0.06 0.42 -0.21 0.00 -0.22 0.00 0.00 54.13 54.06 2wii s LEU 1527Cb -0.15 -2.85 -0.26 0.00 0.50 0.00 0.00 46.19 43.43 2wii s LEU 1527CO -0.02 -2.03 1.01 0.58 -1.32 0.00 0.00 176.35 174.57 2wii h VAL 1528N 6.66 1.48 -3.14 1.68 2.07 -1.55 -0.63 116.25 122.82 2wii h VAL 1528Ca -0.28 -2.22 -0.14 0.00 0.82 0.00 0.00 66.70 64.89 2wii h VAL 1528Cb 1.13 2.84 -0.22 0.00 -1.52 0.00 0.00 31.29 33.53 2wii h VAL 1528CO 1.18 0.63 -0.36 -0.75 0.02 0.00 0.00 177.57 178.30 2wii s LYS 1529N -2.91 0.52 -0.26 1.57 2.20 -1.16 -4.72 119.74 114.98 2wii s LYS 1529Ca -0.14 -0.04 0.00 0.00 -0.36 0.00 0.00 55.97 55.44 2wii s LYS 1529Cb 0.02 0.23 0.04 0.00 -1.51 0.00 0.00 37.83 36.61 2wii s LYS 1529CO 0.81 -0.12 -0.08 0.08 -0.36 0.00 0.00 175.35 175.68 2wii s VAL 1530N -0.84 2.57 -0.61 4.02 1.01 -1.26 -1.03 120.40 124.25 2wii s VAL 1530Ca -0.09 -1.31 -0.10 0.00 0.00 0.00 0.00 61.98 60.48 2wii s VAL 1530Cb -0.05 -2.39 0.16 0.00 0.00 0.00 0.00 36.38 34.10 2wii s VAL 1530CO 0.02 0.09 0.51 -1.10 0.00 0.00 0.00 175.10 174.62 2wii s GLN 1531N 1.23 2.88 0.45 2.72 -0.21 0.39 -5.01 119.66 122.10 2wii s GLN 1531Ca -0.04 -2.12 -0.22 0.00 0.02 0.00 0.00 55.36 53.00 2wii s GLN 1531Cb -0.18 -4.07 -0.09 0.00 1.00 0.00 0.00 33.01 29.67 2wii s GLN 1531CO -0.05 -1.24 1.04 -0.51 -2.12 0.00 0.00 175.29 172.42 2wii s LEU 1532N 0.75 3.98 0.32 2.90 1.43 -1.26 -1.08 118.68 125.72 2wii s LEU 1532Ca 0.11 1.96 0.03 0.00 -1.03 0.00 0.00 54.13 55.21 2wii s LEU 1532Cb -0.21 -4.40 -0.02 0.00 0.03 0.00 0.00 46.19 41.59 2wii s LEU 1532CO -0.03 -0.64 0.34 -0.55 0.23 0.00 0.00 176.35 175.70 2wii s SER 1533N -1.81 1.29 0.25 2.29 0.15 -1.24 -4.93 113.70 109.70 2wii s SER 1533Ca 0.63 -1.63 0.11 0.00 0.70 0.00 0.00 55.95 55.76 2wii s SER 1533Cb -0.18 0.58 0.27 0.00 -1.71 0.00 0.00 66.02 64.97 2wii s SER 1533CO 0.23 -1.13 1.55 -0.55 1.20 0.00 0.00 173.24 174.54 2wii h ASN 1534N 2.17 0.00 0.00 5.45 -1.07 -1.92 -3.40 115.58 116.80 2wii h ASN 1534Ca -0.27 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 56.07 2wii h ASN 1534Cb 1.24 0.00 -0.00 0.00 -2.07 0.00 0.00 38.32 37.48 2wii h ASN 1534CO 0.38 0.66 -1.11 0.47 0.07 0.00 0.00 177.43 177.91 2wii n ASP 1535N -3.65 1.39 -4.03 6.14 8.00 -1.26 -4.86 116.55 118.27 2wii n ASP 1535Ca -0.01 0.01 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 2wii n ASP 1535Cb 0.67 -0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 41.56 2wii n ASP 1535CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2wii s PHE 1536N -2.04 1.31 -0.13 1.24 0.40 -1.26 -1.76 117.98 115.75 2wii s PHE 1536Ca -0.03 -0.41 -0.12 0.00 -0.60 0.00 0.00 56.93 55.77 2wii s PHE 1536Cb 0.01 -0.94 -0.05 0.00 0.51 0.00 0.00 43.02 42.55 2wii s PHE 1536CO 0.04 -0.19 0.27 -0.51 0.70 0.00 0.00 175.22 175.53 2wii s ASP 1537N 0.39 6.48 -0.19 1.36 1.01 0.12 -3.70 116.67 122.13 2wii s ASP 1537Ca -0.08 0.56 -0.06 0.00 0.71 0.00 0.00 52.55 53.68 2wii s ASP 1537Cb -0.12 -2.17 -0.03 0.00 1.01 0.00 0.00 42.92 41.61 2wii s ASP 1537CO 0.02 0.20 0.03 -1.61 0.21 0.00 0.00 175.17 174.02 2wii s GLU 1538N -0.08 3.80 -0.33 8.23 2.02 -0.24 -2.15 118.70 129.95 2wii s GLU 1538Ca 0.17 -0.44 -0.01 0.00 0.02 0.00 0.00 54.97 54.71 2wii s GLU 1538Cb -0.13 -3.12 0.07 0.00 0.10 0.00 0.00 34.13 31.04 2wii s GLU 1538CO 0.05 0.17 0.05 0.71 0.02 0.00 0.00 175.26 176.26 2wii s TYR 1539N 0.62 3.39 -0.73 1.61 1.51 0.14 -0.46 117.35 123.42 2wii s TYR 1539Ca 0.01 -2.13 -0.27 0.00 -1.01 0.00 0.00 57.07 53.68 2wii s TYR 1539Cb -0.14 -2.44 0.02 0.00 -0.11 0.00 0.00 41.96 39.29 2wii s TYR 1539CO 0.02 -0.86 1.45 0.42 -1.11 0.00 0.00 175.55 175.47 2wii s ILE 1540N 1.19 3.64 -0.03 2.71 1.09 -0.20 -0.49 121.20 129.11 2wii s ILE 1540Ca -0.01 0.26 -0.16 0.00 -1.10 0.00 0.00 60.65 59.64 2wii s ILE 1540Cb -0.20 -4.67 -0.05 0.00 -1.06 0.00 0.00 42.46 36.47 2wii s ILE 1540CO -0.03 -1.61 0.44 -0.04 -0.10 0.00 0.00 