#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g6j s GLU 731 N 0.00 4.05 -1.04 -0.67 8.01 -1.26 -4.39 118.70 123.39 3g6j s GLU 731 Ca 0.00 0.75 -0.05 0.00 0.01 0.00 0.00 54.97 55.67 3g6j s GLU 731 Cb 0.00 -2.41 0.01 0.00 -4.31 0.00 0.00 34.13 27.41 3g6j s GLU 731 CO 0.00 0.14 0.90 -3.47 0.01 0.00 0.00 175.26 172.84 3g6j n ASP 732 N -0.36 -4.66 -3.60 -0.19 2.03 -1.26 -4.96 116.55 103.54 3g6j n ASP 732 Ca 0.04 -0.44 -0.15 0.00 0.52 0.00 0.00 54.79 54.75 3g6j n ASP 732 Cb 0.53 -4.10 -0.07 0.00 -0.72 0.00 0.00 41.12 36.76 3g6j n ASP 732 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 3g6j s ILE 733 N -3.26 0.00 0.22 5.18 2.07 -1.26 -2.55 121.20 121.59 3g6j s ILE 733 Ca 0.36 -0.01 -0.30 0.00 -1.41 0.00 0.00 60.65 59.28 3g6j s ILE 733 Cb -0.16 -0.98 -0.10 0.00 0.13 0.00 0.00 42.46 41.36 3g6j s ILE 733 CO 0.58 -0.00 1.44 -0.63 -1.91 0.00 0.00 174.94 174.41 3g6j s ILE 734 N -0.20 2.79 0.37 2.00 1.01 -1.26 -4.98 121.20 120.93 3g6j s ILE 734 Ca -0.04 0.64 -0.20 0.00 0.00 0.00 0.00 60.65 61.05 3g6j s ILE 734 Cb -0.03 -3.41 -0.10 0.00 0.01 0.00 0.00 42.46 38.93 3g6j s ILE 734 CO 0.04 0.09 0.87 0.00 0.00 0.00 0.00 174.94 175.94 3g6j s ALA 735 N 0.30 3.18 0.21 9.38 0.00 -1.26 -4.84 121.76 128.73 3g6j s ALA 735 Ca 0.61 0.30 -0.10 0.00 0.00 0.00 0.00 51.96 52.77 3g6j s ALA 735 Cb -0.41 -3.02 0.31 0.00 0.00 0.00 0.00 23.12 20.00 3g6j s ALA 735 CO 0.39 0.21 1.69 1.49 0.00 0.00 0.00 175.76 179.54 3g6j h GLU 736 N 2.32 0.20 0.00 0.00 4.22 -1.95 -0.62 114.58 118.75 3g6j h GLU 736 Ca -0.48 -0.01 -0.05 0.00 0.08 0.00 0.00 59.36 58.90 3g6j h GLU 736 Cb 1.18 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.38 3g6j h GLU 736 CO 0.63 0.13 -0.23 0.93 -2.18 0.00 0.00 179.01 178.30 3g6j h GLU 737 N 0.21 0.00 0.00 1.92 3.07 -2.04 -1.44 114.58 116.30 3g6j h GLU 737 Ca 0.32 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.18 3g6j h GLU 737 Cb 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.42 3g6j h GLU 737 CO -0.45 0.23 0.00 0.09 -1.40 0.00 0.00 179.01 177.48 3g6j n ASN 738 N -4.21 0.71 -4.66 1.42 3.02 -0.26 -4.75 115.26 106.54 3g6j n ASN 738 Ca -0.02 0.62 -0.41 0.00 -0.03 0.00 0.00 54.58 54.73 3g6j n ASN 738 Cb 0.29 -0.79 -0.04 0.00 -0.61 0.00 0.00 39.78 38.63 3g6j n ASN 738 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3g6j s ILE 739 N -3.20 4.90 -0.37 2.41 1.01 -0.54 -4.99 121.20 120.42 3g6j s ILE 739 Ca 0.08 1.55 -0.12 0.00 0.00 0.00 0.00 60.65 62.16 3g6j s ILE 739 Cb 0.11 -4.10 0.01 0.00 0.01 0.00 0.00 42.46 38.49 3g6j s ILE 739 CO 0.49 0.03 0.22 -0.69 0.00 0.00 0.00 174.94 174.99 3g6j s VAL 740 N 2.20 4.80 0.40 2.92 1.01 -1.26 -5.01 120.40 125.46 3g6j s VAL 740 Ca 0.36 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 61.42 3g6j s VAL 740 Cb -0.16 -3.61 -0.08 0.00 0.00 0.00 0.00 36.38 32.52 3g6j s VAL 740 CO 0.11 -0.17 1.25 -0.44 0.00 0.00 0.00 175.10 175.85 3g6j s SER 741 N 1.61 6.38 0.16 3.32 0.01 -1.26 -4.71 113.70 119.20 3g6j s SER 741 Ca 0.04 2.53 -0.31 0.00 1.31 0.00 0.00 55.95 59.52 3g6j s SER 741 Cb -0.19 -2.63 -0.09 0.00 0.21 0.00 0.00 66.02 63.33 3g6j s SER 741 CO 0.08 -0.79 1.39 -0.13 0.41 0.00 0.00 173.24 174.20 3g6j s ARG 742 N -2.26 4.32 0.00 12.44 0.52 0.68 -4.79 118.95 129.86 3g6j s ARG 742 Ca 0.57 2.12 0.00 0.00 -0.52 0.00 0.00 55.73 57.91 3g6j s ARG 742 Cb -0.35 -3.21 0.00 0.00 0.52 0.00 0.00 34.95 31.91 3g6j s ARG 742 CO 0.45 -0.41 0.00 -1.13 0.02 0.00 0.00 175.30 174.23 3g6j n SER 743 N 3.45 1.01 -4.55 0.23 3.41 -1.26 -0.99 113.62 114.91 3g6j n SER 743 Ca 0.10 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.30 3g6j n SER 743 Cb 0.42 0.12 -0.03 0.00 -0.26 0.00 0.00 64.21 64.46 3g6j n SER 743 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3g6j s GLU 744 N -1.05 3.37 -0.48 4.33 2.02 -1.26 -4.87 118.70 120.76 3g6j s GLU 744 Ca 0.00 -0.67 0.07 0.00 0.02 0.00 0.00 54.97 54.39 3g6j s GLU 744 Cb 0.00 -4.71 0.38 0.00 0.10 0.00 0.00 34.13 29.90 3g6j s GLU 744 CO 0.00 -2.16 0.97 1.19 0.02 0.00 0.00 175.26 175.28 3g6j n PHE 745 N 9.06 3.00 -2.34 1.61 3.72 -1.26 -1.15 117.46 130.09 3g6j n PHE 745 Ca 0.16 -3.57 -0.37 0.00 -0.05 0.00 0.00 57.45 53.63 3g6j n PHE 745 Cb 0.50 -0.34 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 3g6j n PHE 745 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 3g6j s PRO 746 N -3.31 3.90 0.36 -1.08 0.04 -1.26 -4.92 135.00 128.73 3g6j s PRO 746 Ca 0.45 1.70 0.17 0.00 0.04 0.00 0.00 61.00 63.36 3g6j s PRO 746 Cb 0.35 -2.47 0.65 0.00 0.04 0.00 0.00 34.50 33.07 3g6j s PRO 746 CO -0.13 -0.41 1.73 0.93 0.04 0.00 0.00 177.00 179.16 3g6j h GLU 747 N 2.23 0.00 -3.36 4.56 5.08 -2.04 -3.45 114.58 117.59 3g6j h GLU 747 Ca -0.49 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.80 3g6j h GLU 747 Cb 1.24 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.34 3g6j h GLU 747 CO 0.61 0.42 -0.17 -1.54 -1.00 0.00 0.00 179.01 177.33 3g6j s SER 748 N -6.57 -0.16 0.00 1.42 1.04 -1.26 -5.14 113.70 103.03 3g6j s SER 748 Ca -0.01 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.15 3g6j s SER 748 Cb 0.12 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.65 3g6j s SER 748 CO 0.70 -0.74 0.00 -2.67 0.98 0.00 0.00 173.24 171.52 3g6j n TRP 749 N 0.15 -0.65 -3.55 5.02 4.27 -1.26 -5.00 117.44 116.41 3g6j n TRP 749 Ca -0.17 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.21 3g6j n TRP 749 Cb 0.62 0.00 0.08 0.00 -1.36 0.00 0.00 31.31 30.64 3g6j n TRP 749 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 3g6j n LEU 750 N 0.00 -3.35 -3.49 5.67 7.94 -1.26 -4.88 117.00 117.63 3g6j n LEU 750 Ca 0.00 -0.52 -0.38 0.00 -1.11 0.00 0.00 56.01 54.00 3g6j n LEU 750 Cb 0.00 -2.97 -0.02 0.00 0.53 0.00 0.00 43.42 40.96 3g6j n LEU 750 CO 0.00 0.63 2.71 1.87 -1.11 0.00 0.00 177.39 181.49 3g6j n TRP 751 N -4.94 2.49 -3.74 1.96 -0.00 -1.26 -4.91 117.44 107.04 3g6j n TRP 751 Ca 0.01 -2.59 -0.21 0.00 -0.00 0.00 0.00 57.50 54.71 3g6j n TRP 751 Cb 0.56 -2.21 -0.03 0.00 -0.00 0.00 0.00 31.31 29.64 3g6j n TRP 751 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 3g6j s ASN 752 N 3.32 5.53 -0.28 5.87 0.02 -1.26 -5.10 114.94 123.03 3g6j s ASN 752 Ca 0.54 -0.37 -0.01 0.00 -1.02 0.00 0.00 52.86 51.99 3g6j s ASN 752 Cb 0.14 -1.10 0.09 0.00 0.02 0.00 0.00 41.25 40.40 3g6j s ASN 752 CO -0.03 -0.35 0.08 -0.69 0.02 0.00 0.00 177.10 176.13 3g6j s VAL 753 N -2.25 0.80 -0.03 1.60 1.01 -1.26 -5.13 120.40 115.14 3g6j s VAL 753 Ca 0.41 -1.20 0.06 0.00 0.00 0.00 0.00 61.98 61.26 3g6j s VAL 753 Cb -0.07 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 3g6j s VAL 753 CO 0.28 -0.56 -0.20 -1.61 0.00 0.00 0.00 175.10 173.01 3g6j s GLU 754 N 1.68 2.28 -0.02 2.72 0.41 -1.26 -5.13 118.70 119.38 3g6j s GLU 754 Ca 0.07 -0.83 -0.02 0.00 -0.41 0.00 0.00 54.97 53.78 3g6j s GLU 754 Cb -0.17 -2.20 -0.04 0.00 -1.78 0.00 0.00 34.13 29.94 3g6j s GLU 754 CO -0.21 0.59 0.12 -0.51 -0.49 0.00 0.00 175.26 174.75 3g6j s ASP 755 N -0.71 5.96 -1.23 -0.19 1.11 -1.26 -5.03 116.67 115.32 3g6j s ASP 755 Ca 0.11 0.24 -0.06 0.00 0.18 0.00 0.00 52.55 53.02 3g6j s ASP 755 Cb -0.10 -1.79 0.20 0.00 1.07 0.00 0.00 42.92 42.29 3g6j s ASP 755 CO 0.00 0.28 1.98 0.18 1.18 0.00 0.00 175.17 178.80 3g6j n LEU 756 N 1.20 7.21 -0.06 1.23 4.77 -1.26 -4.74 117.00 125.35 3g6j n LEU 756 Ca -0.13 -4.94 0.15 0.00 -0.03 0.00 0.00 56.01 51.06 3g6j n LEU 756 Cb 0.53 -1.36 0.74 0.00 -2.33 0.00 0.00 43.42 41.00 3g6j n LEU 756 CO 0.39 1.77 0.98 1.17 -1.33 0.00 0.00 177.39 180.38 3g6j n LYS 757 N 2.11 0.69 -2.19 3.23 3.00 -1.26 -4.87 118.16 118.87 3g6j n LYS 757 Ca 0.46 -0.12 -0.33 0.00 -0.00 0.00 0.00 58.31 58.33 3g6j n LYS 757 Cb 0.30 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 33.83 3g6j n LYS 757 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 3g6j s GLU 758 N -2.39 3.47 0.15 1.64 8.01 -1.26 -4.99 118.70 123.33 3g6j s GLU 758 Ca 0.33 1.23 -0.30 0.00 0.01 0.00 0.00 54.97 56.24 3g6j s GLU 758 Cb 0.21 -2.05 -0.08 0.00 -4.31 0.00 0.00 34.13 27.90 3g6j s GLU 758 CO 0.44 -0.69 1.23 -1.25 0.01 0.00 0.00 175.26 175.00 3g6j s PRO 759 N -3.86 4.45 0.72 0.39 0.04 -1.26 -4.69 135.00 130.78 3g6j s PRO 759 Ca 0.64 1.90 -0.11 0.00 0.04 0.00 0.00 61.00 63.47 3g6j s PRO 759 Cb -0.16 -3.26 0.02 0.00 0.04 0.00 0.00 34.50 31.14 3g6j s PRO 759 CO 0.32 -0.19 1.08 -2.14 0.04 0.00 0.00 177.00 176.12 3g6j s PRO 760 N 0.20 2.78 -0.10 0.56 0.02 -1.26 -4.75 135.00 132.44 3g6j s PRO 760 Ca 0.56 0.67 -0.04 0.00 0.02 0.00 0.00 61.00 62.21 3g6j s PRO 760 Cb -0.33 -1.99 0.05 0.00 0.02 0.00 0.00 34.50 32.25 3g6j s PRO 760 CO 0.35 -1.14 0.20 0.15 -0.33 0.00 0.00 177.00 176.23 3g6j s LYS 761 N -5.20 0.08 -1.71 5.54 1.02 -1.23 -4.74 119.74 113.49 3g6j s LYS 761 Ca 0.58 0.63 0.00 0.00 0.02 0.00 0.00 55.97 57.20 3g6j s LYS 761 Cb -0.13 -0.18 0.00 0.00 -0.52 0.00 0.00 37.83 37.00 3g6j s LYS 761 CO 0.54 -0.30 0.00 0.09 -0.92 0.00 0.00 175.35 174.76 3g6j n ASN 762 N 5.30 -5.22 -0.93 2.83 4.13 -1.26 -2.96 115.26 117.15 3g6j n ASN 762 Ca -0.06 0.19 -0.10 0.00 1.68 0.00 0.00 54.58 56.29 3g6j n ASN 762 Cb 0.50 -4.30 -0.02 0.00 -1.54 0.00 0.00 39.78 34.41 3g6j n ASN 762 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3g6j n GLY 763 N -0.90 0.59 2.85 7.41 0.00 -1.26 -5.01 105.19 108.87 3g6j n GLY 763 Ca -0.20 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.99 3g6j n GLY 763 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3g6j s ILE 764 N -2.43 1.57 -0.35 -0.61 -1.09 -1.16 -5.02 121.20 112.12 3g6j s ILE 764 Ca 0.00 -2.00 -0.29 0.00 -2.23 0.00 0.00 60.65 56.13 3g6j s ILE 764 Cb 0.00 -2.16 0.01 0.00 -1.58 0.00 0.00 42.46 38.73 3g6j s ILE 764 CO 0.00 -0.68 1.33 -0.44 -1.23 0.00 0.00 174.94 173.92 3g6j s SER 765 N 1.09 6.55 0.13 3.58 0.01 -1.26 -3.54 113.70 120.27 3g6j s SER 765 Ca 0.12 1.02 -0.16 0.00 1.31 0.00 0.00 55.95 58.24 3g6j s SER 765 Cb -0.19 -2.54 -0.07 0.00 0.21 0.00 0.00 66.02 63.43 3g6j s SER 765 CO -0.14 -1.22 0.57 -0.89 0.41 0.00 0.00 173.24 171.97 3g6j s THR 766 N 4.76 4.80 -0.02 1.44 2.01 -1.26 -4.94 115.64 122.42 3g6j s THR 766 Ca 0.57 0.98 0.03 0.00 0.31 0.00 0.00 61.69 63.59 3g6j s THR 766 Cb -0.15 -3.79 -0.00 0.00 0.01 0.00 0.00 72.50 68.57 3g6j s THR 766 CO 0.27 0.32 -0.12 -0.75 -0.69 0.00 0.00 174.62 173.65 3g6j s LYS 767 N -1.73 1.12 -0.20 4.92 2.20 -1.26 -4.71 119.74 120.07 3g6j s LYS 767 Ca 0.36 -0.43 -0.06 0.00 -0.36 0.00 0.00 55.97 55.48 3g6j s LYS 767 Cb -0.16 -1.05 -0.03 0.00 -1.51 0.00 0.00 37.83 35.08 3g6j s LYS 767 CO 0.19 0.22 0.02 -0.51 -0.36 0.00 0.00 175.35 174.91 3g6j s LEU 768 N -0.08 3.39 -0.09 5.43 1.43 -1.26 -5.10 118.68 122.40 3g6j s LEU 768 Ca 0.01 -0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.96 3g6j s LEU 768 Cb -0.07 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 3g6j s LEU 768 CO 0.00 0.07 -0.06 -0.04 0.23 0.00 0.00 176.35 176.55 3g6j s MET 769 N 0.97 2.99 -0.45 1.70 -1.94 -1.26 -5.09 119.30 116.22 3g6j s MET 769 Ca 0.02 -0.53 -0.14 0.00 -1.71 0.00 0.00 55.69 53.33 3g6j s MET 769 Cb -0.14 -2.68 0.07 0.00 2.01 0.00 0.00 34.83 34.09 3g6j s MET 769 CO 0.02 0.56 0.35 -0.80 -0.01 0.00 0.00 175.02 175.14 3g6j s ASN 770 N -0.53 5.99 0.18 3.03 0.01 -1.26 -5.07 114.94 117.29 3g6j s ASN 770 Ca 0.08 -1.35 0.07 0.00 -0.71 0.00 0.00 52.86 50.95 3g6j s ASN 770 Cb -0.12 -2.12 -0.04 0.00 0.41 0.00 0.00 41.25 39.38 3g6j s ASN 770 CO 0.02 -0.60 0.03 0.27 -1.51 0.00 0.00 177.10 175.31 3g6j s ILE 771 N 1.58 3.85 -0.31 0.60 -4.36 -1.26 -5.11 121.20 116.18 3g6j s ILE 771 Ca 0.04 -1.39 -0.03 0.00 -0.26 0.00 0.00 60.65 59.00 3g6j s ILE 771 Cb -0.24 -2.95 0.05 0.00 1.25 0.00 0.00 42.46 40.57 3g6j s ILE 771 CO 0.05 -0.13 0.03 -0.36 0.24 0.00 0.00 174.94 174.78 3g6j s PHE 772 N -1.77 3.27 0.46 1.37 0.08 -1.26 -5.10 117.98 115.02 3g6j s PHE 772 Ca 0.28 -1.75 -0.25 0.00 0.12 0.00 0.00 56.93 55.34 3g6j s PHE 772 Cb -0.09 -2.18 -0.08 0.00 -0.57 0.00 0.00 43.02 40.10 3g6j s PHE 772 CO 0.20 -0.78 1.39 -0.51 -0.10 0.00 0.00 175.22 175.42 3g6j s LEU 773 N 1.30 4.09 1.02 -0.37 1.43 -1.26 -5.01 118.68 119.88 3g6j s LEU 773 Ca -0.04 2.85 -0.17 0.00 -1.03 0.00 0.00 54.13 55.74 3g6j s LEU 773 Cb -0.20 -3.98 0.23 0.00 0.03 0.00 0.00 46.19 42.28 3g6j s LEU 773 CO 0.00 -1.17 1.34 -0.54 0.23 0.00 0.00 176.35 176.21 3g6j s LYS 774 N -2.48 0.17 0.01 1.70 -0.14 -1.26 -4.98 119.74 112.76 3g6j s LYS 774 Ca 0.62 -0.50 0.27 0.00 -1.36 0.00 0.00 55.97 55.00 3g6j s LYS 774 Cb -0.42 -1.80 0.94 0.00 -1.68 0.00 0.00 37.83 34.87 3g6j s LYS 774 CO 0.54 -2.72 1.72 -0.25 -0.76 0.00 0.00 175.35 173.88 3g6j n ASP 775 N -3.96 0.23 -4.74 2.83 9.92 -0.30 -4.89 116.55 115.64 3g6j n ASP 775 Ca 0.17 0.23 -0.42 0.00 -0.53 0.00 0.00 54.79 54.24 3g6j n ASP 775 Cb 0.59 -0.23 -0.01 0.00 -0.64 0.00 0.00 41.12 40.84 3g6j n ASP 775 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 3g6j n SER 776 N -1.55 3.47 -4.35 -2.24 7.64 -1.25 -4.95 113.62 110.39 3g6j n SER 776 Ca 0.06 1.21 -0.45 0.00 1.01 0.00 0.00 58.87 60.70 3g6j n SER 776 Cb 0.35 -1.57 -0.05 0.00 -1.01 0.00 0.00 64.21 61.93 3g6j n SER 776 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3g6j s ILE 777 N -0.87 5.00 0.00 0.44 1.01 -1.26 -4.79 121.20 120.72 3g6j s ILE 777 Ca 0.56 -1.25 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3g6j s ILE 777 Cb -0.51 -4.43 0.00 0.00 0.01 0.00 0.00 42.46 37.53 3g6j s ILE 777 CO 0.60 -1.02 0.00 1.07 0.00 0.00 0.00 174.94 175.59 3g6j n THR 778 N 5.39 0.00 -4.64 2.92 5.66 -1.04 -4.98 114.28 117.59 3g6j n THR 778 Ca -0.11 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.60 3g6j n THR 778 Cb 0.41 0.00 -0.17 0.00 -1.55 0.00 0.00 70.33 69.03 3g6j n THR 778 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 3g6j s THR 779 N -2.82 1.66 0.09 1.09 2.01 -1.26 -1.22 115.64 115.18 3g6j s THR 779 Ca 0.00 -0.75 -0.16 0.00 0.31 0.00 0.00 61.69 61.09 3g6j s THR 779 Cb 0.00 -1.49 -0.07 0.00 0.01 0.00 0.00 72.50 70.96 3g6j s THR 779 CO 0.00 0.47 0.52 0.26 -0.69 0.00 0.00 174.62 175.18 3g6j s TRP 780 N 0.81 3.70 -0.22 4.92 0.52 0.32 -4.91 118.94 124.08 3g6j s TRP 780 Ca -0.10 1.11 -0.05 0.00 0.02 0.00 0.00 56.10 57.09 3g6j s TRP 780 Cb -0.16 -2.39 -0.02 0.00 -1.15 0.00 0.00 33.47 29.76 3g6j s TRP 780 CO 0.01 0.53 -0.00 -2.00 0.02 0.00 0.00 176.95 175.51 3g6j s GLU 781 N -1.48 3.51 -0.19 4.98 2.12 -1.26 -0.66 118.70 125.72 3g6j s GLU 781 Ca 0.32 -0.56 -0.07 0.00 0.36 0.00 0.00 54.97 55.01 3g6j s GLU 781 Cb -0.17 -3.10 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 3g6j s GLU 781 CO 0.18 -0.14 0.05 0.42 -0.54 0.00 0.00 175.26 175.23 3g6j s ILE 782 N 1.39 4.57 -0.09 -3.70 1.01 0.02 -4.92 121.20 119.48 3g6j s ILE 782 Ca 0.05 -0.11 0.03 0.00 0.00 0.00 0.00 60.65 60.63 3g6j s ILE 782 Cb -0.15 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.26 3g6j s ILE 782 CO -0.00 0.44 -0.21 -0.22 0.00 0.00 0.00 174.94 174.96 3g6j s LEU 783 N 0.59 1.96 -0.10 2.97 2.96 -1.26 -1.10 118.68 124.70 3g6j s LEU 783 Ca 0.02 -0.49 0.03 0.00 -0.22 0.00 0.00 54.13 53.47 3g6j s LEU 783 Cb -0.13 -1.25 0.01 0.00 0.50 0.00 0.00 46.19 45.32 3g6j s LEU 783 CO 0.01 0.12 -0.20 0.00 -1.32 0.00 0.00 176.35 174.97 3g6j s ALA 784 N 0.46 1.90 -0.08 5.97 0.00 -1.26 -5.05 121.76 123.69 3g6j s ALA 784 Ca -0.17 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.96 3g6j s ALA 784 Cb -0.17 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.13 3g6j s ALA 784 CO 0.07 0.15 -0.02 0.08 0.00 0.00 0.00 175.76 176.04 3g6j s VAL 785 N 0.58 4.11 0.04 0.00 1.01 -1.26 -0.62 120.40 124.26 3g6j s VAL 785 Ca -0.14 -0.32 0.09 0.00 0.00 0.00 0.00 61.98 61.60 3g6j s VAL 785 Cb -0.17 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.47 3g6j s VAL 785 CO 0.05 0.60 -0.24 -0.94 0.00 0.00 0.00 175.10 174.56 3g6j s SER 786 N -0.81 3.31 -0.05 3.32 1.04 -0.10 -4.97 113.70 115.44 3g6j s SER 786 Ca 0.12 -0.54 0.04 0.00 0.48 0.00 0.00 55.95 56.06 3g6j s SER 786 Cb -0.11 -0.37 -0.00 0.00 0.10 0.00 0.00 66.02 65.63 3g6j s SER 786 CO 0.02 0.27 -0.18 -0.32 0.98 0.00 0.00 173.24 174.01 3g6j s MET 787 N -1.22 1.96 -0.03 4.02 1.75 -1.26 -0.07 119.30 124.44 3g6j s MET 787 Ca 0.12 -0.64 -0.03 0.00 -1.25 0.00 0.00 55.69 53.90 3g6j s MET 787 Cb -0.10 -1.66 0.01 0.00 2.84 0.00 0.00 34.83 35.92 3g6j s MET 787 CO 0.02 0.23 0.08 0.45 -0.65 0.00 0.00 175.02 175.15 3g6j s SER 788 N 0.12 -0.08 0.22 1.11 0.15 -0.39 -4.97 113.70 109.86 3g6j s SER 788 Ca -0.06 0.17 -0.08 0.00 0.70 0.00 0.00 55.95 56.67 3g6j s SER 788 Cb -0.13 0.16 0.26 0.00 -1.71 0.00 0.00 66.02 64.61 3g6j s SER 788 CO 0.03 -0.03 1.83 0.44 1.20 0.00 0.00 173.24 176.71 3g6j h ASP 789 N 6.06 0.67 0.06 5.45 5.19 -2.01 -0.15 116.42 131.69 3g6j h ASP 789 Ca -0.25 0.02 -0.19 0.00 -0.62 0.00 0.00 57.03 55.98 3g6j h ASP 789 Cb 1.20 -0.12 0.02 0.00 0.18 0.00 0.00 39.33 40.61 3g6j h ASP 789 CO 0.46 0.43 -0.80 0.11 -3.12 0.00 0.00 179.24 176.32 3g6j h LYS 790 N 0.80 0.43 -0.00 3.56 6.56 -2.06 -3.41 116.57 122.45 3g6j h LYS 790 Ca 0.32 -0.55 0.00 0.00 -1.06 0.00 0.00 60.65 59.36 3g6j h LYS 790 Cb 0.16 0.18 0.00 0.00 -0.57 0.00 0.00 32.23 31.99 3g6j h LYS 790 CO -0.17 1.20 0.00 1.63 -2.06 0.00 0.00 179.45 180.06 3g6j n LYS 791 N -4.10 0.44 0.00 3.15 5.02 -1.20 -5.12 118.16 116.35 3g6j n LYS 791 Ca -0.12 -0.87 0.00 0.00 -2.02 0.00 0.00 58.31 55.30 3g6j n LYS 791 Cb 0.78 -1.01 0.00 0.00 -0.02 0.00 0.00 35.03 34.79 3g6j n LYS 791 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3g6j n GLY 792 N -0.16 -0.74 3.81 0.72 0.00 -0.07 -4.87 105.19 103.88 3g6j n GLY 792 Ca 0.00 -1.31 -0.38 0.00 0.00 0.00 0.00 46.02 44.32 3g6j n GLY 792 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3g6j s ILE 793 N 0.00 4.80 -0.22 -0.61 2.07 -1.26 -1.26 121.20 124.72 3g6j s ILE 793 Ca 0.00 1.14 -0.04 0.00 -1.41 0.00 0.00 60.65 60.34 3g6j s ILE 793 Cb 0.00 -3.86 0.09 0.00 0.13 0.00 0.00 42.46 38.82 3g6j s ILE 793 CO 0.00 0.56 0.18 0.00 -1.91 0.00 0.00 174.94 173.77 3g6j s VAL 795 N 2.25 4.77 0.87 0.00 1.01 -1.26 -0.92 120.40 127.12 3g6j s VAL 795 Ca 0.06 1.36 -0.12 0.00 0.00 0.00 0.00 61.98 63.29 3g6j s VAL 795 Cb -0.16 -4.17 0.11 0.00 0.00 0.00 0.00 36.38 32.17 3g6j s VAL 795 CO -0.18 -0.23 1.13 0.00 0.00 0.00 0.00 175.10 175.82 3g6j s ALA 796 N 3.01 1.96 0.35 5.51 0.00 0.21 -5.01 121.76 127.80 3g6j s ALA 796 Ca 0.35 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.60 3g6j s ALA 796 Cb -0.14 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 19.84 3g6j s ALA 796 CO 0.11 -2.09 1.06 -0.51 0.00 0.00 0.00 175.76 174.34 3g6j s ASP 797 N -4.02 6.98 0.48 0.00 1.01 -1.26 -4.75 116.67 115.10 3g6j s ASP 797 Ca 0.63 2.12 -0.23 0.00 0.71 0.00 0.00 52.55 55.77 3g6j s ASP 797 Cb -0.14 -2.60 -0.07 0.00 1.01 0.00 0.00 42.92 41.12 3g6j s ASP 797 CO 0.53 -0.34 1.29 -2.84 0.21 0.00 0.00 175.17 174.02 3g6j s PRO 798 N -2.06 3.56 -0.15 8.23 0.02 -1.26 -4.78 135.00 138.56 3g6j s PRO 798 Ca 0.52 2.08 0.01 0.00 0.02 0.00 0.00 61.00 63.63 3g6j s PRO 798 Cb -0.26 -2.44 0.02 0.00 0.02 0.00 0.00 34.50 31.84 3g6j s PRO 798 CO 0.33 -0.81 -0.16 0.12 -0.33 0.00 0.00 177.00 176.15 3g6j s PHE 799 N -1.37 2.31 -0.08 6.54 5.36 -0.26 -4.94 117.98 125.55 3g6j s PHE 799 Ca 0.65 -1.28 -0.12 0.00 -0.96 0.00 0.00 56.93 55.22 3g6j s PHE 799 Cb -0.36 -1.66 -0.05 0.00 -0.34 0.00 0.00 43.02 40.61 3g6j s PHE 799 CO 0.44 -0.67 0.29 -1.21 -1.46 0.00 0.00 175.22 172.61 3g6j s GLU 800 N 1.31 3.81 -0.05 10.12 2.02 -1.26 -0.80 118.70 133.85 3g6j s GLU 800 Ca 0.02 0.15 0.04 0.00 0.02 0.00 0.00 54.97 55.20 3g6j s GLU 800 Cb -0.13 -3.25 0.00 0.00 0.10 0.00 0.00 34.13 30.85 3g6j s GLU 800 CO -0.09 0.63 -0.15 0.08 0.02 0.00 0.00 175.26 175.75 3g6j s VAL 801 N -0.75 1.31 -0.27 2.63 1.01 0.16 -4.97 120.40 119.53 3g6j s VAL 801 Ca 0.19 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.55 3g6j s VAL 801 Cb -0.14 -1.14 0.05 0.00 0.00 0.00 0.00 36.38 35.15 3g6j s VAL 801 CO 0.08 0.39 -0.08 -0.89 0.00 0.00 0.00 175.10 174.59 3g6j s THR 802 N 0.23 2.43 -0.03 3.92 2.01 -1.26 0.12 115.64 123.05 3g6j s THR 802 Ca -0.07 -1.50 -0.10 0.00 0.31 0.00 0.00 61.69 60.33 3g6j s THR 802 Cb -0.13 -2.39 -0.05 0.00 0.01 0.00 0.00 72.50 69.95 3g6j s THR 802 CO 0.03 -0.01 0.28 -0.69 -0.69 0.00 0.00 174.62 173.54 3g6j s VAL 803 N 1.16 5.26 -0.23 3.82 1.01 -0.36 -4.99 120.40 126.07 3g6j s VAL 803 Ca -0.07 0.42 -0.29 0.00 0.00 0.00 0.00 61.98 62.05 3g6j s VAL 803 Cb -0.19 -3.57 0.16 0.00 0.00 0.00 0.00 36.38 32.77 3g6j s VAL 803 CO -0.04 0.51 1.17 -0.32 0.00 0.00 0.00 175.10 176.42 3g6j s MET 804 N -1.32 0.35 0.13 2.72 0.00 -1.26 -2.49 119.30 117.43 3g6j s MET 804 Ca 0.23 0.15 0.04 0.00 0.00 0.00 0.00 55.69 56.11 3g6j s MET 804 Cb -0.14 0.16 -0.04 0.00 0.00 0.00 0.00 34.83 34.81 3g6j s MET 804 CO 0.11 -0.10 -0.11 -0.65 0.00 0.00 0.00 175.02 174.28 3g6j s GLN 805 N -0.80 1.00 0.39 4.11 -0.21 -1.26 -5.05 119.66 117.85 3g6j s GLN 805 Ca 0.03 -1.34 0.18 0.00 0.02 0.00 0.00 55.36 54.26 3g6j s GLN 805 Cb -0.02 -0.65 0.81 0.00 1.00 0.00 0.00 33.01 34.16 3g6j s GLN 805 CO -0.04 0.09 1.81 -0.44 -2.12 0.00 0.00 175.29 174.59 3g6j h ASP 806 N 3.11 0.00 -3.64 5.90 5.19 -1.95 -3.44 116.42 121.58 3g6j h ASP 806 Ca -0.37 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 55.83 3g6j h ASP 806 Cb 1.19 0.00 -0.28 0.00 0.18 0.00 0.00 39.33 40.42 3g6j h ASP 806 CO 0.59 0.34 -0.56 0.12 -3.12 0.00 0.00 179.24 176.60 3g6j s PHE 807 N -3.84 -0.17 -0.03 4.55 5.36 -1.26 -0.88 117.98 121.72 3g6j s PHE 807 Ca -0.01 0.44 -0.30 0.00 -0.96 0.00 0.00 56.93 56.10 3g6j s PHE 807 Cb 0.12 0.01 0.11 0.00 -0.34 0.00 0.00 43.02 42.92 3g6j s PHE 807 CO 0.68 -0.11 0.97 -0.59 -1.46 0.00 0.00 175.22 174.71 3g6j s PHE 808 N 0.51 -0.27 -0.13 10.12 -0.12 -1.13 -4.91 117.98 122.05 3g6j s PHE 808 Ca -0.04 0.14 -0.14 0.00 -0.05 0.00 0.00 56.93 56.85 3g6j s PHE 808 Cb -0.05 0.54 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 3g6j s PHE 808 CO -0.02 -0.49 0.31 0.42 -0.05 0.00 0.00 175.22 175.38 3g6j s ILE 809 N -2.97 5.28 -0.30 -4.49 1.01 -1.26 -1.29 121.20 117.18 3g6j s ILE 809 Ca 0.07 0.59 -0.04 0.00 0.00 0.00 0.00 60.65 61.26 3g6j s ILE 809 Cb -0.01 -3.64 0.03 0.00 0.01 0.00 0.00 42.46 38.86 3g6j s ILE 809 CO -0.07 0.43 0.04 -0.62 0.00 0.00 0.00 174.94 174.72 3g6j s ASP 810 N 0.13 4.94 -0.43 3.58 -1.08 0.25 -4.88 116.67 119.18 3g6j s ASP 810 Ca 0.18 -0.98 -0.17 0.00 -0.52 0.00 0.00 52.55 51.06 3g6j s ASP 810 Cb -0.14 -1.79 0.03 0.00 -1.46 0.00 0.00 42.92 39.56 3g6j s ASP 810 CO 0.06 -0.23 0.46 -0.22 0.52 0.00 0.00 175.17 175.75 3g6j s LEU 811 N 1.38 4.94 -0.90 -1.34 2.96 -1.26 -0.26 118.68 124.19 3g6j s LEU 811 Ca -0.01 -0.75 -0.17 0.00 -0.22 0.00 0.00 54.13 52.98 3g6j s LEU 811 Cb -0.18 -2.38 0.16 0.00 0.50 0.00 0.00 46.19 44.28 3g6j s LEU 811 CO 0.00 -0.62 1.03 -0.13 -1.32 0.00 0.00 176.35 175.31 3g6j s ARG 812 N 2.15 3.60 0.02 1.98 1.81 -0.20 -5.02 118.95 123.30 3g6j s ARG 812 Ca 0.12 -1.95 -0.07 0.00 -1.72 0.00 0.00 55.73 52.11 3g6j s ARG 812 Cb -0.18 -4.78 -0.05 0.00 -0.45 0.00 0.00 34.95 29.49 3g6j s ARG 812 CO 0.13 -1.64 0.29 -0.51 -0.68 0.00 0.00 175.30 172.89 3g6j s LEU 813 N 1.99 4.36 1.00 2.53 1.02 -1.26 -4.06 118.68 124.26 3g6j s LEU 813 Ca 0.29 0.59 -0.13 0.00 0.02 0.00 0.00 54.13 54.89 3g6j s LEU 813 Cb -0.06 -2.74 0.19 0.00 0.02 0.00 0.00 46.19 43.60 3g6j s LEU 813 CO -0.09 0.23 1.10 -2.84 0.02 0.00 0.00 176.35 174.78 3g6j s PRO 814 N -1.82 0.41 0.19 1.29 0.02 -1.26 -4.97 135.00 128.87 3g6j s PRO 814 Ca 0.29 0.41 -0.03 0.00 0.02 0.00 0.00 61.00 61.69 3g6j s PRO 814 Cb -0.13 -1.74 0.12 0.00 0.02 0.00 0.00 34.50 32.77 3g6j s PRO 814 CO 0.17 -2.72 1.51 -0.92 -0.33 0.00 0.00 177.00 174.71 3g6j h TYR 815 N -1.88 0.67 -2.37 6.54 3.20 -1.95 -3.45 116.97 117.72 3g6j h TYR 815 Ca -0.54 -0.24 -0.05 0.00 3.14 0.00 0.00 58.73 61.05 3g6j h TYR 815 Cb 1.33 -0.13 -0.17 0.00 1.54 0.00 0.00 36.73 39.31 3g6j h TYR 815 CO 0.16 0.96 0.17 -1.54 -1.64 0.00 0.00 178.16 176.27 3g6j s SER 816 N -6.92 -0.60 0.06 -2.11 1.04 -1.26 -3.03 113.70 100.88 3g6j s SER 816 Ca -0.07 0.46 0.05 0.00 0.48 0.00 0.00 55.95 56.86 3g6j s SER 816 Cb 0.11 0.55 -0.03 0.00 0.10 0.00 0.00 66.02 66.75 3g6j s SER 816 CO 0.84 -0.71 -0.13 0.68 0.98 0.00 0.00 173.24 174.89 3g6j s VAL 817 N -2.01 1.03 0.38 5.02 -7.23 -1.03 -4.99 120.40 111.58 3g6j s VAL 817 Ca -0.07 -1.16 -0.21 0.00 -1.81 0.00 0.00 61.98 58.73 3g6j s VAL 817 Cb -0.00 -0.98 -0.10 0.00 0.56 0.00 0.00 36.38 35.85 3g6j s VAL 817 CO 0.03 -0.17 0.90 -0.69 -0.31 0.00 0.00 175.10 174.86 3g6j s VAL 818 N -1.13 4.41 0.29 1.32 1.01 -1.26 -1.24 120.40 123.80 3g6j s VAL 818 Ca -0.02 1.45 -0.29 0.00 0.00 0.00 0.00 61.98 63.12 3g6j s VAL 818 Cb -0.09 -3.69 -0.10 0.00 0.00 0.00 0.00 36.38 32.50 3g6j s VAL 818 CO 0.02 -0.19 1.30 -0.60 0.00 0.00 0.00 175.10 175.63 3g6j s ARG 819 N -2.88 4.39 0.00 2.72 3.52 0.20 -2.93 118.95 123.97 3g6j s ARG 819 Ca 0.58 2.14 0.00 0.00 -0.13 0.00 0.00 55.73 58.32 3g6j s ARG 819 Cb -0.11 -3.12 0.00 0.00 -1.56 0.00 0.00 34.95 30.16 3g6j s ARG 819 CO 0.16 -0.18 0.00 0.09 -0.81 0.00 0.00 175.30 174.57 3g6j n ASN 820 N 1.39 -3.65 -4.53 -2.12 5.03 0.48 -4.64 115.26 107.23 3g6j n ASN 820 Ca 0.02 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 55.06 3g6j n ASN 820 Cb 0.42 -2.73 -0.10 0.00 -1.02 0.00 0.00 39.78 36.36 3g6j n ASN 820 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3g6j s GLU 821 N -1.40 3.47 0.25 3.52 2.12 -1.15 -4.94 118.70 120.57 3g6j s GLU 821 Ca 0.00 -0.61 -0.31 0.00 0.36 0.00 0.00 54.97 54.41 3g6j s GLU 821 Cb 0.00 -3.82 -0.11 0.00 0.26 0.00 0.00 34.13 30.45 3g6j s GLU 821 CO 0.00 -0.50 1.63 -1.14 -0.54 0.00 0.00 175.26 174.71 3g6j s GLN 822 N 1.81 4.14 0.04 4.30 0.74 -1.26 -4.46 119.66 124.96 3g6j s GLN 822 Ca 0.08 2.55 0.01 0.00 0.05 0.00 0.00 55.36 58.05 3g6j s GLN 822 Cb -0.17 -3.06 -0.02 0.00 1.10 0.00 0.00 33.01 30.85 3g6j s GLN 822 CO 0.11 -0.66 -0.05 0.14 -0.55 0.00 0.00 175.29 174.27 3g6j s VAL 823 N 0.56 0.34 -0.16 1.34 -7.23 -0.19 -5.00 120.40 110.06 3g6j s VAL 823 Ca 0.68 -1.11 -0.08 0.00 -1.81 0.00 0.00 61.98 59.66 3g6j s VAL 823 Cb -0.48 -0.59 -0.04 0.00 0.56 0.00 0.00 36.38 35.83 3g6j s VAL 823 CO 0.40 -0.51 0.11 -0.70 -0.31 0.00 0.00 175.10 174.09 3g6j s GLU 824 N -1.83 3.78 0.26 4.82 2.12 -1.26 -1.03 118.70 125.55 3g6j s GLU 824 Ca -0.10 -0.22 0.08 0.00 0.36 0.00 0.00 54.97 55.09 3g6j s GLU 824 Cb -0.08 -3.25 -0.05 0.00 0.26 0.00 0.00 34.13 31.01 3g6j s GLU 824 CO -0.01 0.50 -0.12 0.96 -0.54 0.00 0.00 175.26 176.05 3g6j s ILE 825 N -0.25 1.86 -0.05 -3.70 -4.36 -0.23 -4.98 121.20 109.50 3g6j s ILE 825 Ca 0.10 -2.21 0.04 0.00 -0.26 0.00 0.00 60.65 58.32 3g6j s ILE 825 Cb -0.12 -2.28 0.00 0.00 1.25 0.00 0.00 42.46 41.31 3g6j s ILE 825 CO 0.01 -0.42 -0.16 -0.13 0.24 0.00 0.00 174.94 174.48 3g6j s ARG 826 N -3.65 1.76 -0.34 0.37 1.81 -1.26 -0.42 118.95 117.23 3g6j s ARG 826 Ca 0.27 -0.56 -0.05 0.00 -1.72 0.00 0.00 55.73 53.67 3g6j s ARG 826 Cb 0.00 -1.51 0.05 0.00 -0.45 0.00 0.00 34.95 33.05 3g6j s ARG 826 CO 0.11 0.19 0.09 0.00 -0.68 0.00 0.00 175.30 175.01 3g6j s ALA 827 N 0.18 3.00 -0.09 2.13 0.00 -0.34 -1.04 121.76 125.62 3g6j s ALA 827 Ca -0.07 -1.81 -0.18 0.00 0.00 0.00 0.00 51.96 49.91 3g6j s ALA 827 Cb -0.12 -2.21 -0.05 0.00 0.00 0.00 0.00 23.12 20.74 3g6j s ALA 827 CO 0.03 -1.36 0.48 0.08 0.00 0.00 0.00 175.76 174.99 3g6j s VAL 828 N 1.35 5.13 -0.14 0.00 1.01 0.63 -1.38 120.40 127.01 3g6j s VAL 828 Ca -0.02 0.97 0.01 0.00 0.00 0.00 0.00 61.98 62.94 3g6j s VAL 828 Cb -0.20 -3.81 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 3g6j s VAL 828 CO 0.01 0.38 -0.17 -0.76 0.00 0.00 0.00 175.10 174.56 3g6j s LEU 829 N 0.26 2.44 -0.13 3.92 1.02 0.29 0.85 118.68 127.33 3g6j s LEU 829 Ca 0.26 -0.46 -0.01 0.00 0.02 0.00 0.00 54.13 53.94 3g6j s LEU 829 Cb -0.16 -1.54 -0.02 0.00 0.02 0.00 0.00 46.19 44.49 3g6j s LEU 829 CO 0.12 0.12 -0.08 -0.31 0.02 0.00 0.00 176.35 176.21 3g6j s TYR 830 N 0.60 2.91 -0.57 0.29 2.02 -0.41 -1.32 117.35 120.87 3g6j s TYR 830 Ca -0.10 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.21 3g6j s TYR 830 Cb -0.16 -1.86 0.15 0.00 -0.40 0.00 0.00 41.96 39.68 3g6j s TYR 830 CO 0.03 -0.04 0.36 1.21 -1.57 0.00 0.00 175.55 175.54 3g6j s ASN 831 N 0.15 5.07 0.00 2.29 2.47 -0.35 -2.82 114.94 121.74 3g6j s ASN 831 Ca -0.04 -2.74 0.19 0.00 0.42 0.00 0.00 52.86 50.69 3g6j s ASN 831 Cb -0.14 -1.81 0.93 0.00 -1.45 0.00 0.00 41.25 38.78 3g6j s ASN 831 CO 0.04 -0.37 1.62 -1.22 -3.72 0.00 0.00 177.10 173.45 3g6j n TYR 832 N 3.60 0.09 -1.88 0.43 4.02 -0.05 -1.03 117.16 122.34 3g6j n TYR 832 Ca 0.06 -0.05 -0.37 0.00 -0.01 0.00 0.00 57.90 57.54 3g6j n TYR 832 Cb 0.37 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.74 3g6j n TYR 832 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 3g6j s ARG 833 N -1.91 2.81 -0.15 -0.72 1.81 -1.25 -4.58 118.95 114.95 3g6j s ARG 833 Ca 0.29 1.97 -0.20 0.00 -1.72 0.00 0.00 55.73 56.07 3g6j s ARG 833 Cb 0.14 -1.93 -0.17 0.00 -0.45 0.00 0.00 34.95 32.55 3g6j s ARG 833 CO 0.23 -1.37 0.37 0.37 -0.68 0.00 0.00 175.30 174.21 3g6j h GLN 834 N 0.81 0.00 -1.40 3.54 5.75 -1.95 -1.71 115.11 120.15 3g6j h GLN 834 Ca -0.51 0.00 -0.45 0.00 -0.15 0.00 0.00 58.65 57.55 3g6j h GLN 834 Cb 1.32 0.00 -0.41 0.00 1.07 0.00 0.00 27.48 29.46 3g6j h GLN 834 CO 0.54 0.72 -1.06 0.27 -2.65 0.00 0.00 178.83 176.65 3g6j n ASN 835 N -4.59 2.21 -3.63 -0.69 0.23 -1.26 -4.62 115.26 102.92 3g6j n ASN 835 Ca -0.15 -3.05 -0.12 0.00 -0.53 0.00 0.00 54.58 50.74 3g6j n ASN 835 Cb 0.44 -0.54 -0.07 0.00 -2.08 0.00 0.00 39.78 37.53 3g6j n ASN 835 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3g6j s GLN 836 N -3.10 0.68 0.68 -3.83 -2.07 -1.26 -5.09 119.66 105.67 3g6j s GLN 836 Ca 0.35 0.74 -0.11 0.00 -1.82 0.00 0.00 55.36 54.53 3g6j s GLN 836 Cb 0.41 0.33 -0.00 0.00 -1.09 0.00 0.00 33.01 32.66 3g6j s GLN 836 CO -0.04 -0.10 1.05 -1.83 -1.32 0.00 0.00 175.29 173.06 3g6j s GLU 837 N 0.18 3.10 -0.07 9.60 -1.05 -1.26 -3.97 118.70 125.23 3g6j s GLU 837 Ca 0.01 0.84 0.04 0.00 -0.15 0.00 0.00 54.97 55.71 3g6j s GLU 837 Cb -0.05 -2.02 -0.02 0.00 -0.44 0.00 0.00 34.13 31.61 3g6j s GLU 837 CO -0.02 -0.95 -0.18 -0.51 0.95 0.00 0.00 175.26 174.55 3g6j s LEU 838 N -5.43 2.50 -0.48 1.83 1.43 -0.21 -4.96 118.68 113.36 3g6j s LEU 838 Ca 0.57 -0.33 -0.17 0.00 -1.03 0.00 0.00 54.13 53.18 3g6j s LEU 838 Cb -0.13 -1.50 0.06 0.00 0.03 0.00 0.00 46.19 44.65 3g6j s LEU 838 CO 0.54 0.28 0.48 -0.75 0.23 0.00 0.00 176.35 177.14 3g6j s LYS 839 N -0.35 3.04 -0.09 1.70 2.20 -1.26 -1.17 119.74 123.80 3g6j s LYS 839 Ca 0.03 -1.14 -0.02 0.00 -0.36 0.00 0.00 55.97 54.48 3g6j s LYS 839 Cb -0.12 -4.11 -0.03 0.00 -1.51 0.00 0.00 37.83 32.06 3g6j s LYS 839 CO 0.02 -1.08 0.01 0.08 -0.36 0.00 0.00 175.35 174.02 3g6j s VAL 840 N 2.04 4.40 -0.20 4.02 1.01 -0.45 -0.65 120.40 130.57 3g6j s VAL 840 Ca 0.09 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 61.77 3g6j s VAL 840 Cb -0.22 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.26 3g6j s VAL 840 CO 0.09 0.61 0.08 -0.60 0.00 0.00 0.00 175.10 175.28 3g6j s ARG 841 N -0.88 3.99 0.10 2.72 3.52 -0.03 -0.78 118.95 127.59 3g6j s ARG 841 Ca 0.13 -0.33 0.09 0.00 -0.13 0.00 0.00 55.73 55.49 3g6j s ARG 841 Cb -0.11 -3.28 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 3g6j s ARG 841 CO 0.02 0.22 -0.22 0.54 -0.81 0.00 0.00 175.30 175.05 3g6j s VAL 842 N 0.54 1.80 -0.08 7.11 0.11 -0.26 -0.78 120.40 128.85 3g6j s VAL 842 Ca 0.04 -1.54 -0.05 0.00 -2.93 0.00 0.00 61.98 57.51 3g6j s VAL 842 Cb -0.13 -1.62 0.03 0.00 -1.53 0.00 0.00 36.38 33.14 3g6j s VAL 842 CO 0.01 0.00 0.19 -0.70 -3.33 0.00 0.00 175.10 171.27 3g6j s GLU 843 N -1.84 0.18 -0.20 1.54 2.12 0.44 -1.71 118.70 119.23 3g6j s GLU 843 Ca 0.08 0.38 -0.19 0.00 0.36 0.00 0.00 54.97 55.60 3g6j s GLU 843 Cb -0.10 -0.05 -0.03 0.00 0.26 0.00 0.00 34.13 34.21 3g6j s GLU 843 CO 0.04 -0.11 0.55 -1.17 -0.54 0.00 0.00 175.26 174.03 3g6j s LEU 844 N 0.79 4.14 0.32 2.70 2.96 -0.93 -0.73 118.68 127.93 3g6j s LEU 844 Ca -0.06 0.72 -0.26 0.00 -0.22 0.00 0.00 54.13 54.31 3g6j s LEU 844 Cb -0.07 -2.76 -0.10 0.00 0.50 0.00 0.00 46.19 43.76 3g6j s LEU 844 CO -0.04 -0.21 0.97 -0.76 -1.32 0.00 0.00 176.35 174.98 3g6j s LEU 845 N 1.74 4.36 0.56 -0.68 1.02 -0.50 -4.18 118.68 120.99 3g6j s LEU 845 Ca 0.25 1.90 -0.21 0.00 0.02 0.00 0.00 54.13 56.10 3g6j s LEU 845 Cb -0.16 -3.98 -0.04 0.00 0.02 0.00 0.00 46.19 42.03 3g6j s LEU 845 CO 0.10 -0.11 1.28 -2.28 0.02 0.00 0.00 176.35 175.36 3g6j s HIS 846 N -1.55 2.38 -0.21 0.29 5.65 -1.26 -4.73 115.29 115.86 3g6j s HIS 846 Ca 0.50 1.45 -0.08 0.00 0.25 0.00 0.00 55.06 57.18 3g6j s HIS 846 Cb -0.21 -3.64 0.09 0.00 -1.18 0.00 0.00 32.58 27.64 3g6j s HIS 846 CO 0.26 -2.50 0.46 1.21 -0.65 0.00 0.00 174.74 173.52 3g6j s ASN 847 N -1.24 -0.45 0.64 9.88 3.84 -1.26 -5.03 114.94 121.32 3g6j s ASN 847 Ca 0.73 1.08 0.42 0.00 0.21 0.00 0.00 52.86 55.30 3g6j s ASN 847 Cb -0.36 1.36 2.16 0.00 -0.55 0.00 0.00 41.25 43.87 3g6j s ASN 847 CO 0.41 -0.22 2.28 -0.65 -2.79 0.00 0.00 177.10 176.12 3g6j h PRO 848 N 7.89 0.00 0.00 0.43 0.11 -1.97 -0.58 132.00 137.88 3g6j h PRO 848 Ca -0.21 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.87 3g6j h PRO 848 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3g6j h PRO 848 CO 0.15 0.00 -0.14 0.00 -0.21 0.00 0.00 178.00 177.81 3g6j h ALA 849 N 2.00 1.11 -1.92 -0.75 0.00 -1.96 -3.45 119.26 114.29 3g6j h ALA 849 Ca -0.00 -0.12 -0.60 0.00 0.00 0.00 0.00 54.91 54.19 3g6j h ALA 849 Cb 0.13 -0.02 -0.12 0.00 0.00 0.00 0.00 17.79 17.79 3g6j h ALA 849 CO 0.00 0.17 -0.63 -0.06 0.00 0.00 0.00 179.25 178.73 3g6j s PHE 850 N -3.89 2.50 -0.19 0.00 0.40 -0.23 -0.95 117.98 115.63 3g6j s PHE 850 Ca -0.01 -0.46 -0.01 0.00 -0.60 0.00 0.00 56.93 55.85 3g6j s PHE 850 Cb 0.11 -1.46 0.00 0.00 0.51 0.00 0.00 43.02 42.18 3g6j s PHE 850 CO 0.59 0.51 -0.13 0.00 0.70 0.00 0.00 175.22 176.89 3g6j s SER 852 N 1.26 -0.03 0.64 0.00 1.04 -1.26 -1.77 113.70 113.58 3g6j s SER 852 Ca 0.03 -0.92 0.39 0.00 0.48 0.00 0.00 55.95 55.93 3g6j s SER 852 Cb -0.14 0.66 2.16 0.00 0.10 0.00 0.00 66.02 68.81 3g6j s SER 852 CO -0.07 -1.27 2.29 -0.07 0.98 0.00 0.00 173.24 175.10 3g6j h LEU 853 N 2.14 0.00 -8.87 2.42 3.38 -1.98 -3.39 115.31 109.01 3g6j h LEU 853 Ca -0.25 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.15 3g6j h LEU 853 Cb 1.25 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 3g6j h LEU 853 CO 0.33 0.00 1.17 0.00 0.09 0.00 0.00 178.44 180.03 3g6j s ALA 854 N -4.32 3.02 0.43 1.53 0.00 -1.26 -4.64 121.76 116.52 3g6j s ALA 854 Ca -0.05 0.16 0.07 0.00 0.00 0.00 0.00 51.96 52.14 3g6j s ALA 854 Cb 0.13 -3.95 -0.03 0.00 0.00 0.00 0.00 23.12 19.27 3g6j s ALA 854 CO 0.45 -2.40 0.27 0.95 0.00 0.00 0.00 175.76 175.03 3g6j s THR 855 N 6.02 2.34 0.45 0.00 -4.23 0.39 -4.62 115.64 115.99 3g6j s THR 855 Ca 0.71 -1.56 0.11 0.00 -1.18 0.00 0.00 61.69 59.78 3g6j s THR 855 Cb -0.20 -2.89 0.27 0.00 1.34 0.00 0.00 72.50 71.02 3g6j s THR 855 CO 0.32 0.00 2.09 0.00 -0.54 0.00 0.00 174.62 176.49 3g6j h THR 856 N 1.21 1.05 -0.06 3.99 1.03 -1.97 -2.87 112.91 115.29 3g6j h THR 856 Ca -0.42 -0.11 0.00 0.00 -0.01 0.00 0.00 66.41 65.87 3g6j h THR 856 Cb 1.26 0.69 0.00 0.00 -1.07 0.00 0.00 68.15 69.03 3g6j h THR 856 CO 0.64 0.06 0.00 0.29 -0.01 0.00 0.00 175.52 176.50 3g6j n LYS 857 N -4.50 1.17 -3.86 0.00 5.02 -1.26 -4.95 118.16 109.78 3g6j n LYS 857 Ca 0.01 -1.19 -0.22 0.00 -2.02 0.00 0.00 58.31 54.89 3g6j n LYS 857 Cb 0.10 -1.08 -0.17 0.00 -0.02 0.00 0.00 35.03 33.85 3g6j n LYS 857 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3g6j s ARG 858 N -0.65 0.63 0.52 1.97 3.52 -1.08 -5.14 118.95 118.71 3g6j s ARG 858 Ca 0.06 0.06 -0.18 0.00 -0.13 0.00 0.00 55.73 55.54 3g6j s ARG 858 Cb 0.04 -0.91 -0.07 0.00 -1.56 0.00 0.00 34.95 32.44 3g6j s ARG 858 CO 0.05 -0.25 1.02 1.03 -0.81 0.00 0.00 175.30 176.35 3g6j s ARG 859 N 1.69 3.73 -0.64 5.12 0.52 -1.26 -0.46 118.95 127.64 3g6j s ARG 859 Ca 0.01 1.22 -0.07 0.00 -0.52 0.00 0.00 55.73 56.37 3g6j s ARG 859 Cb -0.13 -2.09 0.17 0.00 0.52 0.00 0.00 34.95 33.42 3g6j s ARG 859 CO -0.04 -0.47 0.50 -1.58 0.02 0.00 0.00 175.30 173.72 3g6j s HIS 860 N -2.25 3.51 -0.06 -0.53 5.65 -1.26 -4.85 115.29 115.49 3g6j s HIS 860 Ca 0.64 -2.40 0.02 0.00 0.25 0.00 0.00 55.06 53.57 3g6j s HIS 860 Cb -0.14 -3.40 0.02 0.00 -1.18 0.00 0.00 32.58 27.88 3g6j s HIS 860 CO 0.26 -0.91 -0.09 1.14 -0.65 0.00 0.00 174.74 174.49 3g6j s GLN 861 N 0.26 1.39 0.23 2.88 -2.07 -1.26 -2.20 119.66 118.89 3g6j s GLN 861 Ca 0.15 -0.30 0.07 0.00 -1.82 0.00 0.00 55.36 53.46 3g6j s GLN 861 Cb -0.19 -1.22 -0.04 0.00 -1.09 0.00 0.00 33.01 30.47 3g6j s GLN 861 CO -0.04 -0.02 0.11 -0.65 -1.32 0.00 0.00 175.29 173.36 3g6j s GLN 862 N 0.80 2.68 -0.34 9.60 1.11 -0.69 -4.97 119.66 127.85 3g6j s GLN 862 Ca -0.12 -1.12 -0.03 0.00 0.01 0.00 0.00 55.36 54.09 3g6j s GLN 862 Cb -0.15 -2.45 0.07 0.00 -1.01 0.00 0.00 33.01 29.47 3g6j s GLN 862 CO 0.02 0.42 0.09 0.99 0.01 0.00 0.00 175.29 176.81 3g6j s THR 863 N -2.05 3.26 0.39 -0.19 2.01 -1.26 -1.10 115.64 116.70 3g6j s THR 863 Ca 0.31 -1.55 0.06 0.00 0.31 0.00 0.00 61.69 60.82 3g6j s THR 863 Cb -0.08 -2.98 -0.00 0.00 0.01 0.00 0.00 72.50 69.44 3g6j s THR 863 CO 0.22 -0.31 0.54 0.68 -0.69 0.00 0.00 174.62 175.07 3g6j s VAL 864 N 1.25 3.73 -0.29 3.82 -7.23 0.04 -4.96 120.40 116.77 3g6j s VAL 864 Ca -0.00 -0.90 0.01 0.00 -1.81 0.00 0.00 61.98 59.28 3g6j s VAL 864 Cb -0.21 -3.30 0.08 0.00 0.56 0.00 0.00 36.38 33.51 3g6j s VAL 864 CO -0.01 -0.14 0.03 -0.89 -0.31 0.00 0.00 175.10 173.78 3g6j s THR 865 N -2.31 1.44 -0.18 5.32 2.01 -1.26 -1.33 115.64 119.33 3g6j s THR 865 Ca 0.49 -1.55 -0.24 0.00 0.31 0.00 0.00 61.69 60.70 3g6j s THR 865 Cb -0.10 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 3g6j s THR 865 CO 0.33 -0.44 0.76 -0.63 -0.69 0.00 0.00 174.62 173.95 3g6j s ILE 866 N 1.37 4.94 1.10 1.82 1.01 -0.32 -4.90 121.20 126.21 3g6j s ILE 866 Ca 0.04 1.47 -0.13 0.00 0.00 0.00 0.00 60.65 62.03 3g6j s ILE 866 Cb -0.18 -4.07 0.25 0.00 0.01 0.00 0.00 42.46 38.47 3g6j s ILE 866 CO -0.13 0.06 1.05 -2.84 0.00 0.00 0.00 174.94 173.08 3g6j s PRO 867 N 2.02 -0.40 0.48 2.79 0.02 -1.26 -1.05 135.00 137.60 3g6j s PRO 867 Ca 0.35 0.68 -0.22 0.00 0.02 0.00 0.00 61.00 61.82 3g6j s PRO 867 Cb -0.16 -1.63 -0.07 0.00 0.02 0.00 0.00 34.50 32.66 3g6j s PRO 867 CO 0.12 -3.33 1.18 -2.14 -0.33 0.00 0.00 177.00 172.49 3g6j s PRO 868 N -4.68 3.62 -1.43 5.54 0.02 -1.25 -3.61 135.00 133.20 3g6j s PRO 868 Ca 0.67 1.80 -0.02 0.00 0.02 0.00 0.00 61.00 63.47 3g6j s PRO 868 Cb -0.22 -2.32 0.00 0.00 0.02 0.00 0.00 34.50 31.98 3g6j s PRO 868 CO 0.62 -0.67 0.32 1.63 -0.33 0.00 0.00 177.00 178.56 3g6j n LYS 869 N -0.68 -2.49 -3.91 5.54 5.02 -0.20 -4.95 118.16 116.49 3g6j n LYS 869 Ca 0.08 0.31 -0.08 0.00 -2.02 0.00 0.00 58.31 56.60 3g6j n LYS 869 Cb 0.48 -4.20 -0.04 0.00 -0.02 0.00 0.00 35.03 31.26 3g6j n LYS 869 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3g6j s SER 870 N -4.33 -0.19 0.36 4.39 1.04 -1.08 -5.01 113.70 108.89 3g6j s SER 870 Ca 0.03 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 55.76 3g6j s SER 870 Cb -0.01 0.65 -0.05 0.00 0.10 0.00 0.00 66.02 66.72 3g6j s SER 870 CO 0.92 -1.23 0.09 -0.94 0.98 0.00 0.00 173.24 173.06 3g6j s SER 871 N -2.96 2.52 -0.04 7.02 1.04 -1.26 -1.21 113.70 118.80 3g6j s SER 871 Ca 0.16 -1.51 -0.17 0.00 0.48 0.00 0.00 55.95 54.91 3g6j s SER 871 Cb -0.03 0.19 0.03 0.00 0.10 0.00 0.00 66.02 66.31 3g6j s SER 871 CO 0.07 -0.75 0.39 -0.22 0.98 0.00 0.00 173.24 173.70 3g6j s LEU 872 N -3.54 0.53 -0.13 2.42 0.20 -0.44 -4.94 118.68 112.80 3g6j s LEU 872 Ca 0.30 0.31 -0.02 0.00 0.69 0.00 0.00 54.13 55.41 3g6j s LEU 872 Cb 0.06 1.50 -0.03 0.00 -0.43 0.00 0.00 46.19 47.30 3g6j s LEU 872 CO 0.15 -0.43 -0.06 -0.44 -0.29 0.00 0.00 176.35 175.28 3g6j s SER 873 N -1.06 4.62 -0.24 3.68 0.01 -1.26 -0.55 113.70 118.89 3g6j s SER 873 Ca -0.11 -0.14 -0.01 0.00 1.31 0.00 0.00 55.95 57.00 3g6j s SER 873 Cb -0.04 -1.60 0.03 0.00 0.21 0.00 0.00 66.02 64.62 3g6j s SER 873 CO 0.05 0.22 -0.07 -0.69 0.41 0.00 0.00 173.24 173.15 3g6j s VAL 874 N 0.06 2.80 0.23 3.43 1.01 -0.48 -4.77 120.40 122.68 3g6j s VAL 874 Ca -0.01 -1.04 -0.19 0.00 0.00 0.00 0.00 61.98 60.74 3g6j s VAL 874 Cb -0.14 -2.42 -0.08 0.00 0.00 0.00 0.00 36.38 33.74 3g6j s VAL 874 CO 0.03 0.21 0.72 -2.16 0.00 0.00 0.00 175.10 173.90 3g6j s PRO 875 N 1.31 4.22 -0.13 2.72 0.05 -1.26 -1.20 135.00 140.72 3g6j s PRO 875 Ca 0.00 0.84 -0.02 0.00 0.05 0.00 0.00 61.00 61.87 3g6j s PRO 875 Cb -0.17 -2.84 0.04 0.00 0.05 0.00 0.00 34.50 31.58 3g6j s PRO 875 CO -0.05 0.38 0.00 0.71 0.05 0.00 0.00 177.00 178.09 3g6j s TYR 876 N -1.56 0.98 -0.09 0.56 2.02 0.45 -4.97 117.35 114.73 3g6j s TYR 876 Ca 0.44 -0.56 -0.21 0.00 -0.37 0.00 0.00 57.07 56.37 3g6j s TYR 876 Cb -0.16 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.39 3g6j s TYR 876 CO 0.21 -0.47 0.61 0.14 -1.57 0.00 0.00 175.55 174.46 3g6j s VAL 877 N 1.87 5.10 0.04 0.71 -7.23 -1.26 -1.07 120.40 118.57 3g6j s VAL 877 Ca 0.02 1.25 -0.07 0.00 -1.81 0.00 0.00 61.98 61.38 3g6j s VAL 877 Cb -0.14 -3.95 -0.01 0.00 0.56 0.00 0.00 36.38 32.84 3g6j s VAL 877 CO -0.07 0.28 0.13 0.27 -0.31 0.00 0.00 175.10 175.41 3g6j s ILE 878 N 0.71 0.13 -0.20 -0.62 -4.36 -0.20 -4.62 121.20 112.04 3g6j s ILE 878 Ca 0.33 -1.06 -0.01 0.00 -0.26 0.00 0.00 60.65 59.65 3g6j s ILE 878 Cb -0.17 -0.95 0.06 0.00 1.25 0.00 0.00 42.46 42.65 3g6j s ILE 878 CO 0.15 -0.58 -0.02 -0.69 0.24 0.00 0.00 174.94 174.04 3g6j s VAL 879 N -2.72 1.04 0.33 8.37 1.01 -0.73 -1.02 120.40 126.67 3g6j s VAL 879 Ca -0.04 -0.82 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 3g6j s VAL 879 Cb -0.00 -1.38 -0.10 0.00 0.00 0.00 0.00 36.38 34.90 3g6j s VAL 879 CO -0.05 -0.09 1.33 -2.84 0.00 0.00 0.00 175.10 173.46 3g6j s PRO 880 N 1.63 4.33 0.00 2.72 0.02 -1.26 -1.17 135.00 141.26 3g6j s PRO 880 Ca -0.02 2.25 0.00 0.00 0.02 0.00 0.00 61.00 63.24 3g6j s PRO 880 Cb -0.17 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.28 3g6j s PRO 880 CO -0.07 -0.24 0.00 1.28 -0.33 0.00 0.00 177.00 177.64 3g6j n LEU 881 N 0.94 0.00 -4.34 -5.54 4.77 -0.12 -0.39 117.00 112.32 3g6j n LEU 881 Ca 0.01 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 3g6j n LEU 881 Cb 0.41 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.36 3g6j n LEU 881 CO 0.60 0.00 -0.44 -0.75 -1.33 0.00 0.00 177.39 175.46 3g6j s LYS 882 N -1.75 3.35 0.58 3.23 2.20 -1.20 -4.76 119.74 121.40 3g6j s LYS 882 Ca 0.00 -0.69 -0.17 0.00 -0.36 0.00 0.00 55.97 54.75 3g6j s LYS 882 Cb 0.00 -2.70 -0.04 0.00 -1.51 0.00 0.00 37.83 33.58 3g6j s LYS 882 CO 0.00 0.10 1.08 -0.08 -0.36 0.00 0.00 175.35 176.09 3g6j s THR 883 N 0.65 3.57 0.00 3.43 -1.32 -1.26 -4.80 115.64 115.91 3g6j s THR 883 Ca -0.06 0.81 0.00 0.00 -1.21 0.00 0.00 61.69 61.23 3g6j s THR 883 Cb -0.15 -3.31 0.00 0.00 -1.51 0.00 0.00 72.50 67.53 3g6j s THR 883 CO 0.02 -0.38 0.00 0.61 -2.21 0.00 0.00 174.62 172.67 3g6j n GLY 884 N -0.59 -0.71 3.62 6.08 0.00 -0.00 -4.92 105.19 108.67 3g6j n GLY 884 Ca 0.10 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 3g6j n GLY 884 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g6j s LEU 885 N 0.00 3.77 0.41 0.99 2.96 -1.26 -0.10 118.68 125.44 3g6j s LEU 885 Ca 0.00 1.21 0.04 0.00 -0.22 0.00 0.00 54.13 55.16 3g6j s LEU 885 Cb 0.00 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 43.10 3g6j s LEU 885 CO 0.00 -1.28 0.04 -1.10 -1.32 0.00 0.00 176.35 172.69 3g6j s GLN 886 N 4.64 1.91 -0.06 1.98 -1.52 -0.36 -4.97 119.66 121.29 3g6j s GLN 886 Ca 0.63 -2.12 0.03 0.00 -1.95 0.00 0.00 55.36 51.95 3g6j s GLN 886 Cb -0.18 -1.23 0.01 0.00 -0.22 0.00 0.00 33.01 31.38 3g6j s GLN 886 CO 0.28 -0.22 -0.13 -1.21 -0.25 0.00 0.00 175.29 173.76 3g6j s GLU 887 N -3.80 1.70 -0.11 2.91 2.02 -1.26 -1.01 118.70 119.14 3g6j s GLU 887 Ca 0.28 -0.45 -0.00 0.00 0.02 0.00 0.00 54.97 54.82 3g6j s GLU 887 Cb 0.07 -1.41 -0.02 0.00 0.10 0.00 0.00 34.13 32.86 3g6j s GLU 887 CO 0.14 0.07 -0.10 0.08 0.02 0.00 0.00 175.26 175.46 3g6j s VAL 888 N 0.52 