174.94 173.60 2wii s MET 1541N 6.04 4.08 -0.29 2.79 -1.94 0.47 -1.36 119.30 129.09 2wii s MET 1541Ca 0.44 0.45 -0.11 0.00 -1.71 0.00 0.00 55.69 54.76 2wii s MET 1541Cb -0.09 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.42 2wii s MET 1541CO 0.14 0.52 0.21 0.00 -0.01 0.00 0.00 175.02 175.89 2wii s ALA 1542N -0.57 3.53 -0.60 3.03 0.00 0.18 -0.80 121.76 126.53 2wii s ALA 1542Ca 0.25 -1.11 -0.27 0.00 0.00 0.00 0.00 51.96 50.83 2wii s ALA 1542Cb -0.16 -2.52 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 2wii s ALA 1542CO 0.13 -0.61 1.78 0.42 0.00 0.00 0.00 175.76 177.48 2wii s ILE 1543N 1.78 3.42 0.07 0.00 -1.09 -0.70 -1.62 121.20 123.05 2wii s ILE 1543Ca 0.07 0.26 0.02 0.00 -2.23 0.00 0.00 60.65 58.78 2wii s ILE 1543Cb -0.16 -4.04 -0.25 0.00 -1.58 0.00 0.00 42.46 36.43 2wii s ILE 1543CO 0.11 -0.98 1.11 -0.33 -1.23 0.00 0.00 174.94 173.62 2wii h GLU 1544N 14.19 0.14 -2.79 2.79 5.08 -1.41 -1.78 114.58 130.80 2wii h GLU 1544Ca -0.27 -0.23 -0.13 0.00 -1.00 0.00 0.00 59.36 57.73 2wii h GLU 1544Cb 1.15 0.09 -0.25 0.00 0.50 0.00 0.00 28.75 30.23 2wii h GLU 1544CO 1.21 1.06 -0.29 -1.14 -1.00 0.00 0.00 179.01 178.85 2wii s GLN 1545N -2.67 0.42 -0.99 2.33 0.74 -1.05 -4.78 119.66 113.66 2wii s GLN 1545Ca -0.03 0.59 -0.12 0.00 0.05 0.00 0.00 55.36 55.85 2wii s GLN 1545Cb 0.08 0.14 0.23 0.00 1.10 0.00 0.00 33.01 34.57 2wii s GLN 1545CO 0.85 -0.08 1.01 0.99 -0.55 0.00 0.00 175.29 177.50 2wii s THR 1546N 0.53 5.64 0.18 -0.34 2.01 -1.26 -1.56 115.64 120.84 2wii s THR 1546Ca -0.03 -2.80 -0.12 0.00 0.31 0.00 0.00 61.69 59.05 2wii s THR 1546Cb -0.04 -4.60 0.09 0.00 0.01 0.00 0.00 72.50 67.96 2wii s THR 1546CO -0.03 -1.20 1.78 0.40 -0.69 0.00 0.00 174.62 174.88 2wii h ILE 1547N 4.40 1.20 -2.62 1.82 2.04 -1.53 -3.43 117.51 119.40 2wii h ILE 1547Ca 0.16 -0.54 -0.11 0.00 1.00 0.00 0.00 64.86 65.36 2wii h ILE 1547Cb 0.95 0.45 -0.27 0.00 -0.74 0.00 0.00 36.82 37.21 2wii h ILE 1547CO 0.94 0.23 -0.32 -0.75 0.00 0.00 0.00 178.15 178.25 2wii s LYS 1548N -5.79 0.37 0.11 2.37 2.20 -0.21 -4.57 119.74 114.22 2wii s LYS 1548Ca -0.13 0.84 0.10 0.00 -0.36 0.00 0.00 55.97 56.42 2wii s LYS 1548Cb 0.13 0.05 -0.04 0.00 -1.51 0.00 0.00 37.83 36.46 2wii s LYS 1548CO 0.78 -0.18 -0.24 -1.54 -0.36 0.00 0.00 175.35 173.81 2wii s SER 1549N 1.69 3.49 0.00 1.43 1.04 -1.26 0.09 113.70 120.18 2wii s SER 1549Ca -0.08 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2wii s SER 1549Cb -0.09 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.68 2wii s SER 1549CO -0.13 0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.90 2wii n GLY 1550N 1.06 3.10 0.18 7.32 0.00 -1.17 -4.93 105.19 110.74 2wii n GLY 1550Ca -0.17 -0.34 -0.05 0.00 0.00 0.00 0.00 46.02 45.46 2wii n GLY 1550CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2wii h SER 1551N 0.00 0.26 -2.94 1.61 0.02 -1.99 -3.37 113.55 107.14 2wii h SER 1551Ca 0.00 0.03 -0.58 0.00 -0.84 0.00 0.00 61.79 60.40 2wii h SER 1551Cb 0.00 -0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.42 2wii h SER 1551CO 0.00 0.19 0.78 -0.62 -1.14 0.00 0.00 176.83 176.05 2wii s ASP 1552N -5.43 6.31 -1.49 3.07 2.15 -1.26 -4.93 116.67 115.08 2wii s ASP 1552Ca -0.13 -0.34 -0.12 0.00 0.43 0.00 0.00 52.55 52.39 2wii s ASP 1552Cb 0.13 -2.49 0.01 0.00 -0.30 0.00 0.00 42.92 40.27 2wii s ASP 1552CO 0.72 -1.46 2.43 -0.62 -0.17 0.00 0.00 175.17 176.07 2wii n GLU 1553N 8.18 3.19 -2.93 4.34 1.02 -1.26 -4.94 120.64 128.24 2wii n GLU 1553Ca 0.03 -2.57 -0.40 0.00 -0.02 0.00 0.00 57.16 54.20 2wii n GLU 1553Cb 0.48 -3.11 -0.05 0.00 -0.02 0.00 0.00 31.44 28.74 2wii n GLU 1553CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2wii s VAL 1554N 2.60 4.70 0.42 2.62 0.11 -1.26 -5.06 120.40 124.53 2wii s VAL 1554Ca 0.53 1.72 0.01 0.00 -2.93 0.00 0.00 61.98 61.31 2wii s VAL 1554Cb 0.15 -4.16 -0.01 0.00 -1.53 0.00 0.00 36.38 30.83 