3.33 -0.06 2.63 1.01 -0.57 -4.99 120.40 122.28 3g6j s VAL 888 Ca -0.12 -0.58 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 3g6j s VAL 888 Cb -0.15 -2.39 0.03 0.00 0.00 0.00 0.00 36.38 33.87 3g6j s VAL 888 CO 0.03 0.54 -0.02 -0.70 0.00 0.00 0.00 175.10 174.96 3g6j s GLU 889 N 0.00 0.68 0.01 2.72 2.12 -1.26 -2.12 118.70 120.85 3g6j s GLU 889 Ca -0.02 0.02 0.07 0.00 0.36 0.00 0.00 54.97 55.40 3g6j s GLU 889 Cb -0.14 -0.90 -0.02 0.00 0.26 0.00 0.00 34.13 33.34 3g6j s GLU 889 CO 0.04 -0.21 -0.20 0.54 -0.54 0.00 0.00 175.26 174.88 3g6j s VAL 890 N 1.52 1.63 0.11 3.70 0.11 -0.95 -1.41 120.40 125.11 3g6j s VAL 890 Ca -0.02 -1.02 0.08 0.00 -2.93 0.00 0.00 61.98 58.10 3g6j s VAL 890 Cb -0.13 -1.38 -0.04 0.00 -1.53 0.00 0.00 36.38 33.30 3g6j s VAL 890 CO -0.03 0.34 -0.20 -0.54 -3.33 0.00 0.00 175.10 171.33 3g6j s LYS 891 N -0.79 1.15 0.03 1.54 1.02 0.09 -1.53 119.74 121.24 3g6j s LYS 891 Ca 0.08 -1.20 0.02 0.00 0.02 0.00 0.00 55.97 54.89 3g6j s LYS 891 Cb -0.08 -1.38 -0.02 0.00 -0.52 0.00 0.00 37.83 35.83 3g6j s LYS 891 CO 0.00 0.31 -0.08 0.00 -0.92 0.00 0.00 175.35 174.67 3g6j s ALA 892 N -1.30 0.60 -0.00 5.17 0.00 0.51 -0.42 121.76 126.31 3g6j s ALA 892 Ca 0.08 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.40 3g6j s ALA 892 Cb -0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 23.12 23.01 3g6j s ALA 892 CO 0.05 0.03 -0.04 0.00 0.00 0.00 0.00 175.76 175.80 3g6j s ALA 893 N -1.05 0.31 -0.11 0.00 0.00 0.04 -0.90 121.76 120.05 3g6j s ALA 893 Ca -0.06 -0.15 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 3g6j s ALA 893 Cb -0.08 -0.09 -0.05 0.00 0.00 0.00 0.00 23.12 22.90 3g6j s ALA 893 CO 0.00 0.07 0.27 0.14 0.00 0.00 0.00 175.76 176.25 3g6j s VAL 894 N -0.04 5.30 0.64 0.00 -7.23 -0.95 -0.85 120.40 117.27 3g6j s VAL 894 Ca 0.01 0.51 -0.16 0.00 -1.81 0.00 0.00 61.98 60.53 3g6j s VAL 894 Cb -0.02 -3.58 -0.01 0.00 0.56 0.00 0.00 36.38 33.33 3g6j s VAL 894 CO -0.00 0.50 1.12 -0.31 -0.31 0.00 0.00 175.10 176.09 3g6j s TYR 895 N -0.30 2.59 -1.63 2.82 1.51 0.17 -3.91 117.35 118.61 3g6j s TYR 895 Ca 0.17 1.55 0.00 0.00 -1.01 0.00 0.00 57.07 57.79 3g6j s TYR 895 Cb -0.13 -3.21 0.00 0.00 -0.11 0.00 0.00 41.96 38.51 3g6j s TYR 895 CO 0.06 -1.73 0.00 0.72 -1.11 0.00 0.00 175.55 173.49 3g6j n HIS 896 N -2.26 0.00 -3.72 2.71 8.25 -1.06 -4.72 115.22 114.43 3g6j n HIS 896 Ca 0.11 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.43 3g6j n HIS 896 Cb 0.52 -2.88 -0.08 0.00 1.12 0.00 0.00 29.99 28.67 3g6j n HIS 896 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3g6j s HIS 897 N -2.44 -0.24 -1.38 4.41 3.76 -1.25 -5.04 115.29 113.10 3g6j s HIS 897 Ca 0.00 0.33 -0.09 0.00 -0.15 0.00 0.00 55.06 55.16 3g6j s HIS 897 Cb 0.00 0.15 -0.08 0.00 1.11 0.00 0.00 32.58 33.76 3g6j s HIS 897 CO 0.00 -0.45 2.74 1.19 -0.85 0.00 0.00 174.74 177.37 3g6j n PHE 898 N 1.06 2.05 -4.73 1.40 3.01 -1.26 -4.73 117.46 114.26 3g6j n PHE 898 Ca -0.21 -2.73 -0.25 0.00 1.01 0.00 0.00 57.45 55.27 3g6j n PHE 898 Cb 0.57 -2.24 -0.16 0.00 -0.01 0.00 0.00 39.48 37.64 3g6j n PHE 898 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 3g6j s ILE 899 N 2.48 1.30 0.09 4.37 -1.09 -1.26 -5.11 121.20 121.98 3g6j s ILE 899 Ca 0.61 -0.62 -0.19 0.00 -2.23 0.00 0.00 60.65 58.22 3g6j s ILE 899 Cb 0.16 -1.13 0.04 0.00 -1.58 0.00 0.00 42.46 39.95 3g6j s ILE 899 CO -0.05 0.38 0.46 -0.94 -1.23 0.00 0.00 174.94 173.56 3g6j s SER 900 N 0.23 -0.35 0.15 3.58 1.04 -1.26 -2.24 113.70 114.85 3g6j s SER 900 Ca -0.07 -0.08 -0.10 0.00 0.48 0.00 0.00 55.95 56.17 3g6j s SER 900 Cb -0.12 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.48 3g6j s SER 900 CO 0.03 -0.80 0.30 -0.62 0.98 0.00 0.00 173.24 173.13 3g6j s ASP 901 N -2.42 0.00 -0.28 7.02 2.15 -0.07 -5.00 116.67 118.06 3g6j s ASP 901 Ca -0.01 -0.74 -0.19 0.00 0.43 0.00 0.00 52.55 52.04 3g6j s ASP 901 Cb 0.00 0.44 0.12 0.00 -0.30 0.00 0.00 42.92 43.18 3g6j s ASP 901 CO -0.08 -0.88 0.91 -0.83 -0.17 0.00 0.00 175.17 174.12 3g6j s GLY 902 N -2.92 -0.22 -0.13 2.66 0.00 -1.26 -0.37 107.32 105.09 3g6j s GLY 902 Ca 0.13 2.79 0.02 0.00 0.00 0.00 0.00 44.72 47.66 3g6j s GLY 902 CO -0.03 2.31 -0.18 0.14 0.00 0.00 0.00 173.10 175.33 3g6j s VAL 903 N 1.07 2.54 -0.37 1.40 1.01 -0.59 0.25 120.40 125.70 3g6j s VAL 903 Ca -0.06 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.12 3g6j s VAL 903 Cb -0.04 -2.03 0.11 0.00 0.00 0.00 0.00 36.38 34.41 3g6j s VAL 903 CO -0.13 0.54 0.10 -0.60 0.00 0.00 0.00 175.10 175.00 3g6j s ARG 904 N 0.48 1.52 0.32 2.72 3.52 -0.16 -2.24 118.95 125.11 3g6j s ARG 904 Ca -0.12 -1.97 0.08 0.00 -0.13 0.00 0.00 55.73 53.58 3g6j s ARG 904 Cb -0.17 -3.13 -0.03 0.00 -1.56 0.00 0.00 34.95 30.06 3g6j s ARG 904 CO 0.05 -0.98 0.22 0.15 -0.81 0.00 0.00 175.30 173.93 3g6j s LYS 905 N 0.71 2.64 0.30 5.12 1.02 -0.90 -4.47 119.74 124.16 3g6j s LYS 905 Ca 0.12 -1.33 0.10 0.00 0.02 0.00 0.00 55.97 54.88 3g6j s LYS 905 Cb -0.20 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.66 3g6j s LYS 905 CO -0.07 0.16 -0.05 -1.12 -0.92 0.00 0.00 175.35 173.35 3g6j s SER 906 N -3.91 4.13 0.03 2.83 0.01 -1.26 -1.51 113.70 114.02 3g6j s SER 906 Ca 0.38 -0.89 -0.18 0.00 1.31 0.00 0.00 55.95 56.57 3g6j s SER 906 Cb -0.05 -0.57 0.03 0.00 0.21 0.00 0.00 66.02 65.64 3g6j s SER 906 CO 0.25 -0.09 0.40 -1.48 0.41 0.00 0.00 173.24 172.73 3g6j s LEU 907 N -3.65 0.46 -0.38 2.44 2.34 -0.18 -4.96 118.68 114.76 3g6j s LEU 907 Ca 0.32 0.02 -0.21 0.00 0.06 0.00 0.00 54.13 54.32 3g6j s LEU 907 Cb -0.03 1.68 0.01 0.00 -0.56 0.00 0.00 46.19 47.28 3g6j s LEU 907 CO 0.18 -0.63 0.68 -0.54 -1.06 0.00 0.00 176.35 174.98 3g6j s LYS 908 N -2.30 3.62 -0.11 1.48 1.02 -1.17 -1.23 119.74 121.05 3g6j s LYS 908 Ca -0.06 0.03 -0.23 0.00 0.02 0.00 0.00 55.97 55.73 3g6j s LYS 908 Cb -0.01 -3.84 -0.03 0.00 -0.52 0.00 0.00 37.83 33.43 3g6j s LYS 908 CO -0.01 -0.83 0.69 0.08 -0.92 0.00 0.00 175.35 174.36 3g6j s VAL 909 N 2.85 5.03 0.06 3.17 1.01 0.86 -2.46 120.40 130.91 3g6j s VAL 909 Ca 0.26 1.38 0.09 0.00 0.00 0.00 0.00 61.98 63.71 3g6j s VAL 909 Cb -0.14 -4.02 -0.03 0.00 0.00 0.00 0.00 36.38 32.19 3g6j s VAL 909 CO 0.16 0.20 -0.24 -0.69 0.00 0.00 0.00 175.10 174.54 3g6j s VAL 910 N 1.16 1.92 0.98 2.92 1.01 -0.38 -0.82 120.40 127.18 3g6j s VAL 910 Ca 0.35 -1.35 -0.15 0.00 0.00 0.00 0.00 61.98 60.83 3g6j s VAL 910 Cb -0.17 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 3g6j s VAL 910 CO 0.15 0.24 -0.18 -2.65 0.00 0.00 0.00 175.10 172.67 3g6j n PRO 911 N 1.68 -0.16 0.21 2.72 -0.02 -1.26 0.58 135.00 138.75 3g6j n PRO 911 Ca -0.17 -0.03 0.05 0.00 -2.02 0.00 0.00 63.50 61.33 3g6j n PRO 911 Cb 0.53 -1.45 0.47 0.00 -0.02 0.00 0.00 33.50 33.03 3g6j n PRO 911 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3g6j h GLU 912 N -1.30 0.00 0.00 -0.52 3.07 -1.96 -3.40 114.58 110.48 3g6j h GLU 912 Ca -0.44 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.42 3g6j h GLU 912 Cb 1.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.20 3g6j h GLU 912 CO 0.29 0.26 0.00 0.41 -1.40 0.00 0.00 179.01 178.57 3g6j n GLY 913 N -0.67 1.13 3.02 -3.84 0.00 -1.26 -4.78 105.19 98.78 3g6j n GLY 913 Ca -0.02 -1.51 -0.10 0.00 0.00 0.00 0.00 46.02 44.39 3g6j n GLY 913 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3g6j s ILE 914 N 0.91 0.09 0.08 -0.61 2.07 -1.08 -4.95 121.20 117.71 3g6j s ILE 914 Ca 0.00 -0.75 -0.30 0.00 -1.41 0.00 0.00 60.65 58.19 3g6j s ILE 914 Cb 0.00 -0.31 -0.05 0.00 0.13 0.00 0.00 42.46 42.23 3g6j s ILE 914 CO 0.00 -0.41 1.05 -0.13 -1.91 0.00 0.00 174.94 173.53 3g6j s ARG 915 N -1.31 4.57 0.05 3.50 1.81 -1.26 -3.17 118.95 123.14 3g6j s ARG 915 Ca -0.14 1.56 0.03 0.00 -1.72 0.00 0.00 55.73 55.46 3g6j s ARG 915 Cb -0.08 -3.38 -0.03 0.00 -0.45 0.00 0.00 34.95 31.01 3g6j s ARG 915 CO 0.00 -0.00 -0.09 -1.64 -0.68 0.00 0.00 175.30 172.88 3g6j s MET 916 N 0.50 0.60 -0.81 3.54 -1.94 -1.17 -5.02 119.30 115.00 3g6j s MET 916 Ca 0.52 -0.80 0.02 0.00 -1.71 0.00 0.00 55.69 53.72 3g6j s MET 916 Cb -0.25 -0.42 0.27 0.00 2.01 0.00 0.00 34.83 36.44 3g6j s MET 916 CO 0.30 0.08 0.99 0.09 -0.01 0.00 0.00 175.02 176.47 3g6j n ASN 917 N 1.43 4.68 -4.80 3.03 3.02 -1.26 -3.89 115.26 117.46 3g6j n ASN 917 Ca -0.22 -3.41 -0.33 0.00 -0.03 0.00 0.00 54.58 50.59 3g6j n ASN 917 Cb 0.54 -0.90 0.01 0.00 -0.61 0.00 0.00 39.78 38.82 3g6j n ASN 917 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 3g6j s LYS 918 N -2.50 3.37 -0.16 3.52 2.20 -1.25 -4.97 119.74 119.94 3g6j s LYS 918 Ca 0.36 1.24 -0.01 0.00 -0.36 0.00 0.00 55.97 57.19 3g6j s LYS 918 Cb 0.10 -2.04 0.05 0.00 -1.51 0.00 0.00 37.83 34.42 3g6j s LYS 918 CO 0.02 -0.78 -0.03 0.99 -0.36 0.00 0.00 175.35 175.19 3g6j s THR 919 N -2.38 0.92 -0.09 3.43 2.01 -1.26 -2.79 115.64 115.48 3g6j s THR 919 Ca 0.64 -0.56 0.13 0.00 0.31 0.00 0.00 61.69 62.22 3g6j s THR 919 Cb -0.16 -1.17 -0.01 0.00 0.01 0.00 0.00 72.50 71.17 3g6j s THR 919 CO 0.35 0.05 1.37 0.58 -0.69 0.00 0.00 174.62 176.28 3g6j h VAL 920 N 6.42 1.03 -2.26 3.82 2.07 -1.93 -3.47 116.25 121.93 3g6j h VAL 920 Ca -0.21 -2.48 0.01 0.00 0.82 0.00 0.00 66.70 64.83 3g6j h VAL 920 Cb 1.11 2.50 -0.17 0.00 -1.52 0.00 0.00 31.29 33.21 3g6j h VAL 920 CO 0.37 0.59 0.32 0.00 0.02 0.00 0.00 177.57 178.86 3g6j s ALA 921 N -2.90 -1.76 -0.40 1.67 0.00 -1.26 -4.82 121.76 112.28 3g6j s ALA 921 Ca 0.03 1.07 0.07 0.00 0.00 0.00 0.00 51.96 53.14 3g6j s ALA 921 Cb 0.08 0.21 0.24 0.00 0.00 0.00 0.00 23.12 23.65 3g6j s ALA 921 CO 0.77 -0.53 0.55 1.33 0.00 0.00 0.00 175.76 177.88 3g6j n VAL 922 N 0.29 -0.65 -2.13 0.00 0.24 -1.26 -2.56 118.33 112.27 3g6j n VAL 922 Ca -0.15 -3.65 -0.10 0.00 -2.04 0.00 0.00 64.34 58.39 3g6j n VAL 922 Cb 0.60 -1.51 0.06 0.00 -1.47 0.00 0.00 33.84 31.52 3g6j n VAL 922 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3g6j n ARG 923 N 1.54 0.09 -4.05 7.34 5.12 -1.11 -5.00 116.66 120.59 3g6j n ARG 923 Ca 0.20 -1.06 -0.20 0.00 -1.93 0.00 0.00 57.85 54.87 3g6j n ARG 923 Cb 0.54 -0.35 -0.16 0.00 -1.16 0.00 0.00 32.46 31.32 3g6j n ARG 923 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3g6j s THR 924 N -1.43 0.43 -0.36 0.55 2.01 -1.26 -3.64 115.64 111.94 3g6j s THR 924 Ca 0.29 -0.04 -0.16 0.00 0.31 0.00 0.00 61.69 62.08 3g6j s THR 924 Cb -0.01 -0.49 -0.00 0.00 0.01 0.00 0.00 72.50 72.01 3g6j s THR 924 CO 0.19 0.21 0.42 -0.76 -0.69 0.00 0.00 174.62 173.99 3g6j s LEU 925 N 1.08 4.51 -0.33 4.42 1.43 -1.26 -4.98 118.68 123.54 3g6j s LEU 925 Ca -0.09 -0.28 0.05 0.00 -1.03 0.00 0.00 54.13 52.78 3g6j s LEU 925 Cb -0.14 -2.41 0.18 0.00 0.03 0.00 0.00 46.19 43.85 3g6j s LEU 925 CO -0.01 -0.43 0.52 -0.62 0.23 0.00 0.00 176.35 176.04 3g6j s ASP 926 N 1.76 -0.62 0.33 2.29 2.15 -1.26 -3.47 116.67 117.85 3g6j s ASP 926 Ca 0.14 -0.47 -0.29 0.00 0.43 0.00 0.00 52.55 52.36 3g6j s ASP 926 Cb -0.16 1.54 -0.12 0.00 -0.30 0.00 0.00 42.92 43.88 3g6j s ASP 926 CO 0.13 -0.28 1.43 -2.65 -0.17 0.00 0.00 175.17 173.63 3g6j n PRO 927 N 4.99 2.41 0.00 4.34 -0.02 -1.26 -3.26 135.00 142.20 3g6j n PRO 927 Ca 0.06 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3g6j n PRO 927 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 3g6j n PRO 927 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3g6j n GLU 928 N 1.03 0.00 -2.52 -0.52 1.02 -1.22 -4.65 120.64 113.77 3g6j n GLU 928 Ca 0.05 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.77 3g6j n GLU 928 Cb 0.36 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.78 3g6j n GLU 928 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3g6j n ARG 929 N 0.00 3.12 -0.15 3.49 1.74 -1.22 -3.89 116.66 119.76 3g6j n ARG 929 Ca 0.00 -3.22 0.00 0.00 -0.77 0.00 0.00 57.85 53.86 3g6j n ARG 929 Cb 0.00 -3.50 0.00 0.00 -1.02 0.00 0.00 32.46 27.94 3g6j n ARG 929 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3g6j n LEU 930 N 8.54 0.20 0.23 0.55 4.77 -1.26 -4.68 117.00 125.35 3g6j n LEU 930 Ca 0.49 0.00 0.15 0.00 -0.03 0.00 0.00 56.01 56.62 3g6j n LEU 930 Cb 0.46 -0.60 0.60 0.00 -2.33 0.00 0.00 43.42 41.54 3g6j n LEU 930 CO 0.77 -0.10 0.94 1.23 -1.33 0.00 0.00 177.39 178.91 3g6j h GLY 931 N 0.00 0.00 -0.45 -0.72 0.00 -1.73 -3.49 103.07 96.68 3g6j h GLY 931 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 47.33 47.38 3g6j h GLY 931 CO 0.00 0.00 -0.13 0.54 0.00 0.00 0.00 176.54 176.95 3g6j n ARG 932 N -2.83 -0.42 -0.08 4.80 1.74 -1.25 -3.94 116.66 114.68 3g6j n ARG 932 Ca 0.01 0.32 -0.03 0.00 -0.77 0.00 0.00 57.85 57.39 3g6j n ARG 932 Cb 0.30 -0.50 0.20 0.00 -1.02 0.00 0.00 32.46 31.44 3g6j n ARG 932 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 3g6j h GLU 933 N -0.18 0.71 -6.39 5.56 5.08 -1.95 -3.24 114.58 114.17 3g6j h GLU 933 Ca -0.01 -0.17 -0.54 0.00 -1.00 0.00 0.00 59.36 57.63 3g6j h GLU 933 Cb 0.18 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3g6j h GLU 933 CO 0.01 0.72 0.67 0.20 -1.00 0.00 0.00 179.01 179.60 3g6j s GLY 934 N -3.75 2.18 0.64 -3.84 0.00 -1.26 -5.00 107.32 96.29 3g6j s GLY 934 Ca -0.09 0.75 -0.18 0.00 0.00 0.00 0.00 44.72 45.20 3g6j s GLY 934 CO 0.80 2.19 1.14 3.33 0.00 0.00 0.00 173.10 180.56 3g6j n VAL 935 N 4.36 4.31 -1.81 1.40 0.24 -1.26 -4.87 118.33 120.70 3g6j n VAL 935 Ca 0.10 -0.49 -0.39 0.00 -2.04 0.00 0.00 64.34 61.53 3g6j n VAL 935 Cb 0.46 -1.32 0.02 0.00 -1.47 0.00 0.00 33.84 31.53 3g6j n VAL 935 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 3g6j s GLN 936 N -3.16 3.51 -0.05 7.34 0.74 -0.85 -4.91 119.66 122.29 3g6j s GLN 936 Ca 0.80 2.34 0.02 0.00 0.05 0.00 0.00 55.36 58.56 3g6j s GLN 936 Cb -0.39 -2.52 0.02 0.00 1.10 0.00 0.00 33.01 31.22 3g6j s GLN 936 CO 0.43 -0.93 -0.07 -1.59 -0.55 0.00 0.00 175.29 172.58 3g6j s LYS 937 N -2.60 1.11 -0.33 1.67 -2.85 -1.26 -2.80 119.74 112.68 3g6j s LYS 937 Ca 0.65 -0.23 -0.01 0.00 -1.00 0.00 0.00 55.97 55.38 3g6j s LYS 937 Cb -0.42 -1.01 0.12 0.00 -2.06 0.00 0.00 37.83 34.45 3g6j s LYS 937 CO 0.53 -0.02 0.16 -2.00 0.10 0.00 0.00 175.35 174.12 3g6j s GLU 938 N 0.73 0.58 -0.07 1.78 2.56 -1.12 -4.98 118.70 118.19 3g6j s GLU 938 Ca -0.12 -1.11 -0.30 0.00 0.00 0.00 0.00 54.97 53.45 3g6j s GLU 938 Cb -0.14 -1.58 -0.02 0.00 2.00 0.00 0.00 34.13 34.39 3g6j s GLU 938 CO 0.01 -1.09 1.05 -0.51 -0.56 0.00 0.00 175.26 174.17 3g6j s ASP 939 N 1.43 7.22 -0.13 -1.70 1.11 -1.26 -1.16 116.67 122.19 3g6j s ASP 939 Ca 0.13 1.64 0.01 0.00 0.18 0.00 0.00 52.55 54.51 3g6j s ASP 939 Cb -0.20 -2.56 -0.01 0.00 1.07 0.00 0.00 42.92 41.22 3g6j s ASP 939 CO -0.18 -0.44 -0.15 -0.63 1.18 0.00 0.00 175.17 174.95 3g6j s ILE 940 N 1.81 2.86 0.77 0.77 1.01 -0.81 -5.01 121.20 122.60 3g6j s ILE 940 Ca 0.51 -0.73 -0.09 0.00 0.00 0.00 0.00 60.65 60.35 3g6j s ILE 940 Cb -0.21 -2.19 0.09 0.00 0.01 0.00 0.00 42.46 40.17 3g6j s ILE 940 CO 0.21 0.53 1.10 -2.16 0.00 0.00 0.00 174.94 174.62 3g6j s PRO 941 N 0.37 1.83 0.92 2.79 0.04 -1.26 -2.89 135.00 136.81 3g6j s PRO 941 Ca -0.12 -0.30 -0.11 0.00 0.04 0.00 0.00 61.00 60.51 3g6j s PRO 941 Cb -0.16 -2.09 0.15 0.00 0.04 0.00 0.00 34.50 32.44 3g6j s PRO 941 CO 0.06 -1.53 1.09 -2.14 0.04 0.00 0.00 177.00 174.52 3g6j s PRO 942 N -5.41 1.00 1.08 0.56 0.02 -1.26 -4.79 135.00 126.20 3g6j s PRO 942 Ca 0.63 1.05 -0.18 0.00 0.02 0.00 0.00 61.00 62.53 3g6j s PRO 942 Cb -0.09 -1.76 0.25 0.00 0.02 0.00 0.00 34.50 32.92 3g6j s PRO 942 CO 0.47 -2.48 1.27 0.00 -0.33 0.00 0.00 177.00 175.92 3g6j s ALA 943 N -2.78 1.59 0.00 -1.55 0.00 -1.26 -4.96 121.76 112.80 3g6j s ALA 943 Ca 0.65 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 51.39 3g6j s ALA 943 Cb -0.20 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.14 3g6j s ALA 943 CO 0.58 -2.98 0.29 -3.47 0.00 0.00 0.00 175.76 170.18 3g6j n ASP 944 N -4.21 0.00 -3.48 0.00 2.03 -1.26 -4.92 116.55 104.71 3g6j n ASP 944 Ca 0.16 0.29 -0.25 0.00 0.52 0.00 0.00 54.79 55.51 3g6j n ASP 944 Cb 0.59 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 41.04 3g6j n ASP 944 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3g6j n LEU 945 N -0.40 -2.72 -0.13 -2.67 4.77 -1.26 -4.85 117.00 109.73 3g6j n LEU 945 Ca 0.00 -0.51 0.09 0.00 -0.03 0.00 0.00 56.01 55.56 3g6j n LEU 945 Cb 0.00 -2.78 -0.07 0.00 -2.33 0.00 0.00 43.42 38.24 3g6j n LEU 945 CO 0.00 0.42 0.05 -1.54 -1.33 0.00 0.00 177.39 174.99 3g6j n SER 946 N -2.73 1.14 -0.81 -1.43 3.41 -1.26 -4.32 113.62 107.62 3g6j n SER 946 Ca -0.02 -1.07 0.07 0.00 -0.26 0.00 0.00 58.87 57.59 3g6j n SER 946 Cb 0.57 0.84 0.22 0.00 -0.26 0.00 0.00 64.21 65.58 3g6j n SER 946 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3g6j n ASP 947 N -1.02 3.55 -4.78 4.04 5.75 -1.26 -5.02 116.55 117.80 3g6j n ASP 947 Ca 0.05 -2.62 -0.37 0.00 -0.01 0.00 0.00 54.79 51.83 3g6j n ASP 947 Cb 0.32 -0.43 -0.03 0.00 -1.03 0.00 0.00 41.12 39.95 3g6j n ASP 947 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 3g6j s GLN 948 N -2.12 4.10 0.08 0.11 0.74 -1.26 -3.96 119.66 117.35 3g6j s GLN 948 Ca 0.35 1.63 -0.31 0.00 0.05 0.00 0.00 55.36 57.08 3g6j s GLN 948 Cb 0.26 -2.58 -0.07 0.00 1.10 0.00 0.00 33.01 31.72 3g6j s GLN 948 CO 0.12 -0.22 1.28 0.08 -0.55 0.00 0.00 175.29 175.99 3g6j s VAL 949 N -1.57 3.73 0.88 1.34 1.01 0.22 -4.96 120.40 121.05 3g6j s VAL 949 Ca 0.58 1.24 -0.11 0.00 0.00 0.00 0.00 61.98 63.69 3g6j s VAL 949 Cb -0.25 -3.79 0.12 0.00 0.00 0.00 0.00 36.38 32.45 3g6j s VAL 949 CO 0.31 0.10 1.09 -2.84 0.00 0.00 0.00 175.10 173.76 3g6j s PRO 950 N 1.08 1.39 -1.31 2.72 0.02 -1.26 -3.70 135.00 133.93 3g6j s PRO 950 Ca 0.61 0.93 -0.05 0.00 0.02 0.00 0.00 61.00 62.51 3g6j s PRO 950 Cb -0.33 -1.82 0.01 0.00 0.02 0.00 0.00 34.50 32.39 3g6j s PRO 950 CO 0.30 -2.18 1.01 -3.47 -0.33 0.00 0.00 177.00 172.33 3g6j n ASP 951 N -3.86 -3.74 -4.02 2.53 2.03 -1.26 -4.96 116.55 103.28 3g6j n ASP 951 Ca 0.08 -0.65 -0.12 0.00 0.52 0.00 0.00 54.79 54.62 3g6j n ASP 951 Cb 0.55 -4.77 -0.11 0.00 -0.72 0.00 0.00 41.12 36.07 3g6j n ASP 951 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3g6j s THR 952 N -3.39 0.35 0.45 5.18 -4.23 -1.24 -5.01 115.64 107.76 3g6j s THR 952 Ca 0.29 -0.94 -0.22 0.00 -1.18 0.00 0.00 61.69 59.64 3g6j s THR 952 Cb -0.13 -0.44 -0.08 0.00 1.34 0.00 0.00 72.50 73.18 3g6j s THR 952 CO 0.76 -0.39 1.07 -1.83 -0.54 0.00 0.00 174.62 173.69 3g6j s GLU 953 N -1.41 3.89 -0.43 3.99 4.04 -1.26 -5.04 118.70 122.48 3g6j s GLU 953 Ca -0.11 1.50 0.03 0.00 0.04 0.00 0.00 54.97 56.42 3g6j s GLU 953 Cb -0.09 -2.30 0.15 0.00 0.02 0.00 0.00 34.13 31.91 3g6j s GLU 953 CO -0.00 -0.38 0.30 -1.54 -1.84 0.00 0.00 175.26 171.80 3g6j s SER 954 N -1.71 2.77 -0.56 0.83 1.04 -1.26 -4.57 113.70 110.24 3g6j s SER 954 Ca 0.64 -2.81 -0.28 0.00 0.48 0.00 0.00 55.95 53.98 3g6j s SER 954 Cb -0.21 -0.70 0.01 0.00 0.10 0.00 0.00 66.02 65.22 3g6j s SER 954 CO 0.26 -0.22 1.44 -0.70 0.98 0.00 0.00 173.24 174.99 3g6j s GLU 955 N 0.23 3.28 -0.90 4.02 2.12 -1.13 -4.25 118.70 122.08 3g6j s GLU 955 Ca 0.24 0.49 -0.25 0.00 0.36 0.00 0.00 54.97 55.81 3g6j s GLU 955 Cb -0.11 -4.14 0.03 0.00 0.26 0.00 0.00 34.13 30.17 3g6j s GLU 955 CO -0.09 -1.96 1.48 0.99 -0.54 0.00 0.00 175.26 175.14 3g6j s THR 956 N 6.18 3.77 0.06 -1.70 2.01 -0.52 -2.22 115.64 123.22 3g6j s THR 956 Ca 0.54 -0.30 -0.10 0.00 0.31 0.00 0.00 61.69 62.13 3g6j s THR 956 Cb -0.11 -4.82 -0.06 0.00 0.01 0.00 0.00 72.50 67.52 3g6j s THR 956 CO 0.25 -1.74 0.39 -0.60 -0.69 0.00 0.00 174.62 172.23 3g6j s ARG 957 N 5.57 3.76 0.11 4.92 3.52 -1.25 -1.87 118.95 133.73 3g6j s ARG 957 Ca 0.47 0.19 0.09 0.00 -0.13 0.00 0.00 55.73 56.34 3g6j s ARG 957 Cb -0.04 -3.04 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 3g6j s ARG 957 CO 0.01 0.59 -0.18 0.42 -0.81 0.00 0.00 175.30 175.33 3g6j s ILE 958 N -1.34 2.86 -0.14 4.11 1.01 -0.95 -2.86 121.20 123.89 3g6j s ILE 958 Ca 0.31 -1.47 -0.02 0.00 0.00 0.00 0.00 60.65 59.47 3g6j s ILE 958 Cb -0.14 -2.30 0.04 0.00 0.01 0.00 0.00 42.46 40.07 3g6j s ILE 958 CO 0.17 0.12 0.01 -0.22 0.00 0.00 0.00 174.94 175.01 3g6j s LEU 959 N -2.09 0.99 -0.54 2.97 0.20 -0.95 -3.25 118.68 116.01 3g6j s LEU 959 Ca 0.18 -0.48 -0.04 0.00 0.69 0.00 0.00 54.13 54.48 3g6j s LEU 959 Cb -0.11 -0.58 0.14 0.00 -0.43 0.00 0.00 46.19 45.21 3g6j s LEU 959 CO 0.10 -0.24 0.36 -0.76 -0.29 0.00 0.00 176.35 175.52 3g6j s LEU 960 N 1.87 5.33 0.00 -0.68 1.43 -0.31 -2.26 118.68 124.05 3g6j s LEU 960 Ca 0.02 -2.47 -0.00 0.00 -1.03 0.00 0.00 54.13 50.65 3g6j s LEU 960 Cb -0.15 -1.87 0.01 0.00 0.03 0.00 0.00 46.19 44.21 3g6j s LEU 960 CO -0.07 -0.47 0.05 1.67 0.23 0.00 0.00 176.35 177.76 3g6j n GLN 961 N 4.03 0.25 -2.72 1.70 7.27 -0.25 -1.36 117.38 126.31 3g6j n GLN 961 Ca 0.03 -0.10 -0.08 0.00 0.07 0.00 0.00 57.00 56.92 3g6j n GLN 961 Cb 0.40 -0.04 0.10 0.00 2.41 0.00 0.00 30.24 33.10 3g6j n GLN 961 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3g6j n GLY 962 N 4.65 0.71 3.58 1.69 0.00 0.15 -4.16 105.19 111.81 3g6j n GLY 962 Ca 0.01 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 3g6j n GLY 962 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3g6j n THR 963 N 0.03 0.23 -2.87 2.61 -2.24 -1.24 -4.79 114.28 106.01 3g6j n THR 963 Ca 0.02 -0.54 -0.19 0.00 -2.27 0.00 0.00 64.05 61.06 3g6j n THR 963 Cb 0.75 -2.60 0.04 0.00 -2.10 0.00 0.00 70.33 66.42 3g6j n THR 963 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3g6j s PRO 964 N 6.85 2.53 0.02 -0.78 0.04 -1.26 -4.17 135.00 138.23 3g6j s PRO 964 Ca 1.01 -1.18 -0.01 0.00 0.04 0.00 0.00 61.00 60.85 3g6j s PRO 964 Cb -0.31 -2.62 -0.02 0.00 0.04 0.00 0.00 34.50 31.59 3g6j s PRO 964 CO 0.33 -0.62 -0.01 0.08 0.04 0.00 0.00 177.00 176.82 3g6j s VAL 965 N -2.60 0.12 -0.23 -0.36 1.01 -1.26 -5.14 120.40 111.93 3g6j s VAL 965 Ca 0.58 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3g6j s VAL 965 Cb -0.09 -0.38 0.05 0.00 0.00 0.00 0.00 36.38 35.96 3g6j s VAL 965 CO 0.37 -0.53 -0.12 0.00 0.00 0.00 0.00 175.10 174.82 3g6j s ALA 966 N -1.65 2.39 0.51 5.51 0.00 -1.26 -4.47 121.76 122.79 3g6j s ALA 966 Ca -0.14 -1.54 0.00 0.00 0.00 0.00 0.00 51.96 50.28 3g6j s ALA 966 Cb -0.08 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.59 