2wii s VAL 1554CO -0.08 0.35 0.63 -1.10 -3.33 0.00 0.00 175.10 171.57 2wii s GLN 1555N 0.01 3.18 0.08 1.54 -1.52 -1.26 -4.97 119.66 116.71 2wii s GLN 1555Ca 0.40 -0.47 -0.31 0.00 -1.95 0.00 0.00 55.36 53.04 2wii s GLN 1555Cb -0.21 -2.60 -0.07 0.00 -0.22 0.00 0.00 33.01 29.91 2wii s GLN 1555CO 0.24 -0.15 1.42 0.08 -0.25 0.00 0.00 175.29 176.63 2wii s VAL 1556N -2.48 3.40 0.00 1.09 1.01 -1.26 -2.59 120.40 119.57 2wii s VAL 1556Ca 0.46 0.94 0.00 0.00 0.00 0.00 0.00 61.98 63.38 2wii s VAL 1556Cb -0.10 -3.60 0.00 0.00 0.00 0.00 0.00 36.38 32.68 2wii s VAL 1556CO 0.37 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.12 2wii n GLY 1557N 3.59 2.39 3.89 4.51 0.00 -0.67 -5.06 105.19 113.84 2wii n GLY 1557Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 2wii n GLY 1557CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wii s GLN 1558N -0.63 2.67 -0.02 1.61 -0.21 -1.07 -4.84 119.66 117.18 2wii s GLN 1558Ca 0.00 0.38 0.07 0.00 0.02 0.00 0.00 55.36 55.83 2wii s GLN 1558Cb 0.00 -2.01 -0.02 0.00 1.00 0.00 0.00 33.01 31.98 2wii s GLN 1558CO 0.00 -1.15 -0.23 -0.65 -2.12 0.00 0.00 175.29 171.14 2wii s GLN 1559N -5.40 1.93 0.02 2.91 -0.21 -1.26 -1.72 119.66 115.93 2wii s GLN 1559Ca 0.59 -0.83 0.07 0.00 0.02 0.00 0.00 55.36 55.21 2wii s GLN 1559Cb -0.11 -1.84 -0.02 0.00 1.00 0.00 0.00 33.01 32.04 2wii s GLN 1559CO 0.51 0.48 -0.20 1.03 -2.12 0.00 0.00 175.29 175.00 2wii s ARG 1560N -0.49 1.40 -0.26 2.91 1.81 0.02 -4.98 118.95 119.36 2wii s ARG 1560Ca 0.07 -0.84 -0.13 0.00 -1.72 0.00 0.00 55.73 53.11 2wii s ARG 1560Cb -0.09 -1.45 -0.04 0.00 -0.45 0.00 0.00 34.95 32.91 2wii s ARG 1560CO -0.00 0.38 0.28 0.99 -0.68 0.00 0.00 175.30 176.27 2wii s THR 1561N -0.69 5.25 -0.18 0.02 2.01 -1.26 -0.40 115.64 120.40 2wii s THR 1561Ca 0.07 0.40 -0.09 0.00 0.31 0.00 0.00 61.69 62.38 2wii s THR 1561Cb -0.08 -3.62 -0.05 0.00 0.01 0.00 0.00 72.50 68.76 2wii s THR 1561CO 0.01 0.24 0.13 -0.36 -0.69 0.00 0.00 174.62 173.94 2wii s PHE 1562N 1.66 3.45 0.08 4.92 0.08 0.36 -0.87 117.98 127.65 2wii s PHE 1562Ca 0.12 0.37 0.07 0.00 0.12 0.00 0.00 56.93 57.61 2wii s PHE 1562Cb -0.15 -2.10 -0.04 0.00 -0.57 0.00 0.00 43.02 40.16 2wii s PHE 1562CO 0.09 0.39 -0.16 0.42 -0.10 0.00 0.00 175.22 175.86 2wii s ILE 1563N 0.02 2.98 -0.20 0.64 1.01 0.15 0.25 121.20 126.05 2wii s ILE 1563Ca 0.10 -1.29 -0.27 0.00 0.00 0.00 0.00 60.65 59.19 2wii s ILE 1563Cb -0.11 -2.33 0.08 0.00 0.01 0.00 0.00 42.46 40.11 2wii s ILE 1563CO -0.00 0.21 0.76 -0.55 0.00 0.00 0.00 174.94 175.35 2wii s SER 1564N -1.84 -0.67 0.62 3.58 0.15 -0.91 -0.82 113.70 113.81 2wii s SER 1564Ca 0.17 1.13 -0.18 0.00 0.70 0.00 0.00 55.95 57.77 2wii s SER 1564Cb -0.11 1.09 -0.03 0.00 -1.71 0.00 0.00 66.02 65.26 2wii s SER 1564CO 0.09 -0.35 1.18 -0.81 1.20 0.00 0.00 173.24 174.56 2wii n PRO 1565N 2.04 1.09 0.00 5.44 -0.04 -1.26 -0.71 135.00 141.56 2wii n PRO 1565Ca -0.15 0.42 0.15 0.00 -0.04 0.00 0.00 63.50 63.88 2wii n PRO 1565Cb 0.56 -2.41 0.60 0.00 -0.04 0.00 0.00 33.50 32.22 2wii n PRO 1565CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2wii h ILE 1566N 0.59 0.84 0.00 0.52 3.07 -1.68 -0.76 117.51 120.10 2wii h ILE 1566Ca -0.50 -0.06 0.00 0.00 1.55 0.00 0.00 64.86 65.85 2wii h ILE 1566Cb 1.35 0.65 0.00 0.00 -0.27 0.00 0.00 36.82 38.55 2wii h ILE 1566CO 0.53 0.03 0.00 0.07 -1.05 0.00 0.00 178.15 177.73 2wii h LYS 1567N 0.17 0.00 -0.01 0.16 2.10 -1.90 -0.85 116.57 116.24 2wii h LYS 1567Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 2wii h LYS 1567Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 2wii h LYS 1567CO -0.03 0.00 -0.54 0.00 -2.00 0.00 0.00 179.45 176.88 2wii h ARG 1569N 1.59 0.98 0.00 0.00 2.43 -1.22 0.39 114.38 118.55 2wii h ARG 1569Ca 0.00 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.02 2wii h ARG 1569Cb 0.61 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 2wii h ARG 1569CO 0.00 0.65 -0.45 1.49 -1.51 0.00 0.00 179.97 180.14 2wii h GLU 1570N 1.01 0.00 0.20 0.20 4.81 -1.78 -2.40 114.58 116.61 2wii h GLU 1570Ca 0.38 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 59.29 2wii h GLU 1570Cb 0.16 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.56 2wii h GLU 1570CO -0.17 0.45 -1.48 0.00 -0.73 0.00 0.00 179.01 177.08 2wii h ALA 1571N 1.55 -0.00 -0.16 2.92 0.00 -1.61 -3.36 119.26 118.60 2wii h ALA 1571Ca -0.00 -0.97 -0.04 0.00 0.00 0.00 0.00 54.91 53.90 2wii h ALA 1571Cb 1.00 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.09 2wii h ALA 1571CO 0.06 0.78 -0.06 -0.07 0.00 0.00 0.00 179.25 179.96 2wii h LEU 1572N 0.00 0.33 -2.11 0.00 3.38 -0.98 -3.48 115.31 112.45 2wii h LEU 1572Ca -0.28 -0.40 -0.39 0.00 0.09 0.00 0.00 57.88 56.90 2wii h LEU 1572Cb 2.03 -0.09 0.08 0.00 0.09 0.00 0.00 40.66 42.77 2wii h LEU 1572CO 0.20 0.65 -0.85 0.29 0.09 0.00 0.00 178.44 178.82 2wii n LYS 1573N -4.65 -4.00 -3.08 1.13 5.02 -0.91 -4.96 118.16 106.72 2wii n LYS 1573Ca -0.06 0.63 -0.39 0.00 -2.02 0.00 0.00 58.31 56.48 2wii n LYS 1573Cb 0.29 -5.11 -0.05 0.00 -0.02 0.00 0.00 35.03 30.13 2wii n LYS 1573CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2wii s LEU 1574N -6.45 4.43 0.05 -0.35 1.43 -1.26 -5.07 118.68 111.45 2wii s LEU 1574Ca 0.14 1.31 0.07 0.00 -1.03 0.00 0.00 54.13 54.62 2wii s LEU 1574Cb -0.04 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 2wii s LEU 1574CO 0.81 0.04 -0.19 -1.61 0.23 0.00 0.00 176.35 175.63 2wii s GLU 1575N -0.06 1.26 0.73 1.70 2.02 -1.26 -5.07 118.70 118.03 2wii s GLU 1575Ca 0.35 -0.91 -0.14 0.00 0.02 0.00 0.00 54.97 54.29 2wii s GLU 1575Cb -0.19 -1.37 0.04 0.00 0.10 0.00 0.00 34.13 32.71 2wii s GLU 1575CO 0.20 0.34 1.18 -1.21 0.02 0.00 0.00 175.26 175.79 2wii s GLU 1576N -1.22 2.17 0.00 1.61 2.02 -1.26 -2.79 118.70 119.23 2wii s GLU 1576Ca 0.06 1.64 0.00 0.00 0.02 0.00 0.00 54.97 56.69 2wii s GLU 1576Cb -0.09 -1.85 0.00 0.00 0.10 0.00 0.00 34.13 32.29 2wii s GLU 1576CO 0.02 -1.79 0.00 1.63 0.02 0.00 0.00 175.26 175.14 2wii n LYS 1577N -2.83 -0.12 -3.95 1.61 5.02 -0.24 -4.99 118.16 112.66 2wii n LYS 1577Ca 0.12 0.03 -0.31 0.00 -2.02 0.00 0.00 58.31 56.13 2wii n LYS 1577Cb 0.51 -3.30 -0.05 0.00 -0.02 0.00 0.00 35.03 32.17 2wii n LYS 1577CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2wii s LYS 1578N -0.42 3.31 0.09 1.97 3.01 -1.12 -4.89 119.74 121.69 2wii s LYS 1578Ca 0.00 -0.48 0.02 0.00 -1.01 0.00 0.00 55.97 54.50 2wii s LYS 1578Cb 0.00 -2.98 -0.04 0.00 -1.01 0.00 0.00 37.83 33.80 2wii s LYS 1578CO 0.00 0.61 0.15 -1.01 0.51 0.00 0.00 175.35 175.61 2wii s HIS 1579N -1.45 3.34 -0.03 3.18 3.76 -1.26 -0.65 115.29 122.17 2wii s HIS 1579Ca 0.33 0.14 -0.08 0.00 -0.15 0.00 0.00 55.06 55.29 2wii s HIS 1579Cb -0.13 -1.67 0.01 0.00 1.11 0.00 0.00 32.58 31.91 2wii s HIS 1579CO 0.25 0.55 0.19 0.71 -0.85 0.00 0.00 174.74 175.59 2wii s TYR 1580N -1.50 -0.10 -0.40 1.40 2.02 0.60 -0.36 117.35 119.01 2wii s TYR 1580Ca 0.32 0.20 -0.18 0.00 -0.37 0.00 0.00 57.07 57.05 2wii s TYR 1580Cb -0.12 0.02 0.01 0.00 -0.40 0.00 0.00 41.96 41.47 2wii s TYR 1580CO 0.25 -0.23 0.47 -1.17 -1.57 0.00 0.00 175.55 173.30 2wii s LEU 1581N -0.79 4.64 -0.04 -1.29 2.96 0.11 -0.82 118.68 123.44 2wii s LEU 1581Ca -0.09 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.45 2wii s LEU 1581Cb -0.05 -2.47 -0.01 0.00 0.50 0.00 0.00 46.19 44.15 2wii s LEU 1581CO 0.01 -0.56 -0.23 -0.04 -1.32 0.00 0.00 176.35 174.22 2wii s MET 1582N 2.28 2.18 0.02 1.98 -1.94 -0.66 -1.88 119.30 121.28 2wii s MET 1582Ca 0.15 -0.83 -0.16 0.00 -1.71 0.00 0.00 55.69 53.14 2wii s MET 1582Cb -0.16 -1.93 0.03 0.00 2.01 0.00 0.00 34.83 34.77 2wii s MET 1582CO 0.14 0.40 0.35 1.67 -0.01 0.00 0.00 175.02 177.57 2wii s TRP 1583N -0.26 -0.20 0.00 -0.03 -2.14 -0.95 -0.56 118.94 114.81 2wii s TRP 1583Ca 