3g6j s ALA 966 CO -0.01 -0.97 0.00 1.04 0.00 0.00 0.00 175.76 175.82 3g6j n GLN 967 N 4.53 -2.75 -1.34 0.00 3.00 -1.26 -4.90 117.38 114.65 3g6j n GLN 967 Ca -0.15 2.24 0.03 0.00 -0.01 0.00 0.00 57.00 59.11 3g6j n GLN 967 Cb 0.44 -3.22 0.09 0.00 0.00 0.00 0.00 30.24 27.55 3g6j n GLN 967 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.06 175.73 3g6j n MET 968 N -3.94 0.88 -1.92 -1.09 2.81 -1.26 -5.06 117.12 107.54 3g6j n MET 968 Ca -0.08 -2.69 -0.43 0.00 -1.81 0.00 0.00 57.70 52.70 3g6j n MET 968 Cb 0.57 -0.80 -0.03 0.00 -0.71 0.00 0.00 33.22 32.25 3g6j n MET 968 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3g6j s THR 969 N -1.66 3.39 0.66 2.03 2.01 -1.26 -4.95 115.64 115.85 3g6j s THR 969 Ca 0.36 0.41 -0.17 0.00 0.31 0.00 0.00 61.69 62.60 3g6j s THR 969 Cb 0.38 -3.48 -0.00 0.00 0.01 0.00 0.00 72.50 69.40 3g6j s THR 969 CO -0.11 -0.28 1.22 -1.61 -0.69 0.00 0.00 174.62 173.14 3g6j s GLU 970 N 5.56 2.58 0.33 4.92 0.41 -1.26 -4.91 118.70 126.32 3g6j s GLU 970 Ca 0.83 1.81 -0.29 0.00 -0.41 0.00 0.00 54.97 56.92 3g6j s GLU 970 Cb -0.26 -1.88 -0.12 0.00 -1.78 0.00 0.00 34.13 30.09 3g6j s GLU 970 CO 0.34 -1.51 1.48 -0.25 -0.49 0.00 0.00 175.26 174.82 3g6j n ASP 971 N -2.12 3.50 -4.76 -0.19 8.00 -1.26 -4.98 116.55 114.73 3g6j n ASP 971 Ca 0.14 1.19 -0.31 0.00 0.71 0.00 0.00 54.79 56.52 3g6j n ASP 971 Cb 0.50 -1.56 0.10 0.00 -0.02 0.00 0.00 41.12 40.13 3g6j n ASP 971 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g6j s ALA 972 N -0.64 2.21 0.09 2.24 0.00 -1.26 -4.96 121.76 119.43 3g6j s ALA 972 Ca 0.59 0.29 -0.31 0.00 0.00 0.00 0.00 51.96 52.53 3g6j s ALA 972 Cb -0.52 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.24 3g6j s ALA 972 CO 0.57 -1.83 1.45 0.08 0.00 0.00 0.00 175.76 176.03 3g6j s VAL 973 N -2.88 3.27 0.11 0.00 1.01 -1.26 -4.91 120.40 115.74 3g6j s VAL 973 Ca 0.62 0.85 -0.33 0.00 0.00 0.00 0.00 61.98 63.12 3g6j s VAL 973 Cb -0.18 -3.55 -0.12 0.00 0.00 0.00 0.00 36.38 32.54 3g6j s VAL 973 CO 0.56 0.04 1.74 -0.67 0.00 0.00 0.00 175.10 176.77 3g6j n ASP 974 N 4.48 3.59 0.27 3.32 2.03 -1.26 -4.86 116.55 124.12 3g6j n ASP 974 Ca 0.13 1.03 0.15 0.00 0.52 0.00 0.00 54.79 56.62 3g6j n ASP 974 Cb 0.42 -1.48 0.73 0.00 -0.72 0.00 0.00 41.12 40.08 3g6j n ASP 974 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3g6j h ALA 975 N 7.49 1.09 0.00 -1.67 0.00 -1.93 -2.45 119.26 121.79 3g6j h ALA 975 Ca -0.46 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.38 3g6j h ALA 975 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 3g6j h ALA 975 CO 0.93 0.11 0.00 1.49 0.00 0.00 0.00 179.25 181.77 3g6j h GLU 976 N 0.00 0.00 -0.00 0.00 4.81 -1.93 -1.36 114.58 116.10 3g6j h GLU 976 Ca -0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3g6j h GLU 976 Cb 0.43 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3g6j h GLU 976 CO 0.01 0.00 -0.04 0.54 -0.73 0.00 0.00 179.01 178.79 3g6j n ARG 977 N -3.00 0.39 -0.65 1.92 5.12 -0.92 -3.98 116.66 115.55 3g6j n ARG 977 Ca 0.00 -0.05 0.06 0.00 -1.93 0.00 0.00 57.85 55.94 3g6j n ARG 977 Cb 0.27 -1.50 0.30 0.00 -1.16 0.00 0.00 32.46 30.37 3g6j n ARG 977 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 3g6j n LEU 978 N -1.27 4.61 0.20 0.55 4.77 -0.51 -4.61 117.00 120.75 3g6j n LEU 978 Ca 0.13 -3.07 0.07 0.00 -0.03 0.00 0.00 56.01 53.10 3g6j n LEU 978 Cb 0.27 -0.61 0.43 0.00 -2.33 0.00 0.00 43.42 41.18 3g6j n LEU 978 CO 0.24 0.71 0.75 0.11 -1.33 0.00 0.00 177.39 177.88 3g6j h LYS 979 N 2.40 0.00 0.00 3.23 1.57 -1.69 -3.07 116.57 119.02 3g6j h LYS 979 Ca 0.04 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3g6j h LYS 979 Cb 1.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.00 3g6j h LYS 979 CO 0.36 0.32 0.00 1.12 -0.57 0.00 0.00 179.45 180.67 3g6j h HIS 980 N 0.00 0.00 0.00 -1.35 2.07 -1.91 -3.27 115.15 110.69 3g6j h HIS 980 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3g6j h HIS 980 Cb 0.73 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.71 3g6j h HIS 980 CO 0.00 0.00 0.00 -0.07 -3.07 0.00 0.00 177.93 174.79 3g6j h LEU 981 N 0.00 0.00 -8.62 6.12 3.38 -1.87 -3.41 115.31 110.91 3g6j h LEU 981 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 3g6j h LEU 981 Cb 0.63 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.31 3g6j h LEU 981 CO 0.00 0.00 1.00 -0.63 0.09 0.00 0.00 178.44 178.90 3g6j s ILE 982 N -3.25 3.99 0.01 1.22 -1.09 -1.23 -2.04 121.20 118.81 3g6j s ILE 982 Ca 0.07 0.91 0.02 0.00 -2.23 0.00 0.00 60.65 59.42 3g6j s ILE 982 Cb 0.10 -4.61 -0.01 0.00 -1.58 0.00 0.00 42.46 36.35 3g6j s ILE 982 CO 0.54 -1.22 -0.07 -0.69 -1.23 0.00 0.00 174.94 172.27 3g6j s VAL 983 N 5.14 0.56 -0.41 2.92 1.01 -1.26 -5.02 120.40 123.34 3g6j s VAL 983 Ca 0.47 -0.57 -0.23 0.00 0.00 0.00 0.00 61.98 61.65 3g6j s VAL 983 Cb -0.08 -0.52 0.02 0.00 0.00 0.00 0.00 36.38 35.79 3g6j s VAL 983 CO 0.27 -0.03 0.79 -0.89 0.00 0.00 0.00 175.10 175.24 3g6j s THR 984 N -0.57 4.68 0.22 3.92 2.01 -1.26 -4.77 115.64 119.86 3g6j s THR 984 Ca -0.01 0.66 -0.31 0.00 0.31 0.00 0.00 61.69 62.34 3g6j s THR 984 Cb -0.05 -4.27 -0.10 0.00 0.01 0.00 0.00 72.50 68.08 3g6j s THR 984 CO 0.00 -0.59 1.55 -2.84 -0.69 0.00 0.00 174.62 172.06 3g6j s PRO 985 N 3.22 4.20 0.27 4.92 0.02 -1.26 -4.92 135.00 141.45 3g6j s PRO 985 Ca 0.31 2.41 0.02 0.00 0.02 0.00 0.00 61.00 63.76 3g6j s PRO 985 Cb -0.12 -3.11 -0.01 0.00 0.02 0.00 0.00 34.50 31.28 3g6j s PRO 985 CO 0.20 -0.57 0.31 -1.13 -0.33 0.00 0.00 177.00 175.48 3g6j n SER 986 N 3.20 -0.84 0.00 2.53 3.41 -1.26 -4.90 113.62 115.75 3g6j n SER 986 Ca 0.11 -2.61 0.00 0.00 -0.26 0.00 0.00 58.87 56.11 3g6j n SER 986 Cb 0.38 1.69 0.00 0.00 -0.26 0.00 0.00 64.21 66.02 3g6j n SER 986 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3g6j n GLY 987 N -0.48 -2.36 0.00 5.00 0.00 -1.26 -2.21 105.19 103.88 3g6j n GLY 987 Ca 0.03 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.49 3g6j n GLY 987 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g6j h GLY 989 N 0.00 0.00 0.00 0.00 0.00 -1.21 -0.63 103.07 101.24 3g6j h GLY 989 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.09 3g6j h GLY 989 CO 0.00 0.00 -1.58 1.18 0.00 0.00 0.00 176.54 176.14 3g6j n GLU 990 N -4.04 0.55 -0.35 4.80 1.02 -1.26 -4.12 120.64 117.23 3g6j n GLU 990 Ca -0.02 0.37 0.07 0.00 -0.02 0.00 0.00 57.16 57.56 3g6j n GLU 990 Cb 0.20 -1.57 0.24 0.00 -0.02 0.00 0.00 31.44 30.29 3g6j n GLU 990 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3g6j h GLN 991 N -1.00 0.97 -0.91 3.49 4.15 -1.84 -1.13 115.11 118.84 3g6j h GLN 991 Ca -0.36 -0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.02 3g6j h GLN 991 Cb 1.24 -0.22 -0.05 0.00 0.21 0.00 0.00 27.48 28.66 3g6j h GLN 991 CO -0.22 0.64 0.60 -0.97 -1.93 0.00 0.00 178.83 176.95 3g6j h ASN 992 N 0.99 1.03 0.70 -0.69 -1.24 -0.62 -1.29 115.58 114.47 3g6j h ASN 992 Ca 0.48 -0.02 -0.11 0.00 0.71 0.00 0.00 56.30 57.36 3g6j h ASN 992 Cb 0.46 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 39.24 3g6j h ASN 992 CO -0.24 0.74 -0.52 0.24 -1.29 0.00 0.00 177.43 176.36 3g6j h MET 993 N 1.22 0.00 -0.44 6.67 2.86 -1.41 -2.11 114.93 121.72 3g6j h MET 993 Ca 0.34 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.89 3g6j h MET 993 Cb -0.12 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 3g6j h MET 993 CO -0.08 0.52 -0.06 0.82 1.06 0.00 0.00 176.91 179.18 3g6j h ILE 994 N 0.00 1.27 -0.01 -1.22 2.04 -0.25 -2.01 117.51 117.34 3g6j h ILE 994 Ca -0.01 -1.14 -0.13 0.00 1.00 0.00 0.00 64.86 64.58 3g6j h ILE 994 Cb 1.02 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 38.19 3g6j h ILE 994 CO 0.07 0.39 -0.61 1.23 0.00 0.00 0.00 178.15 179.23 3g6j h GLY 995 N 0.65 0.02 2.00 5.37 0.00 -1.25 -3.19 103.07 106.68 3g6j h GLY 995 Ca 0.12 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.29 3g6j h GLY 995 CO 0.03 0.02 -0.60 1.98 0.00 0.00 0.00 176.54 177.97 3g6j h MET 996 N 0.01 0.00 0.54 4.80 1.85 -1.27 -3.39 114.93 117.47 3g6j h MET 996 Ca -0.01 0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.07 3g6j h MET 996 Cb 1.08 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 33.10 3g6j h MET 996 CO 0.08 0.60 -0.39 1.15 -0.40 0.00 0.00 176.91 177.96 3g6j h THR 997 N 0.00 0.21 -0.11 -0.77 2.02 -1.34 -2.13 112.91 110.78 3g6j h THR 997 Ca -0.01 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 3g6j h THR 997 Cb 1.28 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 3g6j h THR 997 CO 0.08 0.00 -0.12 1.55 0.37 0.00 0.00 175.52 177.40 3g6j h PRO 998 N -0.90 0.17 -0.32 6.66 0.13 -1.75 -2.45 132.00 133.55 3g6j h PRO 998 Ca -0.06 -0.03 -0.09 0.00 -0.87 0.00 0.00 66.00 64.95 3g6j h PRO 998 Cb 0.76 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 3g6j h PRO 998 CO 0.02 0.30 -0.15 1.15 -0.23 0.00 0.00 178.00 179.10 3g6j h THR 999 N 0.17 1.29 -0.41 1.56 2.02 -1.22 0.16 112.91 116.48 3g6j h THR 999 Ca 0.04 -1.25 -0.00 0.00 0.77 0.00 0.00 66.41 65.96 3g6j h THR 999 Cb 0.32 1.42 -0.02 0.00 -1.74 0.00 0.00 68.15 68.13 3g6j h THR 999 CO 0.02 0.40 0.24 0.58 0.37 0.00 0.00 175.52 177.13 3g6j h VAL 1000N 0.43 1.14 0.01 3.16 2.07 -1.12 -2.10 116.25 119.84 3g6j h VAL 1000Ca 0.07 -0.33 -0.20 0.00 0.82 0.00 0.00 66.70 67.06 3g6j h VAL 1000Cb 0.68 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.05 3g6j h VAL 1000CO 0.05 0.14 -0.91 -0.29 0.02 0.00 0.00 177.57 176.58 3g6j h ILE 1001N 0.54 1.58 -0.07 4.57 6.09 -1.40 -1.63 117.51 127.19 3g6j h ILE 1001Ca 0.15 -2.90 -0.00 0.00 -1.37 0.00 0.00 64.86 60.73 3g6j h ILE 1001Cb 0.02 2.61 -0.00 0.00 0.47 0.00 0.00 36.82 39.91 3g6j h ILE 1001CO -0.03 0.84 0.04 0.00 -3.07 0.00 0.00 178.15 175.93 3g6j h ALA 1002N 1.03 0.09 -0.43 0.18 0.00 -0.58 0.18 119.26 119.72 3g6j h ALA 1002Ca -0.03 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 3g6j h ALA 1002Cb 1.58 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 3g6j h ALA 1002CO 0.13 -0.38 0.15 0.28 0.00 0.00 0.00 179.25 179.44 3g6j h VAL 1003N 0.03 1.21 -0.60 0.00 2.07 -1.40 0.75 116.25 118.32 3g6j h VAL 1003Ca 0.02 -0.68 0.03 0.00 0.82 0.00 0.00 66.70 66.90 3g6j h VAL 1003Cb 0.07 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 3g6j h VAL 1003CO -0.00 0.24 0.35 -0.74 0.02 0.00 0.00 177.57 177.44 3g6j h HIS 1004N 0.56 0.65 -0.21 1.57 6.17 -1.12 0.26 115.15 123.04 3g6j h HIS 1004Ca 0.14 0.02 -0.10 0.00 0.71 0.00 0.00 60.37 61.14 3g6j h HIS 1004Cb 0.23 -0.21 -0.00 0.00 2.52 0.00 0.00 27.41 29.95 3g6j h HIS 1004CO 0.01 0.36 -0.27 -0.92 0.71 0.00 0.00 177.93 177.81 3g6j h TYR 1005N 0.68 0.67 -0.18 5.26 3.20 -0.49 -2.83 116.97 123.28 3g6j h TYR 1005Ca 0.25 -0.22 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 3g6j h TYR 1005Cb 0.06 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.19 3g6j h TYR 1005CO -0.07 0.93 -0.14 -0.07 -1.64 0.00 0.00 178.16 177.17 3g6j h LEU 1006N 0.22 0.28 0.14 2.82 3.38 -0.66 -0.94 115.31 120.56 3g6j h LEU 1006Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3g6j h LEU 1006Cb 0.84 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 3g6j h LEU 1006CO 0.06 0.44 -0.15 0.44 0.09 0.00 0.00 178.44 179.33 3g6j h ASP 1007N 0.27 -0.39 -0.16 -0.43 5.19 -0.41 0.10 116.42 120.60 3g6j h ASP 1007Ca 0.05 0.04 -0.11 0.00 -0.62 0.00 0.00 57.03 56.39 3g6j h ASP 1007Cb 0.41 0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.06 3g6j h ASP 1007CO 0.02 -0.22 -0.34 -0.33 -3.12 0.00 0.00 179.24 175.25 3g6j h GLU 1008N -0.32 0.51 0.00 3.56 4.39 -1.28 -3.05 114.58 118.40 3g6j h GLU 1008Ca 0.01 -0.34 0.00 0.00 0.34 0.00 0.00 59.36 59.37 3g6j h GLU 1008Cb 0.30 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 3g6j h GLU 1008CO -0.04 0.95 0.00 1.79 -1.16 0.00 0.00 179.01 180.55 3g6j h THR 1009N 0.14 0.00 -6.24 1.13 1.35 -1.23 -3.48 112.91 104.59 3g6j h THR 1009Ca 0.00 -0.45 -0.44 0.00 -0.55 0.00 0.00 66.41 64.97 3g6j h THR 1009Cb 0.94 1.34 0.05 0.00 -1.73 0.00 0.00 68.15 68.75 3g6j h THR 1009CO 0.08 0.00 -0.90 -0.62 -0.25 0.00 0.00 175.52 173.83 3g6j n GLU 1010N -2.57 -2.62 -0.79 4.72 1.02 0.35 -4.91 120.64 115.84 3g6j n GLU 1010Ca 0.03 0.49 -0.02 0.00 -0.02 0.00 0.00 57.16 57.64 3g6j n GLU 1010Cb 0.33 -4.53 0.25 0.00 -0.02 0.00 0.00 31.44 27.46 3g6j n GLU 1010CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3g6j n GLN 1011N -4.22 2.74 -0.13 3.49 6.02 -1.17 -4.70 117.38 119.40 3g6j n GLN 1011Ca -0.20 -3.04 -0.04 0.00 -0.01 0.00 0.00 57.00 53.72 3g6j n GLN 1011Cb 0.64 -1.97 0.17 0.00 1.02 0.00 0.00 30.24 30.10 3g6j n GLN 1011CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 3g6j h TRP 1012N 1.72 0.88 -0.40 1.08 4.06 -1.91 -2.46 115.95 118.90 3g6j h TRP 1012Ca 0.20 -0.09 0.05 0.00 2.06 0.00 0.00 58.89 61.10 3g6j h TRP 1012Cb 1.88 -0.25 -0.07 0.00 -1.00 0.00 0.00 29.16 29.72 3g6j h TRP 1012CO 0.98 0.75 -0.47 0.93 -3.56 0.00 0.00 178.44 177.07 3g6j h GLU 1013N 0.80 -0.28 -0.88 0.49 5.08 -1.90 0.28 114.58 118.17 3g6j h GLU 1013Ca 0.17 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.56 3g6j h GLU 1013Cb 0.35 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 3g6j h GLU 1013CO 0.00 -0.19 0.58 0.87 -1.00 0.00 0.00 179.01 179.28 3g6j h LYS 1014N -0.29 1.15 -0.00 2.33 1.79 -1.88 -3.21 116.57 116.46 3g6j h LYS 1014Ca 0.07 -0.07 -0.10 0.00 -2.18 0.00 0.00 60.65 58.37 3g6j h LYS 1014Cb 0.48 -0.26 0.01 0.00 -1.58 0.00 0.00 32.23 30.87 3g6j h LYS 1014CO -0.53 0.76 -0.37 0.35 -1.08 0.00 0.00 179.45 178.58 3g6j h PHE 1015N 1.18 0.38 0.00 -1.35 3.57 -1.03 -3.48 116.94 116.21 3g6j h PHE 1015Ca 0.32 -0.20 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3g6j h PHE 1015Cb -0.13 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.57 3g6j h PHE 1015CO -0.00 1.01 0.00 0.41 -2.23 0.00 0.00 178.31 177.50 3g6j n GLY 1016N 1.06 0.36 0.30 2.40 0.00 0.89 -4.98 105.19 105.23 3g6j n GLY 1016Ca -0.10 0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.09 3g6j n GLY 1016CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3g6j n LEU 1017N 0.00 -0.22 0.13 0.99 7.94 -0.62 0.47 117.00 125.69 3g6j n LEU 1017Ca 0.00 1.46 0.13 0.00 -1.11 0.00 0.00 56.01 56.49 3g6j n LEU 1017Cb 0.00 -0.48 0.45 0.00 0.53 0.00 0.00 43.42 43.92 3g6j n LEU 1017CO 0.00 -1.44 0.88 1.05 -1.11 0.00 0.00 177.39 176.77 3g6j h GLU 1018N 0.00 0.00 0.00 1.96 -0.00 -1.96 -3.23 114.58 111.34 3g6j h GLU 1018Ca 0.45 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.81 3g6j h GLU 1018Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.56 3g6j h GLU 1018CO -0.85 0.00 0.00 0.87 -0.00 0.00 0.00 179.01 179.03 3g6j h LYS 1019N 0.00 0.00 -0.28 1.06 1.57 -0.36 -3.14 116.57 115.42 3g6j h LYS 1019Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g6j h LYS 1019Cb 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 3g6j h LYS 1019CO 0.00 0.00 0.18 -0.09 -0.57 0.00 0.00 179.45 178.97 3g6j h ARG 1020N 0.00 0.35 -0.77 3.15 2.43 -1.66 -1.30 114.38 116.57 3g6j h ARG 1020Ca 0.00 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.25 3g6j h ARG 1020Cb 0.49 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 3g6j h ARG 1020CO 0.00 0.23 0.51 0.37 -1.51 0.00 0.00 179.97 179.57 3g6j h GLN 1021N 0.37 0.66 0.13 0.20 5.75 -1.81 0.27 115.11 120.68 3g6j h GLN 1021Ca 0.10 -0.04 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 3g6j h GLN 1021Cb -0.03 -0.15 0.00 0.00 1.07 0.00 0.00 27.48 28.37 3g6j h GLN 1021CO -0.03 0.44 -0.06 0.78 -2.65 0.00 0.00 178.83 177.31 3g6j h GLY 1022N 0.68 -0.18 1.44 2.39 0.00 -1.54 -2.75 103.07 103.12 3g6j h GLY 1022Ca 0.36 0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.76 3g6j h GLY 1022CO -0.13 -0.06 0.37 0.00 0.00 0.00 0.00 176.54 176.71 3g6j h ALA 1023N 0.52 1.62 -0.79 3.60 0.00 -0.25 -2.82 119.26 121.14 3g6j h ALA 1023Ca -0.02 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3g6j h ALA 1023Cb 0.27 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 3g6j h ALA 1023CO 0.03 0.35 0.36 -0.07 0.00 0.00 0.00 179.25 179.92 3g6j h LEU 1024N 0.74 1.06 -0.99 0.00 -0.00 -0.37 -2.46 115.31 113.28 3g6j h LEU 1024Ca 0.21 -0.15 -0.09 0.00 -0.00 0.00 0.00 57.88 57.85 3g6j h LEU 1024Cb -0.06 -0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 40.31 3g6j h LEU 1024CO -0.05 0.91 -0.19 -0.33 -0.00 0.00 0.00 178.44 178.78 3g6j h GLU 1025N 1.13 0.50 -0.27 1.13 5.08 -1.23 -1.96 114.58 118.97 3g6j h GLU 1025Ca 0.27 -0.17 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 3g6j h GLU 1025Cb 0.15 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 3g6j h GLU 1025CO -0.03 0.67 -0.38 -0.07 -1.00 0.00 0.00 179.01 178.21 3g6j h LEU 1026N 0.45 0.65 -0.28 1.33 3.38 -1.42 0.11 115.31 119.53 3g6j h LEU 1026Ca 0.07 -0.28 -0.09 0.00 0.09 0.00 0.00 57.88 57.67 3g6j h LEU 1026Cb 0.59 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 3g6j h LEU 1026CO 0.04 0.96 -0.17 0.40 0.09 0.00 0.00 178.44 179.77 3g6j h ILE 1027N 0.52 1.30 -0.50 1.22 2.04 -1.17 0.20 117.51 121.11 3g6j h ILE 1027Ca 0.05 -1.28 -0.07 0.00 1.00 0.00 0.00 64.86 64.56 3g6j h ILE 1027Cb 0.88 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 3g6j h ILE 1027CO 0.08 0.41 0.04 0.50 0.00 0.00 0.00 178.15 179.17 3g6j h LYS 1028N 0.35 0.80 -0.63 2.37 3.64 -1.32 -1.04 116.57 120.75 3g6j h LYS 1028Ca 0.06 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.19 3g6j h LYS 1028Cb 0.70 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.39 3g6j h LYS 1028CO 0.05 0.78 0.20 -0.22 -2.27 0.00 0.00 179.45 177.99 3g6j h LYS 1029N 0.76 0.98 -0.26 1.90 3.64 -0.44 -0.46 116.57 122.69 3g6j h LYS 1029Ca 0.15 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 3g6j h LYS 1029Cb 0.40 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3g6j h LYS 1029CO 0.01 0.86 0.12 0.78 -2.27 0.00 0.00 179.45 178.96 3g6j h GLY 1030N 0.91 0.40 0.34 5.01 0.00 -0.43 -1.28 103.07 108.02 3g6j h GLY 1030Ca 0.20 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.36 3g6j h GLY 1030CO -0.01 0.19 -0.31 -1.82 0.00 0.00 0.00 176.54 174.60 3g6j h TYR 1031N 0.28 -0.85 0.21 5.60 3.20 -0.90 -0.06 116.97 124.46 3g6j h TYR 1031Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 3g6j h TYR 1031Cb 0.13 0.37 -0.02 0.00 1.54 0.00 0.00 36.73 38.76 3g6j h TYR 1031CO -0.02 -0.40 -0.21 1.15 -1.64 0.00 0.00 178.16 177.04 3g6j h THR 1032N -0.47 0.54 -0.97 1.81 2.02 -1.08 -2.65 112.91 112.12 3g6j h THR 1032Ca 0.06 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.40 3g6j h THR 1032Cb 0.55 0.54 -0.09 0.00 -1.74 0.00 0.00 68.15 67.41 3g6j h THR 1032CO -0.25 0.00 0.61 1.56 0.37 0.00 0.00 175.52 177.81 3g6j h GLN 1033N -0.45 0.76 -0.03 6.66 4.20 -1.03 -1.26 115.11 123.96 3g6j h GLN 1033Ca -0.00 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.61 3g6j h GLN 1033Cb 0.42 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 3g6j h GLN 1033CO -0.05 0.51 -0.25 0.37 -0.67 0.00 0.00 178.83 178.73 3g6j h GLN 1034N 0.79 0.05 -0.11 1.46 5.75 -0.65 -2.75 115.11 119.64 3g6j h GLN 1034Ca 0.51 -0.01 0.02 0.00 -0.15 0.00 0.00 58.65 59.02 3g6j h GLN 1034Cb 0.75 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.29 3g6j h GLN 1034CO -0.28 0.30 0.08 -0.07 -2.65 0.00 0.00 178.83 176.21 3g6j h LEU 1035N 0.04 0.06 -1.18 -2.39 3.38 -1.03 -1.30 115.31 112.90 3g6j h LEU 1035Ca 0.01 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3g6j h LEU 1035Cb 0.48 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3g6j h LEU 1035CO 0.03 0.04 0.06 0.00 0.09 0.00 0.00 178.44 178.66 3g6j n ALA 1036N -2.54 0.95 -0.48 1.53 0.00 -1.04 -1.25 120.51 117.68 3g6j n ALA 1036Ca -0.01 0.16 0.05 0.00 0.00 0.00 0.00 53.44 53.65 3g6j n ALA 1036Cb 0.15 -1.18 0.12 0.00 0.00 0.00 0.00 19.45 18.54 3g6j n ALA 1036CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3g6j n PHE 1037N -2.13 0.31 -2.73 0.00 3.72 -0.49 -4.89 117.46 111.25 3g6j n PHE 1037Ca -0.01 -0.68 -0.43 0.00 -0.05 0.00 0.00 57.45 56.28 3g6j n PHE 1037Cb 0.09 -0.12 -0.03 0.00 -0.94 0.00 0.00 39.48 38.48 3g6j n PHE 1037CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 3g6j s ARG 1038N -1.77 4.11 0.75 -1.08 3.52 -0.38 -3.73 118.95 120.36 3g6j s ARG 1038Ca 0.22 1.04 -0.10 0.00 -0.13 0.00 0.00 55.73 56.75 3g6j s ARG 1038Cb 0.16 -3.70 0.06 0.00 -1.56 0.00 0.00 34.95 29.91 3g6j s ARG 1038CO 0.07 -0.75 1.10 -0.65 -0.81 0.00 0.00 175.30 174.26 3g6j s GLN 1039N 3.31 2.27 0.35 5.12 -0.21 -0.57 -4.92 119.66 125.02 3g6j s GLN 1039Ca 0.41 0.09 0.07 0.00 0.02 0.00 0.00 55.36 55.95 3g6j s GLN 1039Cb -0.14 -2.04 0.74 0.00 1.00 0.00 0.00 33.01 32.58 3g6j s GLN 1039CO 0.12 -1.33 1.90 -1.35 -2.12 0.00 0.00 175.29 172.51 3g6j h PRO 1040N -0.80 0.75 0.00 2.91 0.11 -1.96 -0.60 132.00 132.40 3g6j h PRO 1040Ca -0.45 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3g6j h PRO 1040Cb 1.31 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3g6j h PRO 1040CO 0.64 0.50 0.00 -1.13 -0.21 0.00 0.00 178.00 177.79 3g6j n SER 1041N -4.52 0.16 0.00 -2.05 3.41 -1.26 -4.85 113.62 104.50 3g6j n SER 1041Ca 0.15 0.54 0.00 0.00 -0.26 0.00 0.00 58.87 59.30 3g6j n SER 1041Cb 0.35 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3g6j n SER 1041CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3g6j n SER 1042N -1.68 -2.11 -4.24 4.04 7.64 -0.23 -4.72 113.62 112.32 3g6j n SER 1042Ca 0.03 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.69 3g6j n SER 1042Cb 0.19 -0.35 0.12 0.00 -1.01 0.00 0.00 64.21 63.15 3g6j n SER 1042CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g6j n ALA 1043N 0.11 -0.03 -2.22 -0.43 0.00 -1.26 -3.56 120.51 113.12 3g6j n ALA 1043Ca 0.00 -1.75 -0.13 0.00 0.00 0.00 0.00 53.44 51.56 3g6j n ALA 1043Cb 0.00 0.25 -0.10 0.00 0.00 0.00 0.00 19.45 19.59 3g6j n ALA 1043CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3g6j s PHE 1044N -2.90 1.12 0.01 0.00 0.40 -1.26 -1.51 117.98 113.84 3g6j s PHE 1044Ca 0.61 -0.95 -0.28 0.00 -0.60 0.00 0.00 56.93 55.71 3g6j s PHE 1044Cb -0.03 -0.63 0.09 0.00 0.51 0.00 0.00 43.02 42.96 3g6j s PHE 1044CO 0.41 -0.15 0.81 0.00 0.70 0.00 0.00 175.22 176.99 3g6j