0.01 0.19 0.00 0.00 2.66 0.00 0.00 56.10 58.96 2wii s TRP 1583Cb -0.12 0.14 0.00 0.00 -3.10 0.00 0.00 33.47 30.40 2wii s TRP 1583CO 0.02 -0.49 0.00 0.41 -2.66 0.00 0.00 176.95 174.23 2wii n GLY 1584N 0.81 1.89 3.98 3.67 0.00 -1.13 -0.06 105.19 114.35 2wii n GLY 1584Ca -0.20 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.62 2wii n GLY 1584CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wii s LEU 1585N 0.00 3.10 0.37 0.99 1.43 -1.26 -1.29 118.68 122.02 2wii s LEU 1585Ca 0.00 -0.11 0.20 0.00 -1.03 0.00 0.00 54.13 53.19 2wii s LEU 1585Cb 0.00 -2.53 0.46 0.00 0.03 0.00 0.00 46.19 44.15 2wii s LEU 1585CO 0.00 -1.49 1.63 0.77 0.23 0.00 0.00 176.35 177.48 2wii h SER 1586N -0.25 0.00 0.52 2.29 4.64 -1.95 -3.06 113.55 115.74 2wii h SER 1586Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 2wii h SER 1586Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2wii h SER 1586CO 0.48 0.32 0.00 -1.54 -0.87 0.00 0.00 176.83 175.22 2wii n SER 1587N -3.27 0.24 0.19 4.97 3.41 -1.26 -2.34 113.62 115.55 2wii n SER 1587Ca 0.02 0.56 0.06 0.00 -0.26 0.00 0.00 58.87 59.25 2wii n SER 1587Cb 0.58 -0.61 0.31 0.00 -0.26 0.00 0.00 64.21 64.22 2wii n SER 1587CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2wii h ASP 1588N 0.00 0.00 -3.47 4.04 5.19 -1.83 -3.46 116.42 116.89 2wii h ASP 1588Ca 0.00 0.00 -0.57 0.00 -0.62 0.00 0.00 57.03 55.84 2wii h ASP 1588Cb 0.26 0.00 0.14 0.00 0.18 0.00 0.00 39.33 39.91 2wii h ASP 1588CO 0.00 0.36 0.28 0.49 -3.12 0.00 0.00 179.24 177.26 2wii n PHE 1589N -3.44 1.42 -3.79 4.55 3.72 -0.99 -1.14 117.46 117.79 2wii n PHE 1589Ca 0.00 0.49 -0.14 0.00 -0.05 0.00 0.00 57.45 57.75 2wii n PHE 1589Cb 0.53 -2.25 -0.15 0.00 -0.94 0.00 0.00 39.48 36.67 2wii n PHE 1589CO 0.00 0.00 0.00 -0.46 -0.05 0.00 0.00 176.76 176.25 2wii s TRP 1590N -1.34 -0.03 0.00 1.38 -0.11 0.24 -4.84 118.94 114.24 2wii s TRP 1590Ca 0.68 0.20 0.00 0.00 1.22 0.00 0.00 56.10 58.20 2wii s TRP 1590Cb -0.48 -0.14 0.00 0.00 -1.50 0.00 0.00 33.47 31.35 2wii s TRP 1590CO 0.53 -0.09 0.00 0.41 -4.62 0.00 0.00 176.95 173.18 2wii n GLY 1591N 3.90 -1.69 3.76 5.86 0.00 -1.26 -0.01 105.19 115.76 2wii n GLY 1591Ca -0.24 -1.47 -0.26 0.00 0.00 0.00 0.00 46.02 44.06 2wii n GLY 1591CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2wii s GLU 1592N 0.00 2.23 0.20 1.61 0.41 -1.26 -4.85 118.70 117.03 2wii s GLU 1592Ca 0.00 -1.92 -0.22 0.00 -0.41 0.00 0.00 54.97 52.42 2wii s GLU 1592Cb 0.00 -1.96 0.13 0.00 -1.78 0.00 0.00 34.13 30.52 2wii s GLU 1592CO 0.00 -0.20 1.55 -0.22 -0.49 0.00 0.00 175.26 175.90 2wii h LYS 1593N 1.33 -0.03 -0.99 1.61 3.64 -1.96 0.43 116.57 120.59 2wii h LYS 1593Ca -0.42 0.00 0.17 0.00 -1.27 0.00 0.00 60.65 59.13 2wii h LYS 1593Cb 1.26 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 33.00 2wii h LYS 1593CO 0.69 -0.02 0.62 -1.35 -2.27 0.00 0.00 179.45 177.11 2wii h PRO 1594N -0.03 0.78 -0.66 1.90 0.11 -2.01 -2.79 132.00 129.30 2wii h PRO 1594Ca 0.27 -0.05 -0.43 0.00 0.11 0.00 0.00 66.00 65.90 2wii h PRO 1594Cb 0.54 -0.18 -0.42 0.00 0.11 0.00 0.00 31.00 31.06 2wii h PRO 1594CO -0.93 0.52 -0.94 0.09 -0.21 0.00 0.00 178.00 176.53 2wii n ASN 1595N -4.68 3.60 -4.70 -2.05 4.13 -0.43 -5.08 115.26 106.04 2wii n ASN 1595Ca 0.21 -3.08 -0.42 0.00 1.68 0.00 0.00 54.58 52.97 2wii n ASN 1595Cb 0.51 -0.40 -0.03 0.00 -1.54 0.00 0.00 39.78 38.32 2wii n ASN 1595CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2wii s LEU 1596N -3.67 4.39 0.42 3.41 2.96 0.14 -4.53 118.68 121.80 2wii s LEU 1596Ca 0.41 2.75 0.07 0.00 -0.22 0.00 0.00 54.13 57.14 2wii s LEU 1596Cb 0.38 -3.