s ALA 1045N -3.60 -1.78 0.28 5.36 0.00 -1.24 -1.73 121.76 119.04 3g6j s ALA 1045Ca 0.19 1.00 -0.03 0.00 0.00 0.00 0.00 51.96 53.11 3g6j s ALA 1045Cb 0.05 0.33 0.57 0.00 0.00 0.00 0.00 23.12 24.08 3g6j s ALA 1045CO 0.01 -0.62 1.60 0.00 0.00 0.00 0.00 175.76 176.75 3g6j h ALA 1046N 2.19 0.94 -2.04 0.00 0.00 -1.89 -3.37 119.26 115.09 3g6j h ALA 1046Ca -0.25 0.30 -0.46 0.00 0.00 0.00 0.00 54.91 54.50 3g6j h ALA 1046Cb 1.24 0.52 -0.14 0.00 0.00 0.00 0.00 17.79 19.41 3g6j h ALA 1046CO 0.34 -0.48 -0.60 -0.06 0.00 0.00 0.00 179.25 178.45 3g6j s PHE 1047N -6.08 1.85 0.12 0.00 0.08 -1.26 -0.94 117.98 111.75 3g6j s PHE 1047Ca -0.13 -1.05 -0.09 0.00 0.12 0.00 0.00 56.93 55.77 3g6j s PHE 1047Cb 0.26 -1.19 -0.12 0.00 -0.57 0.00 0.00 43.02 41.40 3g6j s PHE 1047CO 0.77 -0.11 1.31 -0.39 -0.10 0.00 0.00 175.22 176.70 3g6j h VAL 1048N 2.12 1.32 -1.80 -0.44 -1.51 -1.90 -3.27 116.25 110.77 3g6j h VAL 1048Ca -0.39 -2.15 -0.73 0.00 -1.23 0.00 0.00 66.70 62.19 3g6j h VAL 1048Cb 1.25 2.17 -0.26 0.00 -2.13 0.00 0.00 31.29 32.32 3g6j h VAL 1048CO 0.66 0.66 0.98 0.29 -1.23 0.00 0.00 177.57 178.93 3g6j n LYS 1049N -3.86 2.70 -4.23 5.19 5.02 -1.26 -4.95 118.16 116.77 3g6j n LYS 1049Ca -0.07 -3.36 -0.19 0.00 -2.02 0.00 0.00 58.31 52.66 3g6j n LYS 1049Cb 0.79 -2.25 -0.12 0.00 -0.02 0.00 0.00 35.03 33.42 3g6j n LYS 1049CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 3g6j s ARG 1050N -3.80 0.86 0.28 1.97 3.52 -1.24 -5.12 118.95 115.43 3g6j s ARG 1050Ca 0.54 -0.89 -0.30 0.00 -0.13 0.00 0.00 55.73 54.95 3g6j s ARG 1050Cb 0.44 -0.87 -0.13 0.00 -1.56 0.00 0.00 34.95 32.83 3g6j s ARG 1050CO -0.36 0.20 1.29 0.00 -0.81 0.00 0.00 175.30 175.62 3g6j n ALA 1051N 1.48 0.90 -1.79 6.12 0.00 -1.26 -4.89 120.51 121.07 3g6j n ALA 1051Ca -0.20 0.39 -0.36 0.00 0.00 0.00 0.00 53.44 53.27 3g6j n ALA 1051Cb 0.54 -2.22 -0.06 0.00 0.00 0.00 0.00 19.45 17.72 3g6j n ALA 1051CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3g6j s PRO 1052N -1.14 4.42 -0.16 0.00 0.05 -1.26 -4.83 135.00 132.08 3g6j s PRO 1052Ca 0.62 1.36 -0.18 0.00 0.05 0.00 0.00 61.00 62.85 3g6j s PRO 1052Cb -0.64 -2.65 -0.04 0.00 0.05 0.00 0.00 34.50 31.23 3g6j s PRO 1052CO 0.56 0.12 0.48 0.45 0.05 0.00 0.00 177.00 178.66 3g6j s SER 1053N -1.67 6.61 0.22 6.66 0.15 -0.71 -4.27 113.70 120.70 3g6j s SER 1053Ca 0.54 0.73 -0.09 0.00 0.70 0.00 0.00 55.95 57.83 3g6j s SER 1053Cb -0.18 -2.28 0.17 0.00 -1.71 0.00 0.00 66.02 62.02 3g6j s SER 1053CO 0.24 -0.07 1.84 0.74 1.20 0.00 0.00 173.24 177.18 3g6j h THR 1054N 4.90 1.24 0.78 6.45 2.02 -1.85 -1.55 112.91 124.91 3g6j h THR 1054Ca -0.38 -0.58 -0.04 0.00 0.77 0.00 0.00 66.41 66.19 3g6j h THR 1054Cb 1.17 0.14 0.01 0.00 -1.74 0.00 0.00 68.15 67.72 3g6j h THR 1054CO 0.75 0.26 -0.38 -0.25 0.37 0.00 0.00 175.52 176.27 3g6j h TRP 1055N 1.13 -0.97 -0.56 3.16 7.01 -1.92 -2.03 115.95 121.77 3g6j h TRP 1055Ca 0.29 -0.02 0.06 0.00 2.11 0.00 0.00 58.89 61.33 3g6j h TRP 1055Cb 0.02 0.32 -0.06 0.00 -2.10 0.00 0.00 29.16 27.34 3g6j h TRP 1055CO 0.00 -0.59 0.25 1.25 -2.79 0.00 0.00 178.44 176.56 3g6j h LEU 1056N -1.14 0.33 -0.50 0.65 5.85 -1.90 0.53 115.31 119.13 3g6j h LEU 1056Ca -0.11 0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.71 3g6j h LEU 1056Cb 0.82 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.80 3g6j h LEU 1056CO 0.18 0.21 0.24 0.74 -0.34 0.00 0.00 178.44 179.47 3g6j h THR 1057N 0.48 0.93 -0.52 1.05 2.02 -1.32 0.29 112.91 115.84 3g6j h THR 1057Ca 0.26 -0.16 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 3g6j h THR 1057Cb 0.23 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.05 3g6j h THR 1057CO -0.22 0.08 -0.02 0.00 0.37 0.00 0.00 175.52 175.73 3g6j h ALA 1058N 1.28 0.99 -0.38 6.16 0.00 -0.28 -1.95 119.26 125.07 3g6j h ALA 1058Ca 0.22 -0.29 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 3g6j h ALA 1058Cb 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3g6j h ALA 1058CO -0.17 0.62 -0.33 -0.92 0.00 0.00 0.00 179.25 178.44 3g6j h TYR 1059N 0.82 1.02 -0.84 0.00 3.20 0.56 -1.10 116.97 120.64 3g6j h TYR 1059Ca 0.15 -0.28 0.03 0.00 3.14 0.00 0.00 58.73 61.77 3g6j h TYR 1059Cb 0.52 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.51 3g6j h TYR 1059CO 0.03 1.08 0.54 0.28 -1.64 0.00 0.00 178.16 178.44 3g6j h VAL 1060N 0.73 1.13 -0.54 1.81 2.07 -0.25 -0.37 116.25 120.82 3g6j h VAL 1060Ca 0.07 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 3g6j h VAL 1060Cb 0.90 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 3g6j h VAL 1060CO 0.08 0.19 0.24 0.58 0.02 0.00 0.00 177.57 178.68 3g6j h VAL 1061N 1.04 1.21 -0.84 2.57 2.07 -1.06 0.56 116.25 121.80 3g6j h VAL 1061Ca 0.34 -0.62 -0.02 0.00 0.82 0.00 0.00 66.70 67.21 3g6j h VAL 1061Cb 0.02 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 3g6j h VAL 1061CO -0.12 0.24 0.44 0.50 0.02 0.00 0.00 177.57 178.66 3g6j h LYS 1062N 0.73 1.18 0.33 1.57 3.64 -0.55 -0.24 116.57 123.23 3g6j h LYS 1062Ca 0.18 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3g6j h LYS 1062Cb 0.16 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.75 3g6j h LYS 1062CO -0.02 0.88 -0.16 0.28 -2.27 0.00 0.00 179.45 178.16 3g6j h VAL 1063N 1.19 0.28 -0.54 2.00 2.07 -0.94 -3.25 116.25 117.05 3g6j h VAL 1063Ca 0.30 -0.75 0.11 0.00 0.82 0.00 0.00 66.70 67.17 3g6j h VAL 1063Cb 0.05 0.46 -0.09 0.00 -1.52 0.00 0.00 31.29 30.20 3g6j h VAL 1063CO -0.04 0.07 0.02 -0.26 0.02 0.00 0.00 177.57 177.37 3g6j h PHE 1064N -1.04 -0.00 -0.39 1.57 -1.00 -0.83 0.42 116.94 115.67 3g6j h PHE 1064Ca -0.05 0.04 0.08 0.00 2.81 0.00 0.00 57.97 60.85 3g6j h PHE 1064Cb 0.45 0.09 -0.08 0.00 3.61 0.00 0.00 35.95 40.02 3g6j h PHE 1064CO 0.03 -0.12 -0.11 0.77 -1.61 0.00 0.00 178.31 177.27 3g6j h SER 1065N 0.13 -0.41 0.27 2.17 0.02 -1.17 -0.44 113.55 114.13 3g6j h SER 1065Ca 0.28 0.12 -0.11 0.00 -0.84 0.00 0.00 61.79 61.24 3g6j h SER 1065Cb 0.43 0.26 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 3g6j h SER 1065CO -0.44 -0.15 -0.43 0.25 -1.14 0.00 0.00 176.83 174.92 3g6j h LEU 1066N -0.02 0.22 -0.19 5.07 6.46 -1.38 -3.01 115.31 122.45 3g6j h LEU 1066Ca 0.19 -0.09 0.00 0.00 -0.12 0.00 0.00 57.88 57.85 3g6j h LEU 1066Cb 0.31 -0.06 0.00 0.00 -0.73 0.00 0.00 40.66 40.18 3g6j h LEU 1066CO -0.41 0.63 0.00 0.00 -0.62 0.00 0.00 178.44 178.04 3g6j n ALA 1067N -2.47 1.93 0.28 1.25 0.00 0.06 -3.85 120.51 117.70 3g6j n ALA 1067Ca -0.02 -0.02 0.13 0.00 0.00 0.00 0.00 53.44 53.54 3g6j n ALA 1067Cb 0.49 -1.37 0.81 0.00 0.00 0.00 0.00 19.45 19.37 3g6j n ALA 1067CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 3g6j h VAL 1068N 0.00 0.60 0.00 0.00 -1.51 -1.05 -1.50 116.25 112.79 3g6j h VAL 1068Ca 0.00 -0.24 -0.05 0.00 -1.23 0.00 0.00 66.70 65.17 3g6j h VAL 1068Cb 0.43 1.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.73 3g6j h VAL 1068CO 0.00 0.06 -0.24 0.78 -1.23 0.00 0.00 177.57 176.93 3g6j h ASN 1069N 0.00 0.00 0.05 4.19 2.35 -1.81 -3.30 115.58 117.06 3g6j h ASN 1069Ca -0.00 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.38 3g6j h ASN 1069Cb 0.15 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 38.45 3g6j h ASN 1069CO 0.01 0.24 -2.33 0.18 -1.65 0.00 0.00 177.43 173.88 3g6j n LEU 1070N -3.48 0.86 -3.92 1.61 4.77 -0.59 -5.03 117.00 111.21 3g6j n LEU 1070Ca -0.00 0.02 -0.09 0.00 -0.03 0.00 0.00 56.01 55.90 3g6j n LEU 1070Cb 0.42 0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.52 3g6j n LEU 1070CO 0.34 0.60 -0.06 0.27 -1.33 0.00 0.00 177.39 177.21 3g6j s ILE 1071N -2.51 0.10 -0.06 -0.08 -4.36 -1.04 -5.07 121.20 108.18 3g6j s ILE 1071Ca -0.16 -1.32 -0.30 0.00 -0.26 0.00 0.00 60.65 58.62 3g6j s ILE 1071Cb 0.07 -1.64 -0.05 0.00 1.25 0.00 0.00 42.46 42.09 3g6j s ILE 1071CO 0.77 -0.45 1.62 0.00 0.24 0.00 0.00 174.94 177.12 3g6j s ALA 1072N -3.93 3.62 -0.25 2.27 0.00 -1.26 -4.44 121.76 117.78 3g6j s ALA 1072Ca 0.12 0.91 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 3g6j s ALA 1072Cb 0.04 -3.73 0.03 0.00 0.00 0.00 0.00 23.12 19.46 3g6j s ALA 1072CO -0.05 -1.36 -0.07 0.42 0.00 0.00 0.00 175.76 174.70 3g6j s ILE 1073N 3.92 2.70 -0.28 0.00 -1.09 -1.26 -5.07 121.20 120.12 3g6j s ILE 1073Ca 0.72 -1.15 -0.30 0.00 -2.23 0.00 0.00 60.65 57.69 3g6j s ILE 1073Cb -0.33 -2.41 -0.07 0.00 -1.58 0.00 0.00 42.46 38.08 3g6j s ILE 1073CO 0.28 0.16 2.24 -0.67 -1.23 0.00 0.00 174.94 175.72 3g6j n ASP 1074N 4.62 2.84 -0.33 3.58 4.64 -1.26 -4.85 116.55 125.79 3g6j n ASP 1074Ca -0.16 0.20 0.11 0.00 -1.38 0.00 0.00 54.79 53.55 3g6j n ASP 1074Cb 0.46 -1.47 0.28 0.00 -1.04 0.00 0.00 41.12 39.35 3g6j n ASP 1074CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 3g6j h SER 1075N 14.69 0.67 -0.67 1.67 0.02 -1.98 -0.16 113.55 127.78 3g6j h SER 1075Ca -0.35 0.10 0.09 0.00 -0.84 0.00 0.00 61.79 60.78 3g6j h SER 1075Cb 1.27 -0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.75 3g6j h SER 1075CO 1.00 0.24 0.44 1.56 -1.14 0.00 0.00 176.83 178.93 3g6j h GLN 1076N 0.70 0.53 0.03 3.45 4.20 -1.98 0.64 115.11 122.67 3g6j h GLN 1076Ca 0.53 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.21 3g6j h GLN 1076Cb 0.81 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.47 3g6j h GLN 1076CO -0.38 0.35 -0.01 0.28 -0.67 0.00 0.00 178.83 178.40 3g6j h VAL 1077N 0.55 1.39 -0.85 -0.54 2.07 -1.42 -0.91 116.25 116.54 3g6j h VAL 1077Ca 0.30 -1.38 -0.03 0.00 0.82 0.00 0.00 66.70 66.41 3g6j h VAL 1077Cb 0.47 2.29 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 3g6j h VAL 1077CO -0.10 0.35 0.40 0.25 0.02 0.00 0.00 177.57 178.49 3g6j h LEU 1078N -0.65 1.12 0.00 2.57 5.85 -1.10 -2.59 115.31 120.52 3g6j h LEU 1078Ca -0.00 -0.14 -0.21 0.00 0.84 0.00 0.00 57.88 58.36 3g6j h LEU 1078Cb 0.60 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 3g6j h LEU 1078CO 0.01 0.95 -1.33 0.00 -0.34 0.00 0.00 178.44 177.72 3g6j h GLY 1080N 3.47 0.42 0.88 0.00 0.00 -1.11 0.12 103.07 106.86 3g6j h GLY 1080Ca -0.16 -0.19 -0.10 0.00 0.00 0.00 0.00 47.33 46.87 3g6j h GLY 1080CO 0.08 0.18 -0.27 0.00 0.00 0.00 0.00 176.54 176.53 3g6j h ALA 1081N 1.72 0.32 -0.35 3.60 0.00 -1.45 -2.49 119.26 120.61 3g6j h ALA 1081Ca 0.10 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 3g6j h ALA 1081Cb 0.11 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3g6j h ALA 1081CO -0.01 0.32 0.09 0.28 0.00 0.00 0.00 179.25 179.93 3g6j h VAL 1082N 0.25 1.22 -0.70 0.00 2.07 -1.27 -2.37 116.25 115.45 3g6j h VAL 1082Ca 0.03 -0.75 0.02 0.00 0.82 0.00 0.00 66.70 66.82 3g6j h VAL 1082Cb 0.84 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 3g6j h VAL 1082CO 0.06 0.25 0.45 0.50 0.02 0.00 0.00 177.57 178.86 3g6j h LYS 1083N 0.42 0.88 0.19 1.57 3.64 -0.83 -2.84 116.57 119.59 3g6j h LYS 1083Ca 0.11 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 3g6j h LYS 1083Cb 0.30 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3g6j h LYS 1083CO 0.00 0.58 -0.09 2.35 -2.27 0.00 0.00 179.45 180.02 3g6j h TRP 1084N 0.91 -0.23 -0.95 1.91 7.01 -1.33 -1.20 115.95 122.06 3g6j h TRP 1084Ca 0.26 -0.01 0.16 0.00 2.11 0.00 0.00 58.89 61.42 3g6j h TRP 1084Cb -0.06 0.08 -0.10 0.00 -2.10 0.00 0.00 29.16 26.98 3g6j h TRP 1084CO -0.03 -0.12 0.55 -0.07 -2.79 0.00 0.00 178.44 175.98 3g6j h LEU 1085N -0.28 0.72 0.16 0.65 3.38 -1.29 0.40 115.31 119.04 3g6j h LEU 1085Ca -0.03 0.09 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 3g6j h LEU 1085Cb 0.22 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.93 3g6j h LEU 1085CO 0.04 0.29 -0.08 0.40 0.09 0.00 0.00 178.44 179.19 3g6j h ILE 1086N 0.75 0.90 -0.03 1.22 2.04 -1.27 -2.47 117.51 118.65 3g6j h ILE 1086Ca 0.53 -1.11 -0.16 0.00 1.00 0.00 0.00 64.86 65.12 3g6j h ILE 1086Cb 0.75 1.49 -0.01 0.00 -0.74 0.00 0.00 36.82 38.31 3g6j h ILE 1086CO -0.36 0.23 -0.69 -0.07 0.00 0.00 0.00 178.15 177.26 3g6j h LEU 1087N -0.82 0.20 0.00 1.44 3.38 -0.94 -3.25 115.31 115.31 3g6j h LEU 1087Ca -0.02 -0.13 -0.31 0.00 0.09 0.00 0.00 57.88 57.51 3g6j h LEU 1087Cb 0.53 -0.06 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 3g6j h LEU 1087CO 0.04 0.82 -2.15 -0.62 0.09 0.00 0.00 178.44 176.61 3g6j n GLU 1088N -3.78 1.12 0.00 1.13 -0.58 0.11 -4.76 120.64 113.88 3g6j n GLU 1088Ca -0.02 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3g6j n GLU 1088Cb 0.68 -1.43 0.00 0.00 -0.57 0.00 0.00 31.44 30.12 3g6j n GLU 1088CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3g6j n LYS 1089N -2.73 2.50 -3.95 3.49 4.76 -0.96 -4.96 118.16 116.32 3g6j n LYS 1089Ca -0.29 -1.35 -0.35 0.00 -2.87 0.00 0.00 58.31 53.45 3g6j n LYS 1089Cb 1.01 -0.95 -0.12 0.00 -1.84 0.00 0.00 35.03 33.14 3g6j n LYS 1089CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 3g6j s GLN 1090N -0.85 3.77 1.03 1.97 0.74 -1.06 -1.15 119.66 124.10 3g6j s GLN 1090Ca 0.00 -0.44 -0.14 0.00 0.05 0.00 0.00 55.36 54.83 3g6j s GLN 1090Cb 0.00 -3.22 0.20 0.00 1.10 0.00 0.00 33.01 31.09 3g6j s GLN 1090CO 0.00 0.04 1.11 0.15 -0.55 0.00 0.00 175.29 176.04 3g6j s LYS 1091N 0.99 0.18 0.23 1.67 1.02 -0.21 -4.93 119.74 118.69 3g6j s LYS 1091Ca 0.03 0.29 -0.06 0.00 0.02 0.00 0.00 55.97 56.25 3g6j s LYS 1091Cb -0.14 -1.73 0.32 0.00 -0.52 0.00 0.00 37.83 35.76 3g6j s LYS 1091CO 0.03 -2.85 1.84 -1.35 -0.92 0.00 0.00 175.35 172.09 3g6j h PRO 1092N -1.97 0.87 0.00 -1.68 0.11 -2.00 -2.69 132.00 124.64 3g6j h PRO 1092Ca -0.52 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.54 3g6j h PRO 1092Cb 1.32 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3g6j h PRO 1092CO 0.53 0.57 0.00 0.38 -0.21 0.00 0.00 178.00 179.27 3g6j h ASP 1093N 0.89 0.00 0.00 -2.05 2.03 -1.94 -3.47 116.42 111.88 3g6j h ASP 1093Ca 0.36 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.66 3g6j h ASP 1093Cb 0.19 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.69 3g6j h ASP 1093CO -0.18 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.64 3g6j n GLY 1094N 0.62 1.18 3.77 7.15 0.00 -1.01 -4.62 105.19 112.28 3g6j n GLY 1094Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3g6j n GLY 1094CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g6j s VAL 1095N -2.00 2.87 -0.18 1.61 1.01 -1.26 -3.92 120.40 118.53 3g6j s VAL 1095Ca 0.00 0.74 -0.13 0.00 0.00 0.00 0.00 61.98 62.60 3g6j s VAL 1095Cb 0.00 -3.42 -0.05 0.00 0.00 0.00 0.00 36.38 32.91 3g6j s VAL 1095CO 0.00 0.08 0.24 -0.36 0.00 0.00 0.00 175.10 175.06 3g6j s PHE 1096N -1.35 3.43 -0.02 5.22 0.08 -1.26 -1.05 117.98 123.03 3g6j s PHE 1096Ca 0.58 0.49 0.01 0.00 0.12 0.00 0.00 56.93 58.13 3g6j s PHE 1096Cb -0.34 -2.29 -0.03 0.00 -0.57 0.00 0.00 43.02 39.78 3g6j s PHE 1096CO 0.43 0.22 -0.02 -1.14 -0.10 0.00 0.00 175.22 174.61 3g6j s GLN 1097N 0.53 2.75 -0.23 0.44 0.74 -0.30 -4.44 119.66 119.15 3g6j s GLN 1097Ca 0.13 -0.60 -0.11 0.00 0.05 0.00 0.00 55.36 54.83 3g6j s GLN 1097Cb -0.12 -2.64 -0.05 0.00 1.10 0.00 0.00 33.01 31.30 3g6j s GLN 1097CO 0.02 0.64 0.18 -2.00 -0.55 0.00 0.00 175.29 173.57 3g6j s GLU 1098N -1.34 4.10 0.00 1.67 2.56 -1.26 -4.73 118.70 119.71 3g6j s GLU 1098Ca 0.17 -0.22 0.06 0.00 0.00 0.00 0.00 54.97 54.98 3g6j s GLU 1098Cb -0.11 -3.52 0.00 0.00 2.00 0.00 0.00 34.13 32.50 3g6j s GLU 1098CO 0.07 0.09 0.50 -0.25 -0.56 0.00 0.00 175.26 175.12 3g6j n ASP 1099N 4.17 0.98 -2.82 -1.70 8.00 -1.26 -4.85 116.55 119.07 3g6j n ASP 1099Ca -0.15 -0.99 -0.06 0.00 0.71 0.00 0.00 54.79 54.30 3g6j n ASP 1099Cb 0.52 0.44 0.00 0.00 -0.02 0.00 0.00 41.12 42.06 3g6j n ASP 1099CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g6j n ALA 1100N -0.29 -1.43 -1.69 2.24 0.00 -1.26 -5.02 120.51 113.05 3g6j n ALA 1100Ca 0.03 -1.24 -0.37 0.00 0.00 0.00 0.00 53.44 51.86 3g6j n ALA 1100Cb 0.13 -1.42 0.07 0.00 0.00 0.00 0.00 19.45 18.22 3g6j n ALA 1100CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3g6j n PRO 1101N 2.86 1.04 -1.26 0.00 -0.02 -1.26 -3.90 135.00 132.46 3g6j n PRO 1101Ca 0.19 0.41 -0.34 0.00 -2.02 0.00 0.00 63.50 61.74 3g6j n PRO 1101Cb 0.56 -2.43 0.11 0.00 -0.02 0.00 0.00 33.50 31.71 3g6j n PRO 1101CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3g6j s VAL 1102N -1.43 2.19 -0.09 -1.45 -7.23 -1.26 -4.97 120.40 106.17 3g6j s VAL 1102Ca 0.81 0.09 0.22 0.00 -1.81 0.00 0.00 61.98 61.29 3g6j s VAL 1102Cb -0.39 -2.57 -0.27 0.00 0.56 0.00 0.00 36.38 33.71 3g6j s VAL 1102CO 0.42 -0.06 0.60 2.30 -0.31 0.00 0.00 175.10 178.06 3g6j n ILE 1103N -3.05 0.13 -2.79 -0.62 -5.35 -1.26 -4.42 119.36 102.00 3g6j n ILE 1103Ca 0.13 -0.50 -0.44 0.00 -0.27 0.00 0.00 62.75 61.68 3g6j n ILE 1103Cb 0.50 -0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.35 3g6j n ILE 1103CO 0.00 0.00 0.00 1.41 -1.76 0.00 0.00 176.55 176.20 3g6j n HIS 1104N -2.33 4.73 0.27 4.28 8.25 -1.26 -4.85 115.22 124.31 3g6j n HIS 1104Ca -0.03 -3.19 0.04 0.00 -0.26 0.00 0.00 57.72 54.28 3g6j n HIS 1104Cb 0.56 -2.29 0.16 0.00 1.12 0.00 0.00 29.99 29.54 3g6j n HIS 1104CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3g6j n GLN 1105N 6.20 0.01 0.16 -0.41 1.13 -1.26 -1.90 117.38 121.31 3g6j n GLN 1105Ca 0.40 0.36 0.08 0.00 -1.94 0.00 0.00 57.00 55.90 3g6j n GLN 1105Cb 0.43 -1.50 0.08 0.00 0.11 0.00 0.00 30.24 29.36 3g6j n GLN 1105CO 0.00 0.00 0.00 1.05 -1.44 0.00 0.00 177.06 176.67 3g6j h GLU 1106N 0.00 0.00 0.00 -1.09 9.09 -1.95 -3.34 114.58 117.29 3g6j h GLU 1106Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3g6j h GLU 1106Cb 0.13 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 3g6j h GLU 1106CO 0.00 0.20 0.00 0.00 0.05 0.00 0.00 179.01 179.26 3g6j n MET 1107N -3.08 0.20 0.03 1.06 0.00 -0.80 -3.05 117.12 111.49 3g6j n MET 1107Ca 0.02 0.19 0.13 0.00 0.00 0.00 0.00 57.70 58.04 3g6j n MET 1107Cb 0.63 -1.75 0.35 0.00 0.00 0.00 0.00 33.22 32.45 3g6j n MET 1107CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 175.97 176.41 3g6j n ILE 1108N -2.10 0.17 0.00 3.17 -5.35 -1.25 -4.06 119.36 109.95 3g6j n ILE 1108Ca 0.05 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 3g6j n ILE 1108Cb 0.39 -0.16 0.00 0.00 -1.74 0.00 0.00 39.64 38.13 3g6j n ILE 1108CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3g6j n GLY 1109N 1.43 3.06 0.08 3.28 0.00 -1.17 -3.14 105.19 108.73 3g6j n GLY 1109Ca 0.05 -0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.00 3g6j n GLY 1109CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6j n GLY 1110N 0.00 -1.30 0.30 -0.02 0.00 -1.26 -2.35 105.19 100.56 3g6j n GLY 1110Ca 0.00 0.02 0.17 0.00 0.00 0.00 0.00 46.02 46.21 3g6j n GLY 1110CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3g6j h LEU 1111N 0.00 0.00 -1.34 0.99 4.07 -1.96 -3.09 115.31 113.98 3g6j h LEU 1111Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3g6j h LEU 1111Cb 0.41 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.15 3g6j h LEU 1111CO 0.00 0.04 0.00 -0.09 -1.08 0.00 0.00 178.44 177.31 3g6j h ARG 1112N 0.00 0.00 -6.99 1.13 2.43 -1.71 -3.43 114.38 105.81 3g6j h ARG 1112Ca -0.00 0.00 -0.55 0.00 -0.81 0.00 0.00 59.98 58.62 3g6j h ARG 1112Cb 0.19 0.00 0.12 0.00 -0.42 0.00 0.00 29.97 29.87 3g6j h ARG 1112CO 0.01 0.00 0.71 1.21 -1.51 0.00 0.00 179.97 180.38 3g6j s ASN 1113N -4.49 5.83 0.10 -3.80 3.84 -1.17 -4.95 114.94 110.30 3g6j s ASN 1113Ca 0.00 2.94 -0.14 0.00 0.21 0.00 0.00 52.86 55.88 3g6j s ASN 1113Cb 0.09 -2.66 -0.09 0.00 -0.55 0.00 0.00 41.25 38.04 3g6j s ASN 1113CO 0.35 -1.21 1.41 -1.13 -2.79 0.00 0.00 177.10 173.73 3g6j h ASN 1114N 2.28 0.80 -4.09 -4.21 -1.24 -1.93 -3.45 115.58 103.75 3g6j h ASN 1114Ca -0.51 -0.49 -0.49 0.00 0.71 0.00 0.00 56.30 55.51 3g6j h ASN 1114Cb 1.27 -0.23 0.06 0.00 0.73 0.00 0.00 38.32 40.15 3g6j h ASN 1114CO 0.61 1.13 0.42 0.20 -1.29 0.00 0.00 177.43 178.50 3g6j s ASN 1115N -6.64 5.84 -1.54 1.15 0.01 -1.26 -3.89 114.94 108.60 3g6j s ASN 1115Ca -0.12 2.10 -0.14 0.00 -0.71 0.00 0.00 52.86 53.99 3g6j s ASN 1115Cb 0.09 -2.57 0.09 0.00 0.41 0.00 0.00 41.25 39.27 3g6j s ASN 1115CO 0.84 -1.13 0.97 -0.62 -1.51 0.00 0.00 177.10 175.66 3g6j n GLU 1116N -1.29 -5.41 0.07 -0.60 1.02 -1.26 -4.88 120.64 108.28 3g6j n GLU 1116Ca 0.11 0.59 -0.05 0.00 -0.02 0.00 0.00 57.16 57.79 3g6j n GLU 1116Cb 0.51 -5.48 0.14 0.00 -0.02 0.00 0.00 31.44 26.59 3g6j n GLU 1116CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 3g6j h LYS 1117N -2.05 0.30 0.82 3.49 2.10 -1.86 -1.92 116.57 117.44 3g6j h LYS 1117Ca -0.58 -0.18 -0.04 0.00 -2.00 0.00 0.00 60.65 57.85 3g6j h LYS 1117Cb 1.38 0.02 0.01 0.00 -0.90 0.00 0.00 32.23 32.73 3g6j h LYS 1117CO 0.68 0.76 -0.39 -0.44 -2.00 0.00 0.00 179.45 178.06 3g6j h ASP 1118N 0.23 -0.93 -0.20 7.07 3.32 -1.92 0.42 116.42 124.41 3g6j h ASP 1118Ca 0.00 0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.13 3g6j h ASP 1118Cb 1.02 0.24 -0.06 0.00 0.22 0.00 0.00 39.33 40.75 3g6j h ASP 1118CO 0.09 -0.63 -0.21 0.24 -1.72 0.00 0.00 179.24 177.00 3g6j h MET 1119N -1.15 -0.22 0.27 3.56 2.86 -1.96 -0.66 114.93 117.62 3g6j h MET 1119Ca -0.11 0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.55 3g6j h MET 1119Cb 0.85 0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.53 3g6j h MET 1119CO 0.18 -0.15 -0.35 0.00 1.06 0.00 0.00 176.91 177.66 3g6j h ALA 1120N 0.82 -0.70 -0.41 6.32 0.00 -1.32 -0.80 119.26 123.17 3g6j h ALA 1120Ca 0.12 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 3g6j h ALA 1120Cb 0.41 0.53 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 3g6j h ALA 1120CO -0.33 -0.94 0.03 1.25 0.00 0.00 0.00 179.25 179.26 3g6j h LEU 1121N -0.67 0.68 -0.48 0.00 5.85 -0.79 -0.82 115.31 119.08 3g6j h LEU 1121Ca -0.01 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.47 3g6j h LEU 1121Cb 0.64 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.44 3g6j h LEU 1121CO -0.11 0.80 0.23 0.74 -0.34 0.00 0.00 178.44 179.76 3g6j h THR 1122N 0.55 0.95 -0.68 1.05 2.02 -1.06 -0.70 112.91 115.04 3g6j h THR 1122Ca 0.12 -0.16 0.01 0.00 0.77 0.00 0.00 66.41 67.16 3g6j h THR 1122Cb 0.43 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 3g6j h THR 1122CO 0.01 0.08 0.45 0.00 0.37 0.00 0.00 175.52 176.44 3g6j h ALA 1123N 1.26 1.53 0.02 6.16 0.00 -0.79 0.12 119.26 127.58 3g6j h ALA 1123Ca 0.21 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 3g6j h ALA 1123Cb 0.13 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3g6j h ALA 1123CO -0.16 0.43 -0.01 0.35 0.00 0.00 0.00 179.25 179.86 3g6j h PHE 1124N 0.90 -0.03 -0.65 0.00 3.57 -0.37 -2.34 116.94 118.03 3g6j h PHE 1124Ca 0.25 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.67 3g6j h PHE 1124Cb -0.08 0.01 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 3g6j h PHE 1124CO -0.00 0.41 0.08 0.28 -2.23 0.00 0.00 178.31 176.84 3g6j h VAL 1125N -0.48 1.26 -0.58 1.41 2.07 -1.00 -2.75 116.25 116.19 3g6j h VAL 1125Ca -0.00 -1.08 0.07 0.00 0.82 0.00 0.00 66.70 66.51 3g6j h VAL 1125Cb 0.45 0.68 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 3g6j h VAL 1125CO 0.01 0.40 0.26 0.25 0.02 0.00 0.00 177.57 178.51 3g6j h LEU 1126N 1.02 0.33 -0.57 2.57 5.85 -0.80 -0.88 115.31 122.83 3g6j h LEU 1126Ca 0.19 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 3g6j h LEU 1126Cb 0.48 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3g6j h LEU 1126CO 0.02 0.21 0.35 0.40 -0.34 0.00 0.00 178.44 179.08 3g6j h ILE 1127N 0.48 1.16 -0.43 4.05 2.04 -1.25 -1.95 117.51 121.62 3g6j h ILE 1127Ca 0.27 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 3g6j h ILE 1127Cb 0.26 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.70 3g6j h ILE 1127CO -0.23 0.17 0.24 0.28 0.00 0.00 0.00 178.15 178.60 3g6j h SER 1128N 0.77 0.54 -0.76 1.72 0.02 -1.13 -0.51 113.55 114.20 3g6j h SER 1128Ca 0.20 -0.09 0.09 0.00 -0.84 0.00 0.00 61.79 61.16 3g6j h SER 1128Cb -0.03 -0.14 -0.07 0.00 0.14 0.00 0.00 62.40 62.30 3g6j h SER 1128CO -0.04 0.47 0.41 -0.07 -1.14 0.00 0.00 176.83 176.46 3g6j h LEU 1129N 0.56 0.55 -0.21 5.07 3.38 -0.98 -2.78 115.31 120.90 3g6j h LEU 1129Ca 0.15 0.05 -0.21 0.00 0.09 0.00 0.00 57.88 57.96 3g6j h LEU 1129Cb 0.05 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.76 3g6j h LEU 1129CO -0.02 0.32 -0.71 1.56 0.09 0.00 0.00 178.44 179.67 3g6j h GLN 1130N 0.68 0.81 0.00 1.13 4.20 -0.67 -0.99 115.11 120.27 3g6j h GLN 1130Ca 0.37 -0.62 0.00 0.00 0.06 0.00 0.00 58.65 58.46 3g6j h GLN 1130Cb 0.37 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.26 3g6j h GLN 1130CO -0.26 1.23 0.00 0.93 -0.67 0.00 0.00 178.83 180.06 3g6j h GLU 1131N 0.57 0.00 -0.33 1.46 5.08 -1.03 -2.20 114.58 118.14 3g6j h GLU 1131Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3g6j h GLU 1131Cb 1.