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.43 2wii s LEU 1596CO 0.00 -0.97 0.12 -0.44 -1.32 0.00 0.00 176.35 173.74 2wii s SER 1597N 2.19 4.24 -0.02 3.68 0.01 0.99 -4.61 113.70 120.18 2wii s SER 1597Ca 0.78 -1.20 0.07 0.00 1.31 0.00 0.00 55.95 56.91 2wii s SER 1597Cb -0.46 -0.39 -0.02 0.00 0.21 0.00 0.00 66.02 65.36 2wii s SER 1597CO 0.34 -0.54 -0.23 -0.31 0.41 0.00 0.00 173.24 172.91 2wii s TYR 1598N -2.65 2.42 -0.27 2.43 1.51 -0.05 -0.59 117.35 120.14 2wii s TYR 1598Ca 0.37 -0.37 -0.03 0.00 -1.01 0.00 0.00 57.07 56.03 2wii s TYR 1598Cb 0.06 -1.51 0.03 0.00 -0.11 0.00 0.00 41.96 40.42 2wii s TYR 1598CO 0.20 0.04 -0.00 0.42 -1.11 0.00 0.00 175.55 175.10 2wii s ILE 1599N -0.67 3.25 -0.43 2.71 1.01 -0.29 0.30 121.20 127.07 2wii s ILE 1599Ca 0.11 -0.99 -0.28 0.00 0.00 0.00 0.00 60.65 59.49 2wii s ILE 1599Cb -0.10 -2.70 -0.03 0.00 0.01 0.00 0.00 42.46 39.64 2wii s ILE 1599CO -0.00 0.10 1.89 -0.63 0.00 0.00 0.00 174.94 176.30 2wii s ILE 1600N 1.37 3.37 0.16 2.92 1.01 0.00 -4.75 121.20 125.28 2wii s ILE 1600Ca -0.00 0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.99 2wii s ILE 1600Cb -0.17 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.66 2wii s ILE 1600CO -0.02 -0.51 0.12 0.61 0.00 0.00 0.00 174.94 175.14 2wii n GLY 1601N 5.58 2.98 0.29 6.18 0.00 -1.25 -4.80 105.19 114.16 2wii n GLY 1601Ca 0.24 -2.21 0.14 0.00 0.00 0.00 0.00 46.02 44.19 2wii n GLY 1601CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2wii h LYS 1602N 0.00 0.00 -0.21 1.61 2.10 -1.59 -1.61 116.57 116.87 2wii h LYS 1602Ca -0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.55 2wii h LYS 1602Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 2wii h LYS 1602CO 0.16 0.04 0.00 -0.25 -2.00 0.00 0.00 179.45 177.40 2wii n ASP 1603N -3.82 2.77 -4.71 7.07 8.00 -1.26 -2.62 116.55 121.99 2wii n ASP 1603Ca -0.03 -1.89 -0.41 0.00 0.71 0.00 0.00 54.79 53.18 2wii n ASP 1603Cb 0.13 -0.13 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2wii n ASP 1603CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2wii s THR 1604N -1.74 4.96 -0.31 -3.53 2.01 -0.61 -4.60 115.64 111.82 2wii s THR 1604Ca 0.34 1.72 -0.16 0.00 0.31 0.00 0.00 61.69 63.90 2wii s THR 1604Cb 0.21 -4.17 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 2wii s THR 1604CO 0.30 0.20 0.44 0.86 -0.69 0.00 0.00 174.62 175.73 2wii s TRP 1605N 0.98 3.22 -0.38 4.92 -0.11 0.92 -1.80 118.94 126.68 2wii s TRP 1605Ca 0.44 0.27 0.02 0.00 1.22 0.00 0.00 56.10 58.05 2wii s TRP 1605Cb -0.19 -2.73 0.11 0.00 -1.50 0.00 0.00 33.47 29.16 2wii s TRP 1605CO 0.22 -0.38 0.14 0.08 -4.62 0.00 0.00 176.95 172.38 2wii s VAL 1606N 2.20 1.70 -0.14 5.86 1.01 -1.26 -2.24 120.40 127.53 2wii s VAL 1606Ca 0.16 -2.25 -0.01 0.00 0.00 0.00 0.00 61.98 59.88 2wii s VAL 1606Cb -0.16 -2.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.97 2wii s VAL 1606CO 0.11 -0.72 -0.10 -0.70 0.00 0.00 0.00 175.10 173.69 2wii s GLU 1607N 0.82 3.49 0.10 2.72 2.12 -0.79 -4.97 118.70 122.18 2wii s GLU 1607Ca 0.13 -0.63 -0.31 0.00 0.36 0.00 0.00 54.97 54.52 2wii s GLU 1607Cb -0.21 -2.73 -0.08 0.00 0.26 0.00 0.00 34.13 31.37 2wii s GLU 1607CO -0.10 0.22 1.51 -1.58 -0.54 0.00 0.00 175.26 174.77 2wii s HIS 1608N 0.35 2.92 -0.42 5.30 5.65 -1.26 0.04 115.29 127.87 2wii s HIS 1608Ca -0.09 0.68 -0.15 0.00 0.25 0.00 0.00 55.06 55.75 2wii s HIS 1608Cb -0.15 -3.82 0.02 0.00 -1.18 0.00 0.00 32.58 27.45 2wii s HIS 1608CO 0.05 -3.05 0.32 -0.46 -0.65 0.00 0.00 174.74 170.94 2wii s TRP 1609N 1.73 3.24 0.35 3.88 -0.11 0.51 -4.83 118.94 123.71 2wii s TRP 1609Ca 0.68 -0.60 -0.28 0.00 1.22 0.00 0.00 56.10 57.12 2wii s TRP 1609Cb -0.39 -2.65 -0.12 0.00 -1.50 0.00 0.00 33.47 28.81 2wii s TRP 1609CO 0.30 -0.61 1.35 -2.30 -4.62 0.00 0.00 176.95 171.07 2wii n PRO 1610N 5.19 2.29 -1.34 5.86 -0.02 -1.26 -4.15 135.00 141.57 2wii n PRO 1610Ca -0.11 0.80 -0.30 0.00 -2.02 0.00 0.00 63.50 61.88 2wii n PRO 1610Cb 0.47 -2.43 0.12 0.00 -0.02 0.00 0.00 33.50 31.64 2wii n PRO 1610CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2wii s GLU 1611N -1.93 1.51 0.55 -0.52 0.41 -1.26 -4.78 118.70 112.68 2wii