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.59 3g6j h GLU 1131CO 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.16 3g6j n ALA 1132N -1.97 2.31 0.01 3.43 0.00 -1.06 -4.71 120.51 118.52 3g6j n ALA 1132Ca 0.01 -1.01 -0.10 0.00 0.00 0.00 0.00 53.44 52.34 3g6j n ALA 1132Cb 0.26 -0.56 -0.04 0.00 0.00 0.00 0.00 19.45 19.11 3g6j n ALA 1132CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 3g6j h LYS 1133N 2.79 -0.13 -0.61 0.00 3.64 -0.51 -2.58 116.57 119.17 3g6j h LYS 1133Ca 0.00 0.01 0.07 0.00 -1.27 0.00 0.00 60.65 59.46 3g6j h LYS 1133Cb 0.75 0.03 -0.06 0.00 -0.41 0.00 0.00 32.23 32.54 3g6j h LYS 1133CO 0.00 -0.08 0.30 -0.44 -2.27 0.00 0.00 179.45 176.95 3g6j h ASP 1134N -0.13 0.40 0.39 4.20 3.45 -1.84 -2.33 116.42 120.56 3g6j h ASP 1134Ca 0.07 0.04 -0.11 0.00 0.43 0.00 0.00 57.03 57.47 3g6j h ASP 1134Cb 0.24 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 38.97 3g6j h ASP 1134CO -0.18 0.26 -0.48 0.40 -1.57 0.00 0.00 179.24 177.68 3g6j h ILE 1135N 0.55 1.34 -0.87 0.35 2.04 -1.86 -3.32 117.51 115.74 3g6j h ILE 1135Ca 0.28 -1.66 -0.57 0.00 1.00 0.00 0.00 64.86 63.92 3g6j h ILE 1135Cb 0.24 1.84 -0.42 0.00 -0.74 0.00 0.00 36.82 37.74 3g6j h ILE 1135CO -0.21 0.48 -0.68 0.00 0.00 0.00 0.00 178.15 177.74 3g6j n GLU 1137N -0.69 0.55 -0.83 0.00 1.02 -0.93 -3.10 120.64 116.65 3g6j n GLU 1137Ca 0.45 0.54 -0.11 0.00 -0.02 0.00 0.00 57.16 58.02 3g6j n GLU 1137Cb 0.90 -1.71 -0.03 0.00 -0.02 0.00 0.00 31.44 30.59 3g6j n GLU 1137CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 3g6j n GLU 1138N -4.45 1.60 0.00 3.49 4.07 -1.26 -3.67 120.64 120.42 3g6j n GLU 1138Ca -0.30 -0.94 0.00 0.00 -0.06 0.00 0.00 57.16 55.86 3g6j n GLU 1138Cb 0.63 -1.51 0.00 0.00 -0.06 0.00 0.00 31.44 30.51 3g6j n GLU 1138CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 3g6j n GLN 1139N 1.25 0.00 -3.75 5.31 6.02 -1.26 -5.04 117.38 119.91 3g6j n GLN 1139Ca 0.23 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.93 3g6j n GLN 1139Cb 0.61 -0.14 -0.12 0.00 1.02 0.00 0.00 30.24 31.60 3g6j n GLN 1139CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3g6j s VAL 1140N -1.00 1.94 -0.03 5.09 1.01 -1.18 -5.08 120.40 121.15 3g6j s VAL 1140Ca 0.00 -3.39 -0.30 0.00 0.00 0.00 0.00 61.98 58.29 3g6j s VAL 1140Cb 0.00 -2.31 -0.07 0.00 0.00 0.00 0.00 36.38 34.00 3g6j s VAL 1140CO 0.00 -1.00 1.81 0.20 0.00 0.00 0.00 175.10 176.11 3g6j s ASN 1141N -0.55 6.51 0.00 3.32 0.02 -1.26 -2.25 114.94 120.73 3g6j s ASN 1141Ca 0.24 2.39 0.00 0.00 -1.02 0.00 0.00 52.86 54.47 3g6j s ASN 1141Cb -0.10 -2.53 0.00 0.00 0.02 0.00 0.00 41.25 38.64 3g6j s ASN 1141CO -0.11 -1.03 0.00 -1.54 0.02 0.00 0.00 177.10 174.43 3g6j n SER 1142N 7.53 0.00 0.03 -1.22 3.41 -1.26 -5.02 113.62 117.09 3g6j n SER 1142Ca 0.19 0.00 -0.10 0.00 -0.26 0.00 0.00 58.87 58.69 3g6j n SER 1142Cb 0.42 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 3g6j n SER 1142CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3g6j h LEU 1143N 0.00 -0.75 -9.53 1.04 5.85 -1.81 -1.73 115.31 108.39 3g6j h LEU 1143Ca 0.00 0.11 -0.53 0.00 0.84 0.00 0.00 57.88 58.30 3g6j h LEU 1143Cb 0.00 0.32 0.01 0.00 0.37 0.00 0.00 40.66 41.36 3g6j h LEU 1143CO 0.00 -0.30 0.56 -2.84 -0.34 0.00 0.00 178.44 175.52 3g6j s PRO 1144N -6.07 4.45 0.00 5.25 0.02 -1.26 -1.28 135.00 136.11 3g6j s PRO 1144Ca -0.15 1.80 0.00 0.00 0.02 0.00 0.00 61.00 62.67 3g6j s PRO 1144Cb 0.10 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.30 3g6j s PRO 1144CO 0.66 -0.21 0.00 0.41 -0.33 0.00 0.00 177.00 177.53 3g6j n GLY 1145N 2.97 3.13 0.20 0.52 0.00 -1.26 -4.75 105.19 106.00 3g6j n GLY 1145Ca 0.08 -0.88 -0.10 0.00 0.00 0.00 0.00 46.02 45.11 3g6j n GLY 1145CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3g6j h SER 1146N 0.18 0.60 -0.28 1.61 0.87 -1.05 0.76 113.55 116.24 3g6j h SER 1146Ca 0.00 -0.28 0.05 0.00 -1.23 0.00 0.00 61.79 60.33 3g6j h SER 1146Cb 0.00 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.75 3g6j h SER 1146CO 0.00 0.73 -0.04 0.40 -0.53 0.00 0.00 176.83 177.39 3g6j h ILE 1147N 0.44 0.75 -0.30 2.23 2.04 -1.43 -2.07 117.51 119.17 3g6j h ILE 1147Ca 0.11 -0.01 -0.03 0.00 1.00 0.00 0.00 64.86 65.93 3g6j h ILE 1147Cb 0.41 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 3g6j h ILE 1147CO 0.01 0.01 0.08 0.74 0.00 0.00 0.00 178.15 178.99 3g6j h THR 1148N 0.03 1.21 -0.78 -0.27 2.02 -1.75 -0.00 112.91 113.37 3g6j h THR 1148Ca 0.13 -0.70 0.01 0.00 0.77 0.00 0.00 66.41 66.62 3g6j h THR 1148Cb 0.20 1.10 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 3g6j h THR 1148CO -0.27 0.23 0.52 0.11 0.37 0.00 0.00 175.52 176.48 3g6j h LYS 1149N 0.32 1.02 -0.61 6.66 1.79 0.67 0.52 116.57 126.94 3g6j h LYS 1149Ca 0.10 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.42 3g6j h LYS 1149Cb 0.28 -0.23 -0.02 0.00 -1.58 0.00 0.00 32.23 30.67 3g6j h LYS 1149CO -0.00 0.68 0.05 0.00 -1.08 0.00 0.00 179.45 179.10 3g6j h ALA 1150N 1.29 0.93 -0.57 3.86 0.00 -1.33 -3.17 119.26 120.26 3g6j h ALA 1150Ca 0.29 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 3g6j h ALA 1150Cb -0.12 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.41 3g6j h ALA 1150CO -0.06 0.65 0.14 0.78 0.00 0.00 0.00 179.25 180.75 3g6j h GLY 1151N 1.02 0.95 1.00 0.00 0.00 0.79 -2.37 103.07 104.46 3g6j h GLY 1151Ca 0.18 -0.55 0.02 0.00 0.00 0.00 0.00 47.33 46.97 3g6j h GLY 1151CO 0.02 0.52 0.66 -0.55 0.00 0.00 0.00 176.54 177.18 3g6j h ASP 1152N 0.85 1.12 -0.12 0.19 3.32 -0.02 -2.76 116.42 119.00 3g6j h ASP 1152Ca 0.18 -0.02 -0.15 0.00 0.02 0.00 0.00 57.03 57.06 3g6j h ASP 1152Cb 0.31 -0.28 0.01 0.00 0.22 0.00 0.00 39.33 39.59 3g6j h ASP 1152CO -0.00 0.80 -0.52 0.15 -1.72 0.00 0.00 179.24 177.96 3g6j h PHE 1153N 1.32 0.75 0.51 4.55 3.57 -1.50 -1.35 116.94 124.79 3g6j h PHE 1153Ca 0.37 -0.32 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 3g6j h PHE 1153Cb -0.12 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.49 3g6j h PHE 1153CO -0.00 1.10 -0.44 -0.07 -2.23 0.00 0.00 178.31 176.68 3g6j h LEU 1154N 0.18 -1.16 -0.46 0.59 3.38 -1.34 -0.58 115.31 115.91 3g6j h LEU 1154Ca -0.03 0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.12 3g6j h LEU 1154Cb 1.15 0.37 -0.10 0.00 0.09 0.00 0.00 40.66 42.18 3g6j h LEU 1154CO 0.11 -0.61 -0.27 -0.08 0.09 0.00 0.00 178.44 177.67 3g6j h GLU 1155N -0.94 -0.17 -0.11 1.13 4.81 -1.56 0.34 114.58 118.08 3g6j h GLU 1155Ca -0.06 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.21 3g6j h GLU 1155Cb 0.80 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 3g6j h GLU 1155CO -0.02 -0.11 -0.38 0.00 -0.73 0.00 0.00 179.01 177.76 3g6j h ALA 1156N 1.01 -0.75 -0.02 2.92 0.00 -0.89 -2.61 119.26 118.92 3g6j h ALA 1156Ca 0.21 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3g6j h ALA 1156Cb 0.51 0.89 0.00 0.00 0.00 0.00 0.00 17.79 19.19 3g6j h ALA 1156CO -0.56 -0.89 0.00 0.09 0.00 0.00 0.00 179.25 177.89 3g6j n ASN 1157N -4.56 0.68 0.06 0.00 4.13 -0.26 -4.37 115.26 110.94 3g6j n ASN 1157Ca -0.04 -1.29 -0.12 0.00 1.68 0.00 0.00 54.58 54.81 3g6j n ASN 1157Cb 0.26 -0.01 -0.06 0.00 -1.54 0.00 0.00 39.78 38.43 3g6j n ASN 1157CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 3g6j h TYR 1158N 1.04 -0.14 -0.00 3.10 3.20 0.09 -3.15 116.97 121.11 3g6j h TYR 1158Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3g6j h TYR 1158Cb 0.22 0.06 -0.00 0.00 1.54 0.00 0.00 36.73 38.55 3g6j h TYR 1158CO 0.01 -0.09 0.00 0.52 -1.64 0.00 0.00 178.16 176.96 3g6j h MET 1159N -0.11 0.00 -0.47 1.82 2.86 -1.76 -0.26 114.93 117.00 3g6j h MET 1159Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3g6j h MET 1159Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 3g6j h MET 1159CO -0.04 0.00 0.00 0.09 1.06 0.00 0.00 176.91 178.02 3g6j n ASN 1160N -3.82 2.99 -4.76 1.22 3.02 -1.19 -4.95 115.26 107.76 3g6j n ASN 1160Ca -0.03 -1.96 -0.39 0.00 -0.03 0.00 0.00 54.58 52.18 3g6j n ASN 1160Cb 0.08 -0.31 0.01 0.00 -0.61 0.00 0.00 39.78 38.95 3g6j n ASN 1160CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3g6j s LEU 1161N -1.21 4.11 0.00 3.41 1.43 -0.11 -4.96 118.68 121.34 3g6j s LEU 1161Ca 0.38 2.68 0.00 0.00 -1.03 0.00 0.00 54.13 56.16 3g6j s LEU 1161Cb 0.21 -4.02 0.00 0.00 0.03 0.00 0.00 46.19 42.41 3g6j s LEU 1161CO 0.28 -1.05 0.00 0.00 0.23 0.00 0.00 176.35 175.81 3g6j n GLN 1162N -0.21 0.71 -2.63 1.70 6.02 -1.26 -5.01 117.38 116.69 3g6j n GLN 1162Ca 0.06 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.65 3g6j n GLN 1162Cb 0.44 -0.96 -0.05 0.00 1.02 0.00 0.00 30.24 30.69 3g6j n GLN 1162CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3g6j s ARG 1163N -1.92 4.70 0.18 -1.09 0.52 -1.26 -4.97 118.95 115.11 3g6j s ARG 1163Ca 0.00 1.61 -0.06 0.00 -0.52 0.00 0.00 55.73 56.75 3g6j s ARG 1163Cb 0.00 -3.15 0.07 0.00 0.52 0.00 0.00 34.95 32.39 3g6j s ARG 1163CO 0.00 0.33 1.52 0.77 0.02 0.00 0.00 175.30 177.94 3g6j h SER 1164N 3.82 0.80 -0.31 0.23 0.02 -1.94 -2.81 113.55 113.36 3g6j h SER 1164Ca -0.46 -0.38 0.07 0.00 -0.84 0.00 0.00 61.79 60.18 3g6j h SER 1164Cb 1.21 -0.23 -0.07 0.00 0.14 0.00 0.00 62.40 63.44 3g6j h SER 1164CO 0.67 1.12 -0.19 0.22 -1.14 0.00 0.00 176.83 177.50 3g6j h TYR 1165N 0.61 -0.49 -0.89 3.45 3.20 -1.86 0.28 116.97 121.26 3g6j h TYR 1165Ca 0.04 0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.96 3g6j h TYR 1165Cb 0.98 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.47 3g6j h TYR 1165CO 0.05 -0.27 0.59 1.15 -1.64 0.00 0.00 178.16 178.04 3g6j h THR 1166N -0.16 1.22 -0.38 1.81 2.02 -1.95 -1.77 112.91 113.70 3g6j h THR 1166Ca 0.16 -0.41 0.04 0.00 0.77 0.00 0.00 66.41 66.97 3g6j h THR 1166Cb 0.41 -0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 66.69 3g6j h THR 1166CO -0.41 0.22 0.15 0.58 0.37 0.00 0.00 175.52 176.43 3g6j h VAL 1167N 1.20 0.91 -0.04 3.16 2.07 -0.95 -1.40 116.25 121.20 3g6j h VAL 1167Ca 0.33 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.73 3g6j h VAL 1167Cb -0.13 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 30.21 3g6j h VAL 1167CO -0.07 0.06 -0.04 0.00 0.02 0.00 0.00 177.57 177.54 3g6j h ALA 1168N 1.24 0.06 -0.59 1.67 0.00 -0.62 0.39 119.26 121.40 3g6j h ALA 1168Ca 0.17 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.76 3g6j h ALA 1168Cb 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3g6j h ALA 1168CO -0.16 -0.17 0.14 0.97 0.00 0.00 0.00 179.25 180.04 3g6j h ILE 1169N -0.36 1.25 -0.24 0.00 2.10 -1.34 -0.49 117.51 118.43 3g6j h ILE 1169Ca 0.01 -0.90 -0.13 0.00 1.08 0.00 0.00 64.86 64.91 3g6j h ILE 1169Cb 0.53 0.70 -0.01 0.00 -1.09 0.00 0.00 36.82 36.95 3g6j h ILE 1169CO 0.01 0.34 -0.39 0.00 -1.08 0.00 0.00 178.15 177.03 3g6j h ALA 1170N 1.03 0.88 -0.17 0.18 0.00 -1.30 -2.36 119.26 117.53 3g6j h ALA 1170Ca 0.19 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 3g6j h ALA 1170Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3g6j h ALA 1170CO 0.00 0.63 0.07 0.78 0.00 0.00 0.00 179.25 180.74 3g6j h GLY 1171N 1.06 0.28 0.99 0.00 0.00 -0.42 0.85 103.07 105.83 3g6j h GLY 1171Ca 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3g6j h GLY 1171CO 0.07 0.14 0.33 -1.82 0.00 0.00 0.00 176.54 175.26 3g6j h TYR 1172N 0.13 0.72 0.02 5.60 3.20 -1.12 0.38 116.97 125.90 3g6j h TYR 1172Ca 0.06 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.95 3g6j h TYR 1172Cb 0.17 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.16 3g6j h TYR 1172CO -0.01 0.50 -0.21 0.00 -1.64 0.00 0.00 178.16 176.80 3g6j h ALA 1173N 1.16 -0.29 -0.54 1.82 0.00 -1.16 -1.41 119.26 118.84 3g6j h ALA 1173Ca 0.20 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 3g6j h ALA 1173Cb -0.01 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3g6j h ALA 1173CO -0.04 -0.71 0.04 -0.07 0.00 0.00 0.00 179.25 178.48 3g6j h LEU 1174N -0.35 0.89 -1.68 0.00 3.38 -0.65 -2.86 115.31 114.05 3g6j h LEU 1174Ca 0.05 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 57.83 3g6j h LEU 1174Cb 0.41 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 3g6j h LEU 1174CO -0.18 0.95 0.37 0.00 0.09 0.00 0.00 178.44 179.68 3g6j h ALA 1175N 0.97 2.02 0.00 1.53 0.00 0.05 0.14 119.26 123.98 3g6j h ALA 1175Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3g6j h ALA 1175Cb 0.47 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3g6j h ALA 1175CO 0.02 -0.14 0.00 1.96 0.00 0.00 0.00 179.25 181.09 3g6j h GLN 1176N 0.37 0.00 -0.19 0.00 4.20 -1.01 -0.67 115.11 117.81 3g6j h GLN 1176Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 3g6j h GLN 1176Cb 0.50 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.28 3g6j h GLN 1176CO -0.06 0.00 0.00 -1.33 -0.67 0.00 0.00 178.83 176.77 3g6j n MET 1177N -2.68 2.02 -1.40 1.46 2.81 0.47 -4.97 117.12 114.83 3g6j n MET 1177Ca -0.01 -1.89 -0.14 0.00 -1.81 0.00 0.00 57.70 53.85 3g6j n MET 1177Cb 0.15 -1.40 -0.06 0.00 -0.71 0.00 0.00 33.22 31.19 3g6j n MET 1177CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3g6j n GLY 1178N 1.16 1.42 1.64 3.03 0.00 -0.26 -4.89 105.19 107.29 3g6j n GLY 1178Ca 0.14 -0.26 0.09 0.00 0.00 0.00 0.00 46.02 46.00 3g6j n GLY 1178CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j n ARG 1179N -2.29 3.84 -3.04 1.61 1.74 -0.99 -4.59 116.66 112.94 3g6j n ARG 1179Ca -0.14 -2.93 -0.44 0.00 -0.77 0.00 0.00 57.85 53.57 3g6j n ARG 1179Cb 0.49 -1.93 0.00 0.00 -1.02 0.00 0.00 32.46 30.01 3g6j n ARG 1179CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3g6j n LEU 1180N 1.14 5.85 -4.12 0.55 7.94 -1.26 -4.89 117.00 122.21 3g6j n LEU 1180Ca 0.26 -4.91 -0.28 0.00 -1.11 0.00 0.00 56.01 49.97 3g6j n LEU 1180Cb 0.92 -1.46 -0.17 0.00 0.53 0.00 0.00 43.42 43.25 3g6j n LEU 1180CO 0.25 1.31 -0.51 -0.75 -1.11 0.00 0.00 177.39 176.58 3g6j s LYS 1181N -0.87 2.33 6.16 1.96 2.36 -1.26 -4.49 119.74 125.93 3g6j s LYS 1181Ca 0.35 -0.64 0.00 0.00 -2.55 0.00 0.00 55.97 53.13 3g6j s LYS 1181Cb -0.02 -1.83 0.00 0.00 -1.05 0.00 0.00 37.83 34.93 3g6j s LYS 1181CO -0.00 0.11 0.00 0.41 1.55 0.00 0.00 175.35 177.42 3g6j n GLY 1182N 3.64 1.69 0.17 5.54 0.00 -1.26 -3.72 105.19 111.25 3g6j n GLY 1182Ca -0.21 -0.18 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 3g6j n GLY 1182CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3g6j h PRO 1183N 0.00 0.12 0.00 1.61 0.11 -1.99 -0.34 132.00 131.51 3g6j h PRO 1183Ca 0.00 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 66.04 3g6j h PRO 1183Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3g6j h PRO 1183CO 0.00 0.60 -0.00 -0.07 -0.21 0.00 0.00 178.00 178.32 3g6j h LEU 1184N 0.09 -0.00 -1.38 2.35 4.07 -1.95 -2.67 115.31 115.82 3g6j h LEU 1184Ca 0.00 -0.60 0.11 0.00 0.08 0.00 0.00 57.88 57.46 3g6j h LEU 1184Cb 0.93 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 42.61 3g6j h LEU 1184CO 0.07 0.60 0.51 0.25 -1.08 0.00 0.00 178.44 178.80 3g6j h LEU 1185N -0.61 0.61 0.40 1.67 5.85 -1.70 0.94 115.31 122.47 3g6j h LEU 1185Ca -0.00 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 3g6j h LEU 1185Cb 0.61 -0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.53 3g6j h LEU 1185CO 0.00 0.36 -0.19 -1.13 -0.34 0.00 0.00 178.44 177.14 3g6j h ASN 1186N 0.67 -0.45 -0.59 1.25 -0.00 -1.05 -1.50 115.58 113.91 3g6j h ASN 1186Ca 0.37 -0.07 0.05 0.00 -0.00 0.00 0.00 56.30 56.64 3g6j h ASN 1186Cb 0.51 0.12 -0.05 0.00 -0.00 0.00 0.00 38.32 38.90 3g6j h ASN 1186CO -0.14 -0.20 0.33 0.50 -0.00 0.00 0.00 177.43 177.92 3g6j h LYS 1187N -0.69 0.61 -0.05 6.67 3.64 -1.05 0.66 116.57 126.37 3g6j h LYS 1187Ca -0.05 -0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.32 3g6j h LYS 1187Cb 0.49 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 3g6j h LYS 1187CO 0.09 0.40 -0.49 0.35 -2.27 0.00 0.00 179.45 177.53 3g6j h PHE 1188N 0.62 -1.44 -0.08 1.91 3.57 -0.74 -0.78 116.94 120.00 3g6j h PHE 1188Ca 0.26 0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.80 3g6j h PHE 1188Cb 0.13 0.64 -0.00 0.00 2.79 0.00 0.00 35.95 39.50 3g6j h PHE 1188CO -0.08 -0.54 0.02 -0.07 -2.23 0.00 0.00 178.31 175.40 3g6j h LEU 1189N -0.61 0.13 -1.14 0.59 3.38 -0.73 -2.71 115.31 114.23 3g6j h LEU 1189Ca 0.04 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.75 3g6j h LEU 1189Cb 0.69 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.40 3g6j h LEU 1189CO -0.37 0.35 0.00 0.71 0.09 0.00 0.00 178.44 179.22 3g6j h THR 1190N -0.09 0.00 0.00 0.22 1.35 -0.82 -2.01 112.91 111.56 3g6j h THR 1190Ca 0.03 -0.16 -0.08 0.00 -0.55 0.00 0.00 66.41 65.65 3g6j h THR 1190Cb 0.27 0.83 -0.01 0.00 -1.73 0.00 0.00 68.15 67.51 3g6j h THR 1190CO 0.00 0.00 -0.37 0.74 -0.25 0.00 0.00 175.52 175.64 3g6j h THR 1191N 0.00 1.26 -3.92 6.82 2.02 -0.79 -3.45 112.91 114.85 3g6j h THR 1191Ca 0.00 -1.26 -0.54 0.00 0.77 0.00 0.00 66.41 65.38 3g6j h THR 1191Cb 0.23 1.68 0.11 0.00 -1.74 0.00 0.00 68.15 68.43 3g6j h THR 1191CO 0.00 0.36 0.79 0.00 0.37 0.00 0.00 175.52 177.04 3g6j s ALA 1192N -4.20 3.58 -0.25 6.16 0.00 -0.76 -4.84 121.76 121.45 3g6j s ALA 1192Ca -0.03 1.58 -0.20 0.00 0.00 0.00 0.00 51.96 53.32 3g6j s ALA 1192Cb 0.14 -3.61 -0.02 0.00 0.00 0.00 0.00 23.12 19.63 3g6j s ALA 1192CO 0.73 -1.06 0.59 0.21 0.00 0.00 0.00 175.76 176.22 3g6j s LYS 1193N -2.04 4.11 -1.46 0.00 2.20 -0.24 -3.99 119.74 118.32 3g6j s LYS 1193Ca 0.53 0.49 -0.11 0.00 -0.36 0.00 0.00 55.97 56.52 3g6j s LYS 1193Cb -0.47 -3.64 0.07 0.00 -1.51 0.00 0.00 37.83 32.28 3g6j s LYS 1193CO 0.63 -0.37 0.77 -0.25 -0.36 0.00 0.00 175.35 175.77 3g6j n ASP 1194N 5.58 -4.76 -1.73 1.43 8.00 -1.26 -2.94 116.55 120.87 3g6j n ASP 1194Ca -0.02 -0.57 -0.11 0.00 0.71 0.00 0.00 54.79 54.80 3g6j n ASP 1194Cb 0.49 -3.84 -0.03 0.00 -0.02 0.00 0.00 41.12 37.72 3g6j n ASP 1194CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3g6j n LYS 1195N -4.29 -1.63 0.00 -1.24 5.02 -1.26 -4.71 118.16 110.06 3g6j n LYS 1195Ca -0.00 0.60 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 3g6j n LYS 1195Cb 0.55 -4.95 0.00 0.00 -0.02 0.00 0.00 35.03 30.61 3g6j n LYS 1195CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3g6j n ASN 1196N -0.80 1.89 -4.48 4.39 0.23 -1.15 -4.38 115.26 110.96 3g6j n ASN 1196Ca -0.12 0.00 -0.24 0.00 -0.53 0.00 0.00 54.58 53.69 3g6j n ASN 1196Cb 0.45 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.05 3g6j n ASN 1196CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3g6j s ARG 1197N -1.70 1.69 -0.51 -3.83 1.70 -1.21 -4.09 118.95 111.01 3g6j s ARG 1197Ca 0.00 -1.80 0.04 0.00 -0.47 0.00 0.00 55.73 53.50 3g6j s ARG 1197Cb 0.00 -1.71 0.13 0.00 -0.57 0.00 0.00 34.95 32.80 3g6j s ARG 1197CO 0.00 0.28 0.24 -1.58 -1.08 0.00 0.00 175.30 173.16 3g6j s TRP 1198N -2.56 3.23 0.39 5.89 0.51 -1.26 -1.08 118.94 124.05 3g6j s TRP 1198Ca 0.30 -3.16 0.08 0.00 -2.12 0.00 0.00 56.10 51.20 3g6j s TRP 1198Cb -0.03 -2.83 -0.06 0.00 -0.81 0.00 0.00 33.47 29.74 3g6j s TRP 1198CO 0.15 -0.76 0.09 -1.83 -0.51 0.00 0.00 176.95 174.09 3g6j s GLU 1199N -0.20 2.12 -0.03 4.98 -1.05 -1.26 -4.11 118.70 119.15 3g6j s GLU 1199Ca 0.16 -1.87 -0.10 0.00 -0.15 0.00 0.00 54.97 53.02 3g6j s GLU 1199Cb -0.25 -1.89 0.01 0.00 -0.44 0.00 0.00 34.13 31.56 3g6j s GLU 1199CO -0.01 -0.02 0.22 -0.51 0.95 0.00 0.00 175.26 175.89 3g6j s ASP 1200N -3.80 -0.11 -0.01 0.83 1.01 -1.26 -4.54 116.67 108.79 3g6j s ASP 1200Ca 0.38 0.06 -0.35 0.00 0.71 0.00 0.00 52.55 53.35 3g6j s ASP 1200Cb 0.04 0.31 -0.13 0.00 1.01 0.00 0.00 42.92 44.15 3g6j s ASP 1200CO 0.21 -0.32 1.73 -0.81 0.21 0.00 0.00 175.17 176.19 3g6j n PRO 1201N 1.80 2.00 0.00 8.23 -0.04 -1.26 -4.73 135.00 141.00 3g6j n PRO 1201Ca -0.20 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 63.99 3g6j n PRO 1201Cb 0.56 -2.52 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 3g6j n PRO 1201CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3g6j n GLY 1202N 3.92 0.88 3.62 0.55 0.00 -1.26 -5.09 105.19 107.82 3g6j n GLY 1202Ca 0.21 -1.97 -0.56 0.00 0.00 0.00 0.00 46.02 43.71 3g6j n GLY 1202CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g6j n LYS 1203N 0.00 0.92 0.02 1.61 5.02 -1.26 -4.83 118.16 119.64 3g6j n LYS 1203Ca 0.00 0.33 0.14 0.00 -2.02 0.00 0.00 58.31 56.76 3g6j n LYS 1203Cb 0.00 -1.96 0.53 0.00 -0.02 0.00 0.00 35.03 33.58 3g6j n LYS 1203CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3g6j n GLN 1204N 3.31 0.06 -0.31 1.97 6.02 -1.26 -2.12 117.38 125.05 3g6j n GLN 1204Ca 0.22 0.05 -0.04 0.00 -0.01 0.00 0.00 57.00 57.21 3g6j n GLN 1204Cb 0.14 -1.57 0.08 0.00 1.02 0.00 0.00 30.24 29.91 3g6j n GLN 1204CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3g6j h LEU 1205N 0.00 1.04 -1.37 1.08 3.38 -1.98 -1.56 115.31 115.90 3g6j h LEU 1205Ca 0.00 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 3g6j h LEU 1205Cb 0.56 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3g6j h LEU 1205CO 0.00 0.84 0.21 1.88 0.09 0.00 0.00 178.44 181.46 3g6j h TYR 1206N 1.16 0.63 -0.33 1.13 0.05 -1.79 0.17 116.97 118.00 3g6j h TYR 1206Ca 0.29 -0.02 -0.17 0.00 0.05 0.00 0.00 58.73 58.89 3g6j h TYR 1206Cb 0.03 -0.20 -0.00 0.00 1.01 0.00 0.00 36.73 37.57 3g6j h TYR 1206CO 0.01 0.48 -0.44 -0.91 -1.05 0.00 0.00 178.16 176.24 3g6j h ASN 1207N 0.64 0.95 -0.18 3.88 2.35 -1.57 0.19 115.58 121.84 3g6j h ASN 1207Ca 0.16 -0.50 -0.05 0.00 -0.55 0.00 0.00 56.30 55.36 3g6j h ASN 1207Cb 0.09 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.17 3g6j h ASN 1207CO -0.02 1.27 -0.04 0.58 -1.65 0.00 0.00 177.43 177.56 3g6j h VAL 1208N 0.67 1.20 0.29 2.81 2.07 -0.71 -1.51 116.25 121.08 3g6j h VAL 1208Ca 0.04 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.70 3g6j h VAL 1208Cb 1.04 1.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 3g6j h VAL 1208CO 0.10 0.28 -0.14 -0.08 0.02 0.00 0.00 177.57 177.76 3g6j h GLU 1209N 0.47 -0.38 -0.75 1.57 4.81 -0.36 -2.94 114.58 117.00 3g6j h GLU 1209Ca 0.10 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.42 3g6j h GLU 1209Cb 0.37 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 29.78 3g6j h GLU 1209CO 0.02 -0.04 0.43 0.00 -0.73 0.00 0.00 179.01 178.68 3g6j h ALA 1210N -0.28 1.02 -0.01 2.92 0.00 -0.57 -2.28 119.26 120.06 3g6j h ALA 1210Ca -0.04 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3g6j h ALA 1210Cb 0.51 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3g6j h ALA 1210CO 0.07 0.11 -0.42 1.15 0.00 0.00 0.00 179.25 180.15 3g6j h THR 1211N 0.77 1.31 -0.24 0.00 2.02 -1.36 -1.07 112.91 114.33 3g6j h THR 1211Ca 0.34 -1.46 -0.15 0.00 0.77 0.00 0.00 66.41 65.91 3g6j h THR 1211Cb 0.22 1.78 0.00 0.00 -1.74 0.00 0.00 68.15 68.41 3g6j h THR 1211CO -0.20 0.42 -0.44 0.28 0.37 0.00 0.00 175.52 175.95 3g6j h SER 1212N 0.01 0.80 -0.98 4.18 0.02 -1.23 0.25 113.55 116.60 3g6j h SER 1212Ca -0.00 -0.54 0.01 0.00 -0.84 0.00 0.00 61.79 60.42 3g6j h SER 1212Cb 0.75 -0.23 -0.05 0.00 0.14 0.00 0.00 62.40 63.01 3g6j h SER 1212CO 0.06 1.19 0.63 1.88 -1.14 0.00 0.00 176.83 179.45 3g6j h TYR 1213N 0.45 1.25 0.14 3.45 0.05 -1.31 -1.03 116.97 119.98 3g6j h TYR 1213Ca 0.01 0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.81 3g6j h TYR 1213Cb 1.04 -0.42 0.00 0.00 1.01 0.00 0.00 36.73 38.36 3g6j h TYR 1213CO 0.08 0.80 -0.07 0.00 -1.05 0.00 0.00 178.16 177.93 3g6j h ALA 1214N 1.35 -0.19 -0.74 3.88 0.00 -0.91 -0.44 119.26 122.21 3g6j h ALA 1214Ca 0.36 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.29 3g6j h ALA 1214Cb -0.13 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.68 3g6j h ALA 1214CO -0.07 -0.60 0.42 1.25 0.00 0.00 0.00 179.25 180.25 3g6j h LEU 1215N -0.20 0.63 -1.55 0.00 5.85 -0.28 0.20 115.31 119.97 3g6j h LEU 1215Ca -0.02 0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.68 3g6j h LEU 1215Cb 0.15 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3g6j h LEU 1215CO 0.03 0.40 -0.23 -0.07 -0.34 0.00 0.00 178.44 178.23 3g6j h LEU 1216N 0.77 0.00 -0.10 2.25 3.38 -0.95 0.02 115.31 120.67 3g6j h LEU 1216Ca 0.33 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.17 3g6j h LEU 1216Cb 0.22 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.97 3g6j h LEU 1216CO -0.19 0.23 -0.44 0.00 0.09 0.00 0.00 178.44 178.12 3g6j h ALA 1217N 1.77 0.19 -0.01 1.53 0.00 0.15 -2.66 119.26 120.24 3g6j h ALA 1217Ca -0.00 -0.48 0.02 0.00 0.00 0.00 0.00 54.91 54.45 3g6j h ALA 1217Cb 0.42 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3g6j h ALA 1217CO 0.03 0.33 -0.13 -0.07 0.00 0.00 0.00 179.25 179.42 3g6j h LEU 1218N 0.07 -0.38 -1.38 0.00 3.38 -0.22 -2.25 115.31 114.53 3g6j h LEU 1218Ca -0.03 0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.07 3g6j h LEU 1218Cb 1.08 0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.95 3g6j h LEU 1218CO 0.09 -0.18 0.48 -0.07 0.09 0.00 0.00 178.44 178.85 3g6j h LEU 1219N -0.22 0.66 -0.10 1.67 3.38 -1.08 -0.06 115.31 119.56 3g6j h LEU 1219Ca 0.05 0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 3g6j h LEU 1219Cb 0.28 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3g6j h LEU 1219CO -0.13 0.42 0.04 -0.61 0.09 0.00 0.00 178.44 178.25 3g6j h GLN 1220N 0.74 0.14 -0.03 1.13 5.75 -1.08 -2.77 115.11 119.00 3g6j h GLN 1220Ca 0.32 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.72 3g6j h GLN 1220Cb 0.31 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.82 3g6j h GLN 1220CO -0.11 0.24 -0.35 -0.07 -2.65 0.00 0.00 178.83 175.89 3g6j h LEU 1221N 0.02 0.06 0.67 -2.39 3.38 -0.87 -3.47 115.31 112.70 3g6j h LEU 1221Ca 0.03 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 3g6j h LEU 1221Cb 0.14 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3g6j h LEU 1221CO -0.00 0.41 -0.14 0.29 0.09 0.00 0.00 178.44 179.09 3g6j n LYS 1222N -4.11 -0.46 -1.91 1.13 5.02 -0.08 -4.96 118.16 112.79 3g6j n LYS 1222Ca -0.02 0.43 -0.39 0.00 -2.02 0.00 0.00 58.31 56.32 3g6j n LYS 1222Cb 0.40 -4.24 -0.03 0.00 -0.02 0.00 0.00 35.03 31.14 3g6j n LYS 1222CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3g6j n ASP 1223N 0.91 3.60 0.00 4.39 2.03 -1.19 -4.73 116.55 121.56 3g6j n ASP 1223Ca -0.07 -2.78 0.09 0.00 0.52 0.00 0.00 54.79 52.55 3g6j n ASP 1223Cb 0.44 -1.57 0.42 0.00 -0.72 0.00 0.00 41.12 39.68 3g6j n ASP 1223CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 3g6j n PHE 1224N 9.43 0.00 0.01 -0.67 3.72 -1.26 -2.48 117.46 126.20 3g6j n PHE 1224Ca 0.49 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.77 3g6j n PHE 1224Cb 0.43 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 3g6j n PHE 1224CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3g6j h ASP 1225N 0.00 0.67 1.70 4.37 3.32 -2.00 -3.27 116.42 121.21 3g6j h ASP 1225Ca 0.00 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.63 3g6j h ASP 1225Cb 0.31 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.66 3g6j h ASP 1225CO 0.00 1.17 -0.28 0.15 -1.72 0.00 0.00 179.24 178.56 3g6j h PHE 1226N 0.41 0.00 -0.01 4.55 3.04 -1.90 -3.40 116.94 119.63 3g6j h PHE 1226Ca -0.02 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.92 3g6j h PHE 1226Cb 1.27 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.78 3g6j h PHE 1226CO 0.06 0.00 0.00 0.28 -2.02 0.00 0.00 178.31 176.63 3g6j h VAL 1227N 0.00 1.25 -0.71 1.41 2.07 -1.60 -3.35 116.25 115.31 3g6j h VAL 1227Ca 0.00 -0.73 0.12 0.00 0.82 0.00 0.00 66.70 66.91 3g6j h VAL 1227Cb 0.99 1.72 -0.09 0.00 -1.52 0.00 0.00 31.29 32.40 3g6j h VAL 1227CO 0.00 0.19 0.29 -0.65 0.02 0.00 0.00 177.57 177.42 3g6j h PRO 1228N -0.29 0.44 -0.23 1.57 0.11 -1.78 0.29 132.00 132.12 3g6j h PRO 1228Ca 0.00 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 66.07 3g6j h PRO 1228Cb 0.31 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.31 3g6j h PRO 1228CO 0.00 0.29 0.06 -1.35 -0.21 0.00 0.00 178.00 176.79 3g6j h PRO 1229N 0.46 0.32 0.10 1.05 0.11 -1.87 0.16 132.00 132.32 3g6j h PRO 1229Ca 0.38 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.44 3g6j h PRO 1229Cb 0.53 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.58 3g6j h PRO 1229CO -0.36 0.30 -0.05 0.28 -0.21 0.00 0.00 178.00 177.97 3g6j h VAL 1230N 0.32 1.12 -0.63 3.15 2.07 -1.13 -0.62 116.25 120.54 3g6j h VAL 1230Ca 0.08 -1.25 0.08 0.00 0.82 0.00 0.00 66.70 66.43 3g6j h VAL 1230Cb 0.13 1.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.73 3g6j h VAL 1230CO -0.00 0.29 0.42 0.58 0.02 0.00 0.00 177.57 178.87 3g6j h VAL 1231N -0.75 0.95 0.19 2.57 2.07 -1.20 -0.91 116.25 119.17 3g6j h VAL 1231Ca -0.01 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 3g6j h VAL 1231Cb 0.57 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3g6j h VAL 1231CO 0.02 0.10 -0.09 -0.09 0.02 0.00 0.00 177.57 177.53 3g6j h ARG 1232N 0.54 -0.24 -0.94 1.57 2.43 -0.60 -2.23 114.38 114.92 3g6j h ARG 1232Ca 0.28 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.52 3g6j h ARG 1232Cb 0.40 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.94 3g6j h ARG 1232CO -0.09 0.02 0.61 2.35 -1.51 0.00 0.00 179.97 181.36 3g6j h TRP 1233N -0.48 1.13 0.28 2.20 7.01 -0.64 -1.69 115.95 123.75 3g6j h TRP 1233Ca -0.03 0.03 -0.01 0.00 2.11 0.00 0.00 58.89 60.99 3g6j h TRP 1233Cb 0.37 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 27.05 3g6j h TRP 1233CO 0.00 0.62 -0.18 -0.07 -2.79 0.00 0.00 178.44 176.03 3g6j h LEU 1234N 1.14 -0.45 -2.00 0.65 3.38 -1.09 -2.93 115.31 114.01 3g6j h LEU 1234Ca 0.39 0.03 0.12 0.00 0.09 0.00 0.00 57.88 58.50 3g6j h LEU 1234Cb 0.09 0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3g6j h LEU 1234CO -0.13 -0.27 0.42 0.78 0.09 0.00 0.00 178.44 179.33 3g6j h ASN 1235N -0.43 0.00 -0.64 -0.43 2.35 -1.32 -1.17 115.58 113.94 3g6j h ASN 1235Ca -0.04 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.65 3g6j h ASN 1235Cb 0.34 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.69 3g6j h ASN 1235CO 0.03 0.00 0.15 -0.33 -1.65 0.00 0.00 177.43 175.63 3g6j h GLU 1236N 0.00 1.04 0.00 0.81 5.08 -1.13 -2.77 114.58 117.60 3g6j h GLU 1236Ca 0.19 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3g6j h GLU 1236Cb 1.03 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 30.14 3g6j h GLU 1236CO -0.00 0.94 -0.15 1.96 -1.00 0.00 0.00 179.01 180.76 3g6j h GLN 1237N 0.96 0.00 -6.28 2.33 1.08 -1.05 -3.47 115.11 108.68 3g6j h GLN 1237Ca 0.20 0.00 -0.44 0.00 -1.45 0.00 0.00 58.65 56.96 3g6j h GLN 1237Cb 0.37 0.00 0.08 0.00 -0.05 0.00 0.00 27.48 27.87 3g6j h GLN 1237CO 0.00 0.15 -0.93 0.54 -0.95 0.00 0.00 178.83 177.64 3g6j n ARG 1238N -3.88 -1.13 -3.14 1.46 1.74 -1.05 -4.94 116.66 105.72 3g6j n ARG 1238Ca -0.02 0.45 -0.41 0.00 -0.77 0.00 0.00 57.85 57.10 3g6j n ARG 1238Cb 0.24 -3.96 -0.07 0.00 -1.02 0.00 0.00 32.46 27.66 3g6j n ARG 1238CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3g6j s TYR 1239N -3.44 3.21 -1.10 -1.55 5.04 -1.26 -4.93 117.35 113.31 3g6j s TYR 1239Ca 0.46 0.52 0.14 0.00 -2.44 0.00 0.00 57.07 55.75 3g6j s TYR 1239Cb -0.17 -2.96 0.43 0.00 0.35 0.00 0.00 41.96 39.60 3g6j s TYR 1239CO 0.87 -0.47 1.36 0.66 -1.34 0.00 0.00 175.55 176.62 3g6j n TYR 1240N 5.84 0.69 -2.75 4.97 4.01 -1.26 -5.05 117.16 123.61 3g6j n TYR 1240Ca -0.02 -0.54 0.05 0.00 -0.16 0.00 0.00 57.90 57.23 3g6j n TYR 1240Cb 0.49 -0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 39.45 3g6j n TYR 1240CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3g6j n GLY 1241N 0.72 -1.76 0.00 2.72 0.00 -1.26 -4.90 105.19 100.71 3g6j n GLY 1241Ca 0.16 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.92 3g6j n GLY 1241CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6j n GLY 1242N -1.33 -2.31 0.00 -0.02 0.00 -1.26 -5.00 105.19 95.26 3g6j n GLY 1242Ca 0.00 -1.48 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3g6j n GLY 1242CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g6j n GLY 1243N -1.96 0.26 3.56 -0.02 0.00 -1.26 -4.68 105.19 101.10 3g6j n GLY 1243Ca 0.00 -1.79 -0.52 0.00 0.00 0.00 0.00 46.02 43.72 3g6j n GLY 1243CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3g6j n TYR 1244N 0.43 1.21 -1.70 1.61 9.36 -1.26 -2.14 117.16 124.67 3g6j n TYR 1244Ca 0.00 0.73 -0.14 0.00 3.32 0.00 0.00 57.90 61.81 3g6j n TYR 1244Cb 0.00 -2.26 -0.04 0.00 -0.63 0.00 0.00 39.34 36.41 3g6j n TYR 1244CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3g6j n GLY 1245N 2.14 0.91 0.94 2.98 0.00 -1.26 -4.90 105.19 105.99 3g6j n GLY 1245Ca 0.17 -0.33 0.09 0.00 0.00 0.00 0.00 46.02 45.96 3g6j n GLY 1245CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3g6j n SER 1246N -0.45 3.14 0.38 1.61 3.41 -0.91 -4.73 113.62 116.07 3g6j n SER 1246Ca -0.15 -1.91 -0.19 0.00 -0.26 0.00 0.00 58.87 56.36 3g6j n SER 1246Cb 0.52 -0.23 -0.10 0.00 -0.26 0.00 0.00 64.21 64.15 3g6j n SER 1246CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3g6j h THR 1247N 3.48 0.07 0.09 6.66 2.02 -1.83 -0.78 112.91 122.62 3g6j h THR 1247Ca 0.00 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3g6j h THR 1247Cb 0.84 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 3g6j h THR 1247CO 0.00 0.00 -0.05 1.56 0.37 0.00 0.00 175.52 177.40 3g6j h GLN 1248N -1.10 -0.12 -0.31 6.66 1.08 -1.85 -1.19 115.11 118.27 3g6j h GLN 1248Ca -0.09 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.18 3g6j h GLN 1248Cb 0.90 0.03 -0.08 0.00 -0.05 0.00 0.00 27.48 28.28 3g6j h GLN 1248CO 0.06 0.30 -0.41 0.00 -0.95 0.00 0.00 178.83 177.83 3g6j h ALA 1249N 0.25 -0.44 -0.14 3.87 0.00 -1.86 0.21 119.26 121.15 3g6j h ALA 1249Ca -0.01 0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3g6j h ALA 1249Cb 0.47 0.83 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 3g6j h ALA 1249CO 0.02 -0.86 -0.18 1.15 0.00 0.00 0.00 179.25 179.38 3g6j h THR 1250N -0.37 0.53 0.13 0.00 2.02 -1.13 0.14 112.91 114.23 3g6j h THR 1250Ca 0.12 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 3g6j h THR 1250Cb 0.59 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 3g6j h THR 1250CO -0.51 0.00 -0.06 0.15 0.37 0.00 0.00 175.52 175.47 3g6j h PHE 1251N -0.22 -0.16 -0.43 3.16 3.04 -0.55 -3.05 116.94 118.72 3g6j h PHE 1251Ca 0.10 -0.00 -0.13 0.00 3.98 0.00 0.00 57.97 61.92 3g6j h PHE 1251Cb 0.37 0.05 -0.01 0.00 2.56 0.00 0.00 35.95 38.92 3g6j h PHE 1251CO -0.30 -0.03 -0.25 0.52 -2.02 0.00 0.00 178.31 176.23 3g6j h MET 1252N -0.25 0.91 -0.61 1.11 2.86 -0.50 -2.18 114.93 116.27 3g6j h MET 1252Ca -0.02 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.21 3g6j h MET 1252Cb 0.20 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 3g6j h MET 1252CO 0.03 1.06 0.35 -0.24 1.06 0.00 0.00 176.91 179.16 3g6j h VAL 1253N 0.78 1.19 0.00 -2.22 3.04 -0.71 0.01 116.25 118.35 3g6j h VAL 1253Ca 0.10 -0.45 0.00 0.00 -1.01 0.00 0.00 66.70 65.33 3g6j h VAL 1253Cb 0.82 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.48 3g6j h VAL 1253CO 0.07 0.20 -0.36 -0.26 -1.01 0.00 0.00 177.57 176.21 3g6j h PHE 1254N 0.83 0.00 -0.19 3.17 0.04 -1.55 -1.03 116.94 118.21 3g6j h PHE 1254Ca 0.22 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.90 3g6j h PHE 1254Cb 0.01 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 3g6j h PHE 1254CO -0.01 0.00 -0.23 0.37 -0.60 0.00 0.00 178.31 177.83 3g6j h GLN 1255N 0.00 0.49 0.08 1.51 4.15 -1.02 -2.53 115.11 117.78 3g6j h GLN 1255Ca 0.00 -0.27 -0.00 0.00 0.77 0.00 0.00 58.65 59.14 3g6j h GLN 1255Cb 0.79 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.50 3g6j h GLN 1255CO 0.00 0.86 -0.04 0.00 -1.93 0.00 0.00 178.83 177.72 3g6j h ALA 1256N 0.62 -0.10 -0.20 3.38 0.00 -0.88 0.52 119.26 122.59 3g6j h ALA 1256Ca 0.02 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 3g6j h ALA 1256Cb 0.79 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3g6j h ALA 1256CO 0.06 -0.41 -0.21 -0.07 0.00 0.00 0.00 179.25 178.62 3g6j h LEU 1257N -0.40 0.35 -0.03 0.00 3.38 -1.33 0.14 115.31 117.44 3g6j h LEU 1257Ca -0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3g6j h LEU 1257Cb 0.34 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 3g6j h LEU 1257CO 0.02 0.58 -0.03 0.00 0.09 0.00 0.00 178.44 179.10 3g6j h ALA 1258N 1.46 0.04 0.00 1.53 0.00 -1.39 -2.90 119.26 118.00 3g6j h ALA 1258Ca 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3g6j h ALA 1258Cb 0.55 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 3g6j h ALA 1258CO 0.04 -0.19 -0.13 0.37 0.00 0.00 0.00 179.25 179.33 3g6j h GLN 1259N -0.40 0.00 -0.75 0.00 5.75 -0.76 -2.44 115.11 116.52 3g6j h GLN 1259Ca 0.00 0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.44 3g6j h GLN 1259Cb 0.52 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.04 3g6j h GLN 1259CO 0.01 0.13 0.23 -0.92 -2.65 0.00 0.00 178.83 175.63 3g6j h TYR 1260N 0.00 1.20 -0.24 3.99 3.20 -0.64 -2.76 116.97 121.72 3g6j h TYR 1260Ca -0.00 -0.12 -0.05 0.00 3.14 0.00 0.00 58.73 61.69 3g6j h TYR 1260Cb 0.25 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 3g6j h TYR 1260CO 0.00 0.95 -0.06 1.96 -1.64 0.00 0.00 178.16 179.37 3g6j h GLN 1261N 1.11 0.47 -1.03 1.82 1.08 -1.24 -3.06 115.11 114.27 3g6j h GLN 1261Ca 0.24 -0.18 0.26 0.00 -1.45 0.00 0.00 58.65 57.52 3g6j h GLN 1261Cb 0.31 -0.03 -0.11 0.00 -0.05 0.00 0.00 27.48 27.61 3g6j h GLN 1261CO -0.01 0.70 0.64 0.87 -0.95 0.00 0.00 178.83 180.08 3g6j h LYS 1262N 0.21 0.45 -2.57 1.46 1.79 -1.32 -2.89 116.57 113.71 3g6j h LYS 1262Ca 0.06 -0.03 -0.78 0.00 -2.18 0.00 0.00 60.65 57.72 3g6j h LYS 1262Cb 0.52 -0.10 -0.29 0.00 -1.58 0.00 0.00 32.23 30.78 3g6j h LYS 1262CO 0.02 0.30 0.72 -0.25 -1.08 0.00 0.00 179.45 179.16 3g6j n ASP 1263N -4.72 6.53 -3.85 0.86 8.00 -1.05 -4.95 116.55 117.36 3g6j n ASP 1263Ca 0.26 -3.54 -0.21 0.00 0.71 0.00 0.00 54.79 52.01 3g6j n ASP 1263Cb 0.83 -1.15 -0.17 0.00 -0.02 0.00 0.00 41.12 40.61 3g6j n ASP 1263CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3g6j s ALA 1264N -3.43 0.69 0.35 2.24 0.00 -1.09 -4.95 121.76 115.57 3g6j s ALA 1264Ca 0.36 -0.09 -0.29 0.00 0.00 0.00 0.00 51.96 51.94 3g6j s ALA 1264Cb 0.12 -0.54 -0.11 0.00 0.00 0.00 0.00 23.12 22.60 3g6j s ALA 1264CO -0.00 -0.17 1.50 -2.14 0.00 0.00 0.00 175.76 174.94 3g6j s PRO 1265N 1.28 4.13 0.00 0.00 0.02 -1.26 -4.96 135.00 134.22 3g6j s PRO 1265Ca -0.05 2.54 -0.18 0.00 0.02 0.00 0.00 61.00 63.32 3g6j s PRO 1265Cb -0.14 -2.99 -0.32 0.00 0.02 0.00 0.00 34.50 31.07 3g6j s PRO 1265CO -0.02 -0.53 0.98 -0.44 -0.33 0.00 0.00 177.00 176.67 3g6j h ASP 1266N 3.53 0.69 -3.35 2.53 3.32 -2.00 -3.46 116.42 117.69 3g6j h ASP 1266Ca -0.50 -0.91 -0.44 0.00 0.02 0.00 0.00 57.03 55.21 3g6j h ASP 1266Cb 1.23 -0.22 -0.36 0.00 0.22 0.00 0.00 39.33 40.20 3g6j h ASP 1266CO 0.68 1.54 -0.78 -1.00 -1.72 0.00 0.00 179.24 177.97 3g6j s HIS 1267N -2.65 0.85 -0.19 4.55 3.76 -1.26 -4.85 115.29 115.50 3g6j s HIS 1267Ca -0.11 -0.28 -0.32 0.00 -0.15 0.00 0.00 55.06 54.20 3g6j s HIS 1267Cb 0.03 -0.81 -0.09 0.00 1.11 0.00 0.00 32.58 32.82 3g6j s HIS 1267CO 0.89 -0.29 2.08 1.04 -0.85 0.00 0.00 174.74 177.61 3g6j n GLN 1268N 4.55 1.89 -2.12 1.40 1.13 -1.26 -4.82 117.38 118.15 3g6j n GLN 1268Ca -0.17 0.61 -0.41 0.00 -1.94 0.00 0.00 57.00 55.09 3g6j n GLN 1268Cb 0.50 -2.81 -0.03 0.00 0.11 0.00 0.00 30.24 28.01 3g6j n GLN 1268CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 3g6j s GLU 1269N 5.38 3.09 -0.29 -1.09 2.02 -1.26 -4.94 118.70 121.61 3g6j s GLU 1269Ca 0.99 0.90 -0.25 0.00 0.02 0.00 0.00 54.97 56.64 3g6j s GLU 1269Cb -0.60 -4.24 0.00 0.00 0.10 0.00 0.00 34.13 29.39 3g6j s GLU 1269CO 0.45 -2.17 0.85 -0.51 0.02 0.00 0.00 175.26 173.90 3g6j s LEU 1270N 7.41 4.06 -0.37 1.80 1.43 -1.26 -3.45 118.68 128.31 3g6j s LEU 1270Ca 0.68 0.83 0.13 0.00 -1.03 0.00 0.00 54.13 54.74 3g6j s LEU 1270Cb -0.16 -3.18 0.40 0.00 0.03 0.00 0.00 46.19 43.28 3g6j s LEU 1270CO 0.27 -0.63 1.03 -3.20 0.23 0.00 0.00 176.35 174.05 3g6j n ASN 1271N 6.26 0.04 -4.73 2.29 2.85 -1.24 -2.66 115.26 118.06 3g6j n ASN 1271Ca 0.06 -2.82 -0.40 0.00 -0.11 0.00 0.00 54.58 51.31 3g6j n ASN 1271Cb 0.48 0.13 -0.05 0.00 1.24 0.00 0.00 39.78 41.58 3g6j n ASN 1271CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3g6j s LEU 1272N -2.91 4.39 -0.86 1.20 1.43 -0.86 -4.73 118.68 116.35 3g6j s LEU 1272Ca 0.28 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 3g6j s LEU 1272Cb 0.40 -3.15 0.21 0.00 0.03 0.00 0.00 46.19 43.69 3g6j s LEU 1272CO -0.03 -0.04 0.74 0.47 0.23 0.00 0.00 176.35 177.72 3g6j n ASP 1273N 3.25 3.98 -4.66 2.29 9.92 -1.23 -0.97 116.55 129.14 3g6j n ASP 1273Ca -0.02 -3.17 -0.43 0.00 -0.53 0.00 0.00 54.79 50.65 3g6j n ASP 1273Cb 0.51 -0.98 -0.02 0.00 -0.64 0.00 0.00 41.12 39.98 3g6j n ASP 1273CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3g6j s VAL 1274N -1.47 4.44 -0.13 2.53 1.01 -0.97 -3.99 120.40 121.81 3g6j s VAL 1274Ca 0.28 1.73 -0.07 0.00 0.00 0.00 0.00 61.98 63.92 3g6j s VAL 1274Cb -0.05 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 3g6j s VAL 1274CO -0.13 -0.16 0.11 -0.44 0.00 0.00 0.00 175.10 174.49 3g6j s SER 1275N 1.68 6.13 0.01 3.32 0.01 -0.93 -0.93 113.70 122.99 3g6j s SER 1275Ca 0.51 0.35 0.02 0.00 1.31 0.00 0.00 55.95 58.14 3g6j s SER 1275Cb -0.19 -1.98 -0.01 0.00 0.21 0.00 0.00 66.02 64.05 3g6j s SER 1275CO 0.11 0.34 -0.08 -0.76 0.41 0.00 0.00 173.24 173.27 3g6j s LEU 1276N -0.64 2.06 -0.20 2.44 1.02 -1.19 -1.11 118.68 121.07 3g6j s LEU 1276Ca 0.12 -0.21 -0.17 0.00 0.02 0.00 0.00 54.13 53.89 3g6j s LEU 1276Cb -0.12 -0.34 0.05 0.00 0.02 0.00 0.00 46.19 45.80 3g6j s LEU 1276CO 0.02 0.04 0.53 -1.58 0.02 0.00 0.00 176.35 175.38 3g6j s GLN 1277N -0.45 0.60 0.29 1.70 0.74 -1.22 0.06 119.66 121.38 3g6j s GLN 1277Ca 0.01 0.78 0.09 0.00 0.05 0.00 0.00 55.36 56.29 3g6j s GLN 1277Cb -0.04 0.26 -0.04 0.00 1.10 0.00 0.00 33.01 34.28 3g6j s GLN 1277CO -0.00 -0.09 0.06 -0.51 -0.55 0.00 