s GLU 1611Ca 0.55 0.73 0.23 0.00 -0.41 0.00 0.00 54.97 56.07 2wii s GLU 1611Cb -0.54 -1.85 1.47 0.00 -1.78 0.00 0.00 34.13 31.43 2wii s GLU 1611CO 0.63 -2.04 2.12 1.49 -0.49 0.00 0.00 175.26 176.96 2wii h GLU 1612N -1.40 0.00 -0.01 1.61 4.81 -1.99 -1.11 114.58 116.49 2wii h GLU 1612Ca -0.49 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 2wii h GLU 1612Cb 1.28 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.66 2wii h GLU 1612CO 0.57 0.00 0.01 -0.44 -0.73 0.00 0.00 179.01 178.41 2wii h ASP 1613N 0.00 0.02 0.84 1.04 3.32 -2.02 -3.09 116.42 116.52 2wii h ASP 1613Ca 0.08 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 56.86 2wii h ASP 1613Cb 0.35 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 2wii h ASP 1613CO -0.00 0.12 -0.76 -0.33 -1.72 0.00 0.00 179.24 176.55 2wii h GLU 1614N -0.08 0.00 0.00 3.56 5.08 -1.72 -3.19 114.58 118.22 2wii h GLU 1614Ca 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2wii h GLU 1614Cb 0.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 2wii h GLU 1614CO -0.00 0.76 -0.07 0.00 -1.00 0.00 0.00 179.01 178.69 2wii h GLN 1616N 0.00 0.00 -6.77 0.00 1.08 -1.53 -3.38 115.11 104.51 2wii h GLN 1616Ca -0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 2wii h GLN 1616Cb 0.18 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 27.64 2wii h GLN 1616CO 0.01 0.11 0.58 -0.51 -0.95 0.00 0.00 178.83 178.07 2wii s ASP 1617N -5.99 7.00 0.46 1.46 1.01 -0.32 -4.93 116.67 115.36 2wii s ASP 1617Ca 0.02 2.42 0.19 0.00 0.71 0.00 0.00 52.55 55.89 2wii s ASP 1617Cb 0.09 -2.63 1.11 0.00 1.01 0.00 0.00 42.92 42.51 2wii s ASP 1617CO 0.60 -0.39 1.98 -0.08 0.21 0.00 0.00 175.17 177.49 2wii h GLU 1618N 4.36 0.00 0.00 8.23 4.81 -1.86 -2.12 114.58 128.00 2wii h GLU 1618Ca -0.46 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.65 2wii h GLU 1618Cb 1.22 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.58 2wii h GLU 1618CO 0.71 0.20 -0.54 1.05 -0.73 0.00 0.00 179.01 179.69 2wii h GLU 1619N 0.00 0.00 -0.01 1.92 9.09 -1.91 -3.02 114.58 120.65 2wii h GLU 1619Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2wii h GLU 1619Cb 0.41 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.51 2wii h GLU 1619CO 0.03 0.54 -0.43 0.09 0.05 0.00 0.00 179.01 179.29 2wii n ASN 1620N -3.72 1.06 -0.24 3.06 3.02 -0.85 -4.38 115.26 113.22 2wii n ASN 1620Ca -0.01 -0.85 -0.00 0.00 -0.03 0.00 0.00 54.58 53.69 2wii n ASN 1620Cb 0.58 0.31 0.11 0.00 -0.61 0.00 0.00 39.78 40.17 2wii n ASN 1620CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 2wii h GLN 1621N 1.00 0.65 -0.49 3.52 4.15 -1.29 -1.59 115.11 121.06 2wii h GLN 1621Ca 0.00 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.41 2wii h GLN 1621Cb 0.55 -0.15 -0.03 0.00 0.21 0.00 0.00 27.48 28.06 2wii h GLN 1621CO 0.00 0.43 0.28 -0.22 -1.93 0.00 0.00 178.83 177.39 2wii h LYS 1622N 0.67 0.55 -0.09 1.69 3.64 -1.77 -0.44 116.57 120.81 2wii h LYS 1622Ca 0.32 -0.03 -0.17 0.00 -1.27 0.00 0.00 60.65 59.49 2wii h LYS 1622Cb 0.25 -0.12 0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2wii h LYS 1622CO -0.21 0.36 -0.63 0.37 -2.27 0.00 0.00 179.45 177.07 2wii h GLN 1623N 0.57 0.58 -0.78 1.90 4.15 -1.79 -2.08 115.11 117.66 2wii h GLN 1623Ca 0.20 -0.51 -0.02 0.00 0.77 0.00 0.00 58.65 59.09 2wii h GLN 1623Cb 0.03 0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.80 2wii h GLN 1623CO -0.10 1.13 0.40 0.00 -1.93 0.00 0.00 178.83 178.34 2wii h GLN 1625N 1.09 0.64 -0.51 0.00 1.08 -1.12 -2.41 115.11 113.87 2wii h GLN 1625Ca 0.27 -0.58 -0.04 0.00 -1.45 0.00 0.00 58.65 56.85 2wii h GLN 1625Cb 0.06 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 27.61 2wii h GLN 1625CO -0.04 1.19 0.16 -0.44 -0.95 0.00 0.00 178.83 178.75 2wii h ASP 1626N 0.41 0.74 -0.47 1.46 3.32 -1.08 -0.30 116.42 120.51 2wii h ASP 1626Ca -0.07 -0.21 -0.05 0.00 0.02 0.00 0.00 57.03 56.72 2wii h ASP 1626Cb 1.47 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 40.80 2wii h ASP 1626CO 0.16 0.75 0.11 -0.07 -1.72 0.00 0.00 179.24 178.47 2wii h LEU 1627N 0.70 0.76 -0.29 1.55 3.38 -1.16 0.61 115.31 120.87 2wii h LEU 1627Ca 0.17 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 2wii h LEU 1627Cb 0.27 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2wii h LEU 1627CO -0.01 0.77 -0.14 1.23 0.09 0.00 0.00 178.44 180.38 2wii h GLY 1628N 0.97 0.66 1.83 0.83 0.00 -1.07 -1.62 103.07 104.65 2wii h GLY 1628Ca 0.17 -0.59 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 2wii h GLY 1628CO 0.00 0.54 -0.52 0.00 0.00 0.00 0.00 176.54 176.56 2wii h ALA 1629N 0.75 1.00 -0.58 3.60 0.00 -0.93 -2.19 119.26 120.91 2wii h ALA 1629Ca 0.06 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 2wii h ALA 1629Cb 0.66 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2wii h ALA 1629CO 0.04 0.67 0.11 0.35 0.00 0.00 0.00 179.25 180.42 2wii h PHE 1630N 0.15 1.01 -0.47 0.00 3.57 -0.77 -1.81 116.94 118.63 2wii h PHE 1630Ca 0.00 -0.13 -0.14 0.00 3.53 0.00 0.00 57.97 61.23 2wii h PHE 1630Cb 0.97 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.42 2wii h PHE 1630CO 0.01 0.87 -0.24 1.15 -2.23 0.00 0.00 178.31 177.88 2wii h THR 1631N 0.85 1.27 -0.59 4.41 2.02 -1.15 -2.60 112.91 117.12 2wii h THR 1631Ca 0.18 -1.40 -0.05 0.00 0.77 0.00 0.00 66.41 65.91 2wii h THR 1631Cb 0.40 1.16 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 2wii h THR 1631CO 0.01 0.48 0.18 -0.33 0.37 0.00 0.00 175.52 176.23 2wii h GLU 1632N 0.84 0.92 0.00 6.66 4.39 -1.29 -0.25 114.58 125.85 2wii h GLU 1632Ca 0.10 -0.20 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 2wii h GLU 1632Cb 0.82 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 2wii h GLU 1632CO 0.07 0.82 -0.41 1.03 -1.16 0.00 0.00 179.01 179.36 2wii h SER 1633N 0.83 0.00 0.30 1.42 0.87 -1.28 -0.72 113.55 114.98 2wii h SER 1633Ca 0.19 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 60.42 2wii h SER 1633Cb 0.29 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.26 2wii h SER 1633CO -0.01 0.41 -1.61 0.24 -0.53 0.00 0.00 176.83 175.33 2wii h MET 1634N 0.00 0.38 -0.04 2.24 2.86 -1.26 0.73 114.93 119.84 2wii h MET 1634Ca -0.00 -0.65 -0.22 0.00 -2.06 0.00 0.00 59.70 56.77 2wii h MET 1634Cb 0.76 0.24 0.02 0.00 0.06 0.00 0.00 31.60 32.67 2wii h MET 1634CO 0.05 1.28 -0.83 0.28 1.06 0.00 0.00 176.91 178.76 2wii h VAL 1635N 0.10 1.32 0.05 -2.22 2.07 -0.99 -1.95 116.25 114.63 2wii h VAL 1635Ca -0.29 -2.10 -0.19 0.00 0.82 0.00 0.00 66.70 64.94 2wii h VAL 1635Cb 2.09 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 34.18 2wii h VAL 1635CO 0.20 0.64 -0.98 0.58 0.02 0.00 0.00 177.57 178.03 2wii h VAL 1636N 0.27 1.20 0.00 2.57 2.07 -1.29 -3.41 116.25 117.66 2wii h VAL 1636Ca -0.09 -2.32 -0.32 0.00 0.82 0.00 0.00 66.70 64.79 2wii h VAL 1636Cb 1.49 2.74 -0.06 0.00 -1.52 0.00 0.00 31.29 33.93 2wii h VAL 1636CO 0.16 0.55 -2.20 0.49 0.02 0.00 0.00 177.57 176.59 2wii n PHE 1637N -4.28 0.00 -4.59 1.57 3.01 -0.93 -5.08 117.46 107.17 2wii n PHE 1637Ca -0.23 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.23 2wii n PHE 1637Cb 0.72 -0.86 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 2wii n PHE 1637CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2wii n GLY 1638N 1.95 1.56 3.92 1.37 0.00 0.21 -4.78 105.19 109.41 2wii n GLY 1638Ca -0.29 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.77 2wii n GLY 1638CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wii h PRO 1640N 2.98 -0.58 0.00 0.00 0.11 -1.94 -3.54 132.00 129.03 2wii h PRO 1640Ca -0.45 0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2wii h PRO 1640Cb 1.16 0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.41 2wii h PRO 1640CO 0.75 -0.39 0.00 0.09 -0.21 0.00 0.00 178.00 178.25