0.00 175.29 174.20 3g6j s LEU 1278N 0.50 3.24 0.36 3.68 1.02 -1.26 -3.39 118.68 122.84 3g6j s LEU 1278Ca -0.02 -0.68 0.13 0.00 0.02 0.00 0.00 54.13 53.58 3g6j s LEU 1278Cb -0.04 -1.74 0.70 0.00 0.02 0.00 0.00 46.19 45.12 3g6j s LEU 1278CO -0.02 -0.11 1.81 -0.65 0.02 0.00 0.00 176.35 177.39 3g6j h PRO 1279N 1.75 0.00 -0.07 1.29 0.11 -1.99 -3.00 132.00 130.09 3g6j h PRO 1279Ca -0.44 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.60 3g6j h PRO 1279Cb 1.25 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3g6j h PRO 1279CO 0.62 0.39 -0.29 1.03 -0.21 0.00 0.00 178.00 179.54 3g6j h SER 1280N 0.00 0.12 -1.72 -2.05 0.87 -1.96 -3.44 113.55 105.38 3g6j h SER 1280Ca -0.00 -0.03 -0.44 0.00 -1.23 0.00 0.00 61.79 60.08 3g6j h SER 1280Cb 0.71 -0.03 0.01 0.00 -0.44 0.00 0.00 62.40 62.64 3g6j h SER 1280CO 0.05 0.41 -0.33 -0.60 -0.53 0.00 0.00 176.83 175.83 3g6j s ARG 1281N -4.39 3.04 -0.11 2.24 3.52 -1.13 -5.09 118.95 117.02 3g6j s ARG 1281Ca -0.04 -1.08 -0.12 0.00 -0.13 0.00 0.00 55.73 54.36 3g6j s ARG 1281Cb 0.15 -2.79 -0.04 0.00 -1.56 0.00 0.00 34.95 30.70 3g6j s ARG 1281CO 0.73 -0.01 -0.23 0.43 -0.81 0.00 0.00 175.30 175.41 3g6j n SER 1282N -1.68 1.38 -4.34 -2.12 7.64 -1.26 -4.64 113.62 108.61 3g6j n SER 1282Ca 0.02 0.23 -0.29 0.00 1.01 0.00 0.00 58.87 59.83 3g6j n SER 1282Cb 0.58 -0.63 0.18 0.00 -1.01 0.00 0.00 64.21 63.33 3g6j n SER 1282CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3g6j s SER 1283N -5.48 2.65 0.80 6.43 0.01 -1.26 -4.96 113.70 111.89 3g6j s SER 1283Ca -0.19 0.69 -0.11 0.00 1.31 0.00 0.00 55.95 57.65 3g6j s SER 1283Cb 0.03 -1.04 0.07 0.00 0.21 0.00 0.00 66.02 65.29 3g6j s SER 1283CO 0.28 -3.06 1.09 -0.54 0.41 0.00 0.00 173.24 171.42 3g6j s LYS 1284N -5.47 2.04 -0.49 12.44 1.02 -1.26 -4.75 119.74 123.27 3g6j s LYS 1284Ca 0.68 0.88 0.08 0.00 0.02 0.00 0.00 55.97 57.63 3g6j s LYS 1284Cb -0.11 -1.89 0.27 0.00 -0.52 0.00 0.00 37.83 35.58 3g6j s LYS 1284CO 0.54 -1.71 0.67 -0.89 -0.92 0.00 0.00 175.35 173.04 3g6j n ILE 1285N -3.53 0.78 -2.68 2.17 2.08 0.11 -4.99 119.36 113.29 3g6j n ILE 1285Ca 0.08 -4.65 -0.42 0.00 0.56 0.00 0.00 62.75 58.31 3g6j n ILE 1285Cb 0.55 -1.72 -0.03 0.00 -0.75 0.00 0.00 39.64 37.68 3g6j n ILE 1285CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 3g6j s THR 1286N -2.12 4.02 0.40 1.39 2.01 -1.26 -3.15 115.64 116.93 3g6j s THR 1286Ca 0.39 0.23 -0.24 0.00 0.31 0.00 0.00 61.69 62.38 3g6j s THR 1286Cb 0.20 -4.78 -0.09 0.00 0.01 0.00 0.00 72.50 67.84 3g6j s THR 1286CO -0.08 -1.58 1.04 -1.00 -0.69 0.00 0.00 174.62 172.31 3g6j s HIS 1287N 4.91 3.28 -0.41 4.92 3.76 -0.11 -4.93 115.29 126.71 3g6j s HIS 1287Ca 0.32 1.65 -0.04 0.00 -0.15 0.00 0.00 55.06 56.83 3g6j s HIS 1287Cb -0.11 -3.10 0.11 0.00 1.11 0.00 0.00 32.58 30.59 3g6j s HIS 1287CO 0.15 -0.57 0.21 1.03 -0.85 0.00 0.00 174.74 174.72 3g6j s ARG 1288N -2.54 2.07 -0.51 1.40 0.52 -1.26 -2.29 118.95 116.34 3g6j s ARG 1288Ca 0.58 -1.79 -0.19 0.00 -0.52 0.00 0.00 55.73 53.82 3g6j s ARG 1288Cb -0.21 -3.61 0.06 0.00 0.52 0.00 0.00 34.95 31.72 3g6j s ARG 1288CO 0.26 -1.07 0.61 0.42 0.02 0.00 0.00 175.30 175.55 3g6j s ILE 1289N 1.17 4.90 0.17 1.52 1.01 -0.15 -5.02 121.20 124.80 3g6j s ILE 1289Ca 0.07 -0.59 0.07 0.00 0.00 0.00 0.00 60.65 60.20 3g6j s ILE 1289Cb -0.23 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 37.90 3g6j s ILE 1289CO -0.04 -0.82 -0.00 -1.00 0.00 0.00 0.00 174.94 173.08 3g6j s HIS 1290N 2.55 2.85 -0.15 3.97 3.76 -1.26 -2.02 115.29 124.98 3g6j s HIS 1290Ca 0.14 -0.13 -0.28 0.00 -0.15 0.00 0.00 55.06 54.64 3g6j s HIS 1290Cb -0.20 -1.39 -0.01 0.00 1.11 0.00 0.00 32.58 32.09 3g6j s HIS 1290CO 0.11 0.51 0.94 -0.46 -0.85 0.00 0.00 174.74 174.99 3g6j s TRP 1291N -1.69 3.44 0.00 1.40 -0.11 -1.09 -3.86 118.94 117.03 3g6j s TRP 1291Ca 0.27 1.44 0.00 0.00 1.22 0.00 0.00 56.10 59.03 3g6j s TRP 1291Cb -0.09 -3.13 0.00 0.00 -1.50 0.00 0.00 33.47 28.74 3g6j s TRP 1291CO 0.18 -0.28 0.00 0.39 -4.62 0.00 0.00 176.95 172.63 3g6j n GLU 1292N 5.34 0.00 -2.07 5.86 1.02 -1.26 -4.92 120.64 124.61 3g6j n GLU 1292Ca 0.08 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.81 3g6j n GLU 1292Cb 0.48 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.87 3g6j n GLU 1292CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3g6j s SER 1293N 0.00 5.69 0.53 1.62 1.04 -1.25 -4.89 113.70 116.44 3g6j s SER 1293Ca 0.00 0.80 0.28 0.00 0.48 0.00 0.00 55.95 57.51 3g6j s SER 1293Cb 0.00 -2.53 1.47 0.00 0.10 0.00 0.00 66.02 65.06 3g6j s SER 1293CO 0.00 -1.96 2.07 0.00 0.98 0.00 0.00 173.24 174.33 3g6j h ALA 1294N 13.44 1.27 0.67 5.32 0.00 -1.97 -3.24 119.26 134.75 3g6j h ALA 1294Ca -0.29 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.48 3g6j h ALA 1294Cb 1.16 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.93 3g6j h ALA 1294CO 1.12 0.14 -0.32 0.66 0.00 0.00 0.00 179.25 180.85 3g6j h SER 1295N 0.00 -0.76 -5.70 0.00 4.64 -1.95 -3.48 113.55 106.30 3g6j h SER 1295Ca -0.00 0.03 -0.34 0.00 -0.47 0.00 0.00 61.79 61.01 3g6j h SER 1295Cb 0.33 0.20 0.16 0.00 -0.31 0.00 0.00 62.40 62.77 3g6j h SER 1295CO 0.01 -0.49 -0.78 0.18 -0.87 0.00 0.00 176.83 174.88 3g6j n LEU 1296N -4.71 -3.99 -3.64 5.97 4.77 -1.23 -4.81 117.00 109.36 3g6j n LEU 1296Ca -0.11 -0.65 -0.05 0.00 -0.03 0.00 0.00 56.01 55.16 3g6j n LEU 1296Cb 0.35 -3.07 -0.07 0.00 -2.33 0.00 0.00 43.42 38.31 3g6j n LEU 1296CO 0.27 0.37 0.41 -0.22 -1.33 0.00 0.00 177.39 176.89 3g6j s LEU 1297N -6.36 -0.88 0.24 2.23 0.20 -1.24 -0.68 118.68 112.19 3g6j s LEU 1297Ca 0.02 1.37 0.00 0.00 0.69 0.00 0.00 54.13 56.22 3g6j s LEU 1297Cb -0.00 2.24 -0.05 0.00 -0.43 0.00 0.00 46.19 47.95 3g6j s LEU 1297CO 0.74 -0.21 0.12 -0.13 -0.29 0.00 0.00 176.35 176.58 3g6j s ARG 1298N 1.72 1.33 0.01 1.98 3.00 -0.46 -4.96 118.95 121.57 3g6j s ARG 1298Ca -0.09 -1.72 -0.00 0.00 0.00 0.00 0.00 55.73 53.92 3g6j s ARG 1298Cb -0.05 -0.01 -0.01 0.00 0.00 0.00 0.00 34.95 34.87 3g6j s ARG 1298CO -0.19 -0.35 -0.01 0.45 0.00 0.00 0.00 175.30 175.20 3g6j s SER 1299N -3.25 0.15 -0.20 0.23 0.15 -1.26 -1.17 113.70 108.35 3g6j s SER 1299Ca 0.38 -0.31 -0.04 0.00 0.70 0.00 0.00 55.95 56.68 3g6j s SER 1299Cb 0.07 0.07 0.07 0.00 -1.71 0.00 0.00 66.02 64.52 3g6j s SER 1299CO 0.13 -0.20 0.07 -1.61 1.20 0.00 0.00 173.24 172.84 3g6j s GLU 1300N -0.95 0.37 -0.46 5.44 0.41 -1.20 -4.98 118.70 117.33 3g6j s GLU 1300Ca -0.10 -0.33 -0.18 0.00 -0.41 0.00 0.00 54.97 53.94 3g6j s GLU 1300Cb -0.06 -1.90 0.04 0.00 -1.78 0.00 0.00 34.13 30.42 3g6j s GLU 1300CO -0.01 -0.71 0.53 -1.21 -0.49 0.00 0.00 175.26 173.37 3g6j s GLU 1301N 1.98 3.12 -0.15 1.61 8.01 -1.26 -2.23 118.70 129.79 3g6j s GLU 1301Ca 0.02 -0.78 -0.17 0.00 0.01 0.00 0.00 54.97 54.05 3g6j s GLU 1301Cb -0.17 -4.02 -0.04 0.00 -4.31 0.00 0.00 34.13 25.59 3g6j s GLU 1301CO -0.12 -1.01 0.43 0.99 0.01 0.00 0.00 175.26 175.56 3g6j s THR 1302N 2.37 5.21 0.15 3.63 2.01 -0.78 -4.98 115.64 123.24 3g6j s THR 1302Ca 0.14 0.83 -0.12 0.00 0.31 0.00 0.00 61.69 62.85 3g6j s THR 1302Cb -0.18 -3.77 0.01 0.00 0.01 0.00 0.00 72.50 68.58 3g6j s THR 1302CO 0.13 0.31 1.59 0.11 -0.69 0.00 0.00 174.62 176.08 3g6j h LYS 1303N 6.89 0.87 -5.92 4.92 1.79 -1.87 -1.38 116.57 121.86 3g6j h LYS 1303Ca -0.40 -0.28 -0.64 0.00 -2.18 0.00 0.00 60.65 57.15 3g6j h LYS 1303Cb 1.17 -0.07 -0.07 0.00 -1.58 0.00 0.00 32.23 31.68 3g6j h LYS 1303CO 0.75 0.91 -0.53 -2.00 -1.08 0.00 0.00 179.45 177.51 3g6j s GLU 1304N -4.98 3.27 -0.64 3.15 2.12 -1.26 -4.24 118.70 116.12 3g6j s GLU 1304Ca -0.12 -0.43 -0.28 0.00 0.36 0.00 0.00 54.97 54.50 3g6j s GLU 1304Cb 0.11 -2.98 0.03 0.00 0.26 0.00 0.00 34.13 31.55 3g6j s GLU 1304CO 0.82 0.64 1.29 1.21 -0.54 0.00 0.00 175.26 178.68 3g6j s ASN 1305N -2.06 6.24 0.20 -1.70 2.47 -1.26 -4.61 114.94 114.23 3g6j s ASN 1305Ca 0.28 -0.08 0.05 0.00 0.42 0.00 0.00 52.86 53.54 3g6j s ASN 1305Cb -0.12 -2.55 -0.05 0.00 -1.45 0.00 0.00 41.25 37.07 3g6j s ASN 1305CO 0.20 -1.69 -0.08 -1.61 -3.72 0.00 0.00 177.10 170.20 3g6j s GLU 1306N 5.42 1.27 0.03 0.43 0.41 -1.26 -4.94 118.70 120.05 3g6j s GLU 1306Ca 0.42 -1.59 -0.15 0.00 -0.41 0.00 0.00 54.97 53.25 3g6j s GLU 1306Cb -0.08 -0.83 -0.06 0.00 -1.78 0.00 0.00 34.13 31.38 3g6j s GLU 1306CO 0.21 0.06 0.43 0.20 -0.49 0.00 0.00 175.26 175.67 3g6j s GLY 1307N -3.28 2.48 0.07 -1.39 0.00 -1.26 -4.33 107.32 99.61 3g6j s GLY 1307Ca 0.23 -0.21 -0.12 0.00 0.00 0.00 0.00 44.72 44.62 3g6j s GLY 1307CO 0.06 0.14 0.27 -0.11 0.00 0.00 0.00 173.10 173.46 3g6j s PHE 1308N -1.14 -0.03 0.02 1.90 -0.12 -1.14 -4.38 117.98 113.09 3g6j s PHE 1308Ca 0.26 -0.23 -0.07 0.00 -0.05 0.00 0.00 56.93 56.84 3g6j s PHE 1308Cb -0.17 0.06 -0.05 0.00 -0.63 0.00 0.00 43.02 42.24 3g6j s PHE 1308CO 0.15 -0.54 0.29 0.99 -0.05 0.00 0.00 175.22 176.06 3g6j s THR 1309N -3.11 5.27 -0.43 -4.49 2.01 -1.22 -1.92 115.64 111.75 3g6j s THR 1309Ca -0.01 0.18 0.02 0.00 0.31 0.00 0.00 61.69 62.19 3g6j s THR 1309Cb 0.01 -3.58 0.14 0.00 0.01 0.00 0.00 72.50 69.08 3g6j s THR 1309CO -0.07 0.34 0.26 -0.69 -0.69 0.00 0.00 174.62 173.77 3g6j s VAL 1310N -1.33 1.08 0.59 3.82 1.01 -0.31 -3.42 120.40 121.83 3g6j s VAL 1310Ca 0.29 -2.48 -0.16 0.00 0.00 0.00 0.00 61.98 59.62 3g6j s VAL 1310Cb -0.13 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 3g6j s VAL 1310CO 0.17 -0.97 1.06 -0.89 0.00 0.00 0.00 175.10 174.48 3g6j s THR 1311N 0.36 3.75 -0.09 3.92 2.01 -0.26 -2.81 115.64 122.51 3g6j s THR 1311Ca 0.20 0.86 -0.04 0.00 0.31 0.00 0.00 61.69 63.02 3g6j s THR 1311Cb -0.19 -3.37 0.04 0.00 0.01 0.00 0.00 72.50 69.00 3g6j s THR 1311CO -0.03 -0.46 0.21 0.00 -0.69 0.00 0.00 174.62 173.65 3g6j s ALA 1312N -2.38 -0.45 -0.26 7.40 0.00 -1.12 -2.18 121.76 122.78 3g6j s ALA 1312Ca 0.64 0.88 0.01 0.00 0.00 0.00 0.00 51.96 53.50 3g6j s ALA 1312Cb -0.17 -0.60 0.07 0.00 0.00 0.00 0.00 23.12 22.42 3g6j s ALA 1312CO 0.35 -0.22 -0.04 -2.00 0.00 0.00 0.00 175.76 173.85 3g6j s GLU 1313N 1.32 1.68 0.25 0.00 2.12 -1.26 -2.00 118.70 120.81 3g6j s GLU 1313Ca -0.08 -1.16 0.00 0.00 0.36 0.00 0.00 54.97 54.09 3g6j s GLU 1313Cb -0.11 -2.68 0.00 0.00 0.26 0.00 0.00 34.13 31.60 3g6j s GLU 1313CO -0.08 -0.65 0.00 0.41 -0.54 0.00 0.00 175.26 174.40 3g6j n GLY 1314N 4.59 -4.17 1.10 -1.50 0.00 -1.26 -3.48 105.19 100.47 3g6j n GLY 1314Ca -0.10 -0.75 0.09 0.00 0.00 0.00 0.00 46.02 45.25 3g6j n GLY 1314CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3g6j n LYS 1315N -0.30 -2.67 -0.79 1.61 4.01 -1.26 -3.76 118.16 115.00 3g6j n LYS 1315Ca 0.00 2.15 0.10 0.00 -0.51 0.00 0.00 58.31 60.05 3g6j n LYS 1315Cb 0.00 -2.92 -0.04 0.00 -0.51 0.00 0.00 35.03 31.57 3g6j n LYS 1315CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3g6j n GLY 1316N -3.26 -2.19 3.09 0.72 0.00 -1.22 -4.51 105.19 97.82 3g6j n GLY 1316Ca -0.05 -1.29 -0.08 0.00 0.00 0.00 0.00 46.02 44.60 3g6j n GLY 1316CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3g6j s GLN 1317N -2.48 0.57 0.00 1.61 0.74 -1.26 -4.61 119.66 114.23 3g6j s GLN 1317Ca 0.00 -0.90 0.00 0.00 0.05 0.00 0.00 55.36 54.51 3g6j s GLN 1317Cb 0.00 0.21 0.00 0.00 1.10 0.00 0.00 33.01 34.32 3g6j s GLN 1317CO 0.00 -0.13 0.00 0.41 -0.55 0.00 0.00 175.29 175.02 3g6j n GLY 1318N 0.63 3.96 3.28 2.59 0.00 -1.23 -3.68 105.19 110.75 3g6j n GLY 1318Ca -0.18 -0.24 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 3g6j n GLY 1318CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3g6j s THR 1319N 0.38 -0.01 -0.32 2.61 2.01 -1.26 -4.51 115.64 114.54 3g6j s THR 1319Ca 0.00 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.08 3g6j s THR 1319Cb 0.00 -0.59 0.09 0.00 0.01 0.00 0.00 72.50 72.01 3g6j s THR 1319CO 0.00 0.02 0.02 -0.22 -0.69 0.00 0.00 174.62 173.75 3g6j s LEU 1320N 0.81 4.12 -0.23 4.42 2.96 -1.24 -1.09 118.68 128.43 3g6j s LEU 1320Ca -0.05 -1.91 -0.05 0.00 -0.22 0.00 0.00 54.13 51.91 3g6j s LEU 1320Cb -0.06 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.12 3g6j s LEU 1320CO -0.06 -0.34 -0.00 -0.94 -1.32 0.00 0.00 176.35 173.68 3g6j s SER 1321N 1.05 4.59 -0.23 3.68 1.04 -0.96 -2.75 113.70 120.12 3g6j s SER 1321Ca 0.06 -0.32 -0.15 0.00 0.48 0.00 0.00 55.95 56.02 3g6j s SER 1321Cb -0.19 -1.80 -0.04 0.00 0.10 0.00 0.00 66.02 64.09 3g6j s SER 1321CO -0.09 -0.02 0.37 -0.69 0.98 0.00 0.00 173.24 173.78 3g6j s VAL 1322N 1.51 5.20 -0.24 5.02 1.01 -1.06 -2.24 120.40 129.60 3g6j s VAL 1322Ca 0.06 0.61 -0.04 0.00 0.00 0.00 0.00 61.98 62.61 3g6j s VAL 1322Cb -0.15 -3.70 0.08 0.00 0.00 0.00 0.00 36.38 32.62 3g6j s VAL 1322CO -0.01 0.23 0.10 -0.69 0.00 0.00 0.00 175.10 174.73 3g6j s VAL 1323N 1.57 0.08 0.96 2.92 1.01 -1.14 -3.68 120.40 122.11 3g6j s VAL 1323Ca 0.17 -0.59 -0.16 0.00 0.00 0.00 0.00 61.98 61.40 3g6j s VAL 1323Cb -0.15 -0.91 0.22 0.00 0.00 0.00 0.00 36.38 35.55 3g6j s VAL 1323CO 0.08 -0.51 1.31 0.35 0.00 0.00 0.00 175.10 176.33 3g6j n THR 1324N 5.20 0.00 -3.44 3.92 -2.24 -1.12 -3.77 114.28 112.83 3g6j n THR 1324Ca -0.06 -0.99 -0.07 0.00 -2.27 0.00 0.00 64.05 60.66 3g6j n THR 1324Cb 0.45 -1.50 -0.08 0.00 -2.10 0.00 0.00 70.33 67.11 3g6j n THR 1324CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 3g6j s MET 1325N -5.86 0.37 0.28 -0.78 1.75 -0.94 -3.92 119.30 110.20 3g6j s MET 1325Ca 0.74 0.79 0.03 0.00 -1.25 0.00 0.00 55.69 56.01 3g6j s MET 1325Cb -0.02 -0.04 -0.01 0.00 2.84 0.00 0.00 34.83 37.60 3g6j s MET 1325CO 0.52 -0.49 0.12 2.48 -0.65 0.00 0.00 175.02 177.00 3g6j n TYR 1326N 5.38 -0.02 -3.99 4.11 0.18 -1.25 -2.85 117.16 118.72 3g6j n TYR 1326Ca -0.05 -1.90 -0.32 0.00 1.88 0.00 0.00 57.90 57.51 3g6j n TYR 1326Cb 0.50 0.03 -0.14 0.00 -0.38 0.00 0.00 39.34 39.35 3g6j n TYR 1326CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 3g6j s HIS 1327N -2.70 3.63 0.55 -3.48 3.76 -1.26 -3.02 115.29 112.77 3g6j s HIS 1327Ca 0.17 -2.75 -0.09 0.00 -0.15 0.00 0.00 55.06 52.24 3g6j s HIS 1327Cb 0.01 -2.75 -0.04 0.00 1.11 0.00 0.00 32.58 30.90 3g6j s HIS 1327CO 0.12 -0.93 0.92 0.00 -0.85 0.00 0.00 174.74 174.00 3g6j s ALA 1328N 0.99 3.22 1.08 -1.40 0.00 -1.19 -0.61 121.76 123.85 3g6j s ALA 1328Ca 0.06 -0.22 -0.12 0.00 0.00 0.00 0.00 51.96 51.68 3g6j s ALA 1328Cb -0.20 -2.89 0.24 0.00 0.00 0.00 0.00 23.12 20.27 3g6j s ALA 1328CO -0.07 -0.49 1.06 0.15 0.00 0.00 0.00 175.76 176.42 3g6j s LYS 1329N -4.85 -0.27 0.00 0.00 1.02 -1.25 -2.62 119.74 111.76 3g6j s LYS 1329Ca 0.52 0.99 0.29 0.00 0.02 0.00 0.00 55.97 57.79 3g6j s LYS 1329Cb -0.11 -1.62 1.28 0.00 -0.52 0.00 0.00 37.83 36.86 3g6j s LYS 1329CO 0.48 -3.33 1.89 0.00 -0.92 0.00 0.00 175.35 173.46 3g6j n ALA 1330N -4.66 2.73 -1.30 5.17 0.00 -1.26 -4.71 120.51 116.48 3g6j n ALA 1330Ca 0.05 -0.26 0.17 0.00 0.00 0.00 0.00 53.44 53.40 3g6j n ALA 1330Cb 0.54 -1.35 -0.06 0.00 0.00 0.00 0.00 19.45 18.58 3g6j n ALA 1330CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3g6j n LYS 1331N -0.92 -2.80 -2.02 0.00 5.02 -1.26 -4.31 118.16 111.86 3g6j n LYS 1331Ca 0.15 2.07 -0.41 0.00 -2.02 0.00 0.00 58.31 58.10 3g6j n LYS 1331Cb 0.27 -3.35 -0.00 0.00 -0.02 0.00 0.00 35.03 31.92 3g6j n LYS 1331CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3g6j n ASP 1332N -4.11 6.66 -2.95 4.39 9.92 -1.26 -4.49 116.55 124.71 3g6j n ASP 1332Ca -0.03 -3.04 0.00 0.00 -0.53 0.00 0.00 54.79 51.19 3g6j n ASP 1332Cb 0.61 -1.45 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 3g6j n ASP 1332CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 3g6j s GLN 1333N 0.16 0.55 0.00 -1.24 0.74 -1.26 -5.17 119.66 113.44 3g6j s GLN 1333Ca 0.50 -0.27 0.00 0.00 0.05 0.00 0.00 55.36 55.64 3g6j s GLN 1333Cb 0.15 0.04 0.00 0.00 1.10 0.00 0.00 33.01 34.30 3g6j s GLN 1333CO -0.05 -0.77 0.00 1.28 -0.55 0.00 0.00 175.29 175.20 3g6j n LEU 1334N 3.82 0.00 -2.76 3.68 4.77 -1.26 -4.92 117.00 120.32 3g6j n LEU 1334Ca 0.10 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.04 3g6j n LEU 1334Cb 0.60 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.73 3g6j n LEU 1334CO -0.05 0.00 -0.04 0.35 -1.33 0.00 0.00 177.39 176.31 3g6j n THR 1335N 0.00 1.13 -3.20 -5.08 -2.24 -1.26 -4.79 114.28 98.83 3g6j n THR 1335Ca 0.00 -2.94 -0.24 0.00 -2.27 0.00 0.00 64.05 58.59 3g6j n THR 1335Cb 0.00 1.03 -0.06 0.00 -2.10 0.00 0.00 70.33 69.21 3g6j n THR 1335CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3g6j h ASN 1337N 3.62 -1.03 0.64 0.00 -1.07 -1.86 -3.36 115.58 112.53 3g6j h ASN 1337Ca 0.13 0.09 -0.27 0.00 0.07 0.00 0.00 56.30 56.32 3g6j h ASN 1337Cb 0.74 0.34 -0.04 0.00 -2.07 0.00 0.00 38.32 37.29 3g6j h ASN 1337CO 0.67 -0.53 -1.49 0.11 0.07 0.00 0.00 177.43 176.26 3g6j h LYS 1338N -0.80 0.00 -6.11 4.14 1.79 -1.90 -3.44 116.57 110.25 3g6j h LYS 1338Ca -0.03 -0.01 -0.55 0.00 -2.18 0.00 0.00 60.65 57.88 3g6j h LYS 1338Cb 0.71 0.00 -0.19 0.00 -1.58 0.00 0.00 32.23 31.17 3g6j h LYS 1338CO -0.05 0.66 -0.80 -0.06 -1.08 0.00 0.00 179.45 178.11 3g6j s PHE 1339N -2.63 1.87 -0.04 -1.35 0.40 -1.26 -1.14 117.98 113.83 3g6j s PHE 1339Ca -0.03 -0.44 -0.01 0.00 -0.60 0.00 0.00 56.93 55.85 3g6j s PHE 1339Cb 0.09 -0.97 -0.04 0.00 0.51 0.00 0.00 43.02 42.61 3g6j s PHE 1339CO 0.82 0.30 0.05 -0.51 0.70 0.00 0.00 175.22 176.59 3g6j s ASP 1340N -2.38 5.55 -0.12 1.36 1.01 0.16 -4.83 116.67 117.42 3g6j s ASP 1340Ca 0.13 0.16 -0.07 0.00 0.71 0.00 0.00 52.55 53.48 3g6j s ASP 1340Cb -0.08 -1.59 0.04 0.00 1.01 0.00 0.00 42.92 42.30 3g6j s ASP 1340CO 0.06 0.32 0.29 -0.22 0.21 0.00 0.00 175.17 175.83 3g6j s LEU 1341N -1.37 0.45 -0.18 1.23 2.96 -1.26 -1.90 118.68 118.62 3g6j s LEU 1341Ca 0.19 0.60 -0.05 0.00 -0.22 0.00 0.00 54.13 54.65 3g6j s LEU 1341Cb -0.12 0.91 0.06 0.00 0.50 0.00 0.00 46.19 47.55 3g6j s LEU 1341CO 0.09 -0.15 0.10 -0.54 -1.32 0.00 0.00 176.35 174.52 3g6j s LYS 1342N 0.99 0.08 -0.24 1.98 1.02 0.86 -4.98 119.74 119.45 3g6j s LYS 1342Ca -0.07 -0.09 -0.05 0.00 0.02 0.00 0.00 55.97 55.78 3g6j s LYS 1342Cb -0.08 -1.75 -0.01 0.00 -0.52 0.00 0.00 37.83 35.47 3g6j s LYS 1342CO -0.07 -0.69 0.01 0.08 -0.92 0.00 0.00 175.35 173.76 3g6j s VAL 1343N 2.15 3.71 0.01 3.17 1.01 -1.26 -1.04 120.40 128.15 3g6j s VAL 1343Ca 0.03 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.57 3g6j s VAL 1343Cb -0.16 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 3g6j s VAL 1343CO -0.11 0.33 -0.01 -0.89 0.00 0.00 0.00 175.10 174.43 3g6j s THR 1344N 1.51 4.07 -0.11 3.92 2.01 0.55 -4.92 115.64 122.67 3g6j s THR 1344Ca 0.05 -0.68 -0.01 0.00 0.31 0.00 0.00 61.69 61.37 3g6j s THR 1344Cb -0.15 -2.83 0.03 0.00 0.01 0.00 0.00 72.50 69.56 3g6j s THR 1344CO -0.00 0.34 -0.06 -0.51 -0.69 0.00 0.00 174.62 173.70 3g6j s ILE 1345N -1.11 0.91 0.29 1.82 1.10 -1.26 -0.72 121.20 122.24 3g6j s ILE 1345Ca 0.20 -0.22 0.07 0.00 -0.51 0.00 0.00 60.65 60.19 3g6j s ILE 1345Cb -0.11 -0.96 -0.06 0.00 0.15 0.00 0.00 42.46 41.48 3g6j s ILE 1345CO 0.11 0.34 -0.05 -0.54 -2.11 0.00 0.00 174.94 172.69 3g6j s LYS 1346N 1.75 1.60 0.96 3.50 3.01 -0.97 -4.90 119.74 124.70 3g6j s LYS 1346Ca 0.05 -1.82 -0.16 0.00 -1.01 0.00 0.00 55.97 53.03 3g6j s LYS 1346Cb -0.13 -1.20 0.23 0.00 -1.01 0.00 0.00 37.83 35.72 3g6j s LYS 1346CO -0.08 0.03 1.05 -2.30 0.51 0.00 0.00 175.35 174.56 3g6j n PRO 1347N -0.63 -1.98 -1.56 -1.68 -0.02 -1.26 -1.30 135.00 126.58 3g6j n PRO 1347Ca -0.05 -1.65 -0.29 0.00 -2.02 0.00 0.00 63.50 59.49 3g6j n PRO 1347Cb 0.64 -1.30 0.13 0.00 -0.02 0.00 0.00 33.50 32.94 3g6j n PRO 1347CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3g6j s ALA 1348N -3.50 1.86 0.38 3.55 0.00 -1.21 -4.28 121.76 118.56 3g6j s ALA 1348Ca 0.64 -0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.09 3g6j s ALA 1348Cb -0.04 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.05 3g6j s ALA 1348CO 0.47 -2.20 0.00 -0.35 0.00 0.00 0.00 175.76 173.67 3g6j n PRO 1349N -3.71 2.68 -0.35 0.00 -0.04 -1.26 -4.87 135.00 127.45 3g6j n PRO 1349Ca 0.07 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.46 3g6j n PRO 1349Cb 0.59 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 34.00 3g6j n PRO 1349CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3g6j n GLU 1350N 0.00 0.00 -0.77 0.54 2.13 -1.26 -5.18 120.64 116.10 3g6j n GLU 1350Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3g6j n GLU 1350Cb 0.00 -0.27 0.00 0.00 0.27 0.00 0.00 31.44 31.44 3g6j n GLU 1350CO 0.00 0.00 0.00 2.41 -0.41 0.00 0.00 177.13 179.13 3g6j n THR 1351N 1.42 0.00 0.00 6.31 -1.04 -1.26 -5.26 114.28 114.45 3g6j n THR 1351Ca 0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.17 3g6j n THR 1351Cb 0.03 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.72 3g6j n THR 1351CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 3g6j n LYS 1359N -0.53 0.00 0.00 -2.82 2.85 -1.26 -5.26 118.16 111.14 3g6j n LYS 1359Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3g6j n LYS 1359Cb 0.00 -1.26 0.00 0.00 -0.65 0.00 0.00 35.03 33.12 3g6j n LYS 1359CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 3g6j n ASN 1360N 0.00 0.00 -4.56 -5.58 4.05 -1.26 -4.19 115.26 103.71 3g6j n ASN 1360Ca 0.00 0.00 -0.25 0.00 0.45 0.00 0.00 54.58 54.78 3g6j n ASN 1360Cb 0.00 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 40.91 3g6j n ASN 1360CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 3g6j s THR 1361N 0.00 2.42 0.18 -0.44 -4.23 -1.26 -1.46 115.64 110.85 3g6j s THR 1361Ca 0.00 -2.16 -0.07 0.00 -1.18 0.00 0.00 61.69 58.28 3g6j s THR 1361Cb 0.00 -2.65 -0.02 0.00 1.34 0.00 0.00 72.50 71.18 3g6j s THR 1361CO 0.00 -0.23 0.25 -0.04 -0.54 0.00 0.00 174.62 174.06 3g6j s MET 1362N -3.63 1.19 -0.27 3.99 -1.94 0.06 -3.33 119.30 115.37 3g6j s MET 1362Ca 0.33 -1.30 -0.01 0.00 -1.71 0.00 0.00 55.69 53.00 3g6j s MET 1362Cb 0.00 0.35 0.04 0.00 2.01 0.00 0.00 34.83 37.24 3g6j s MET 1362CO 0.17 -0.42 -0.05 0.42 -0.01 0.00 0.00 175.02 175.12 3g6j s ILE 1363N -4.02 2.72 -0.13 2.53 -1.09 -0.42 -0.45 121.20 120.35 3g6j s ILE 1363Ca 0.23 -1.30 -0.21 0.00 -2.23 0.00 0.00 60.65 57.13 3g6j s ILE 1363Cb 0.04 -2.49 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 3g6j s ILE 1363CO 0.04 0.04 0.60 -0.22 -1.23 0.00 0.00 174.94 174.17 3g6j s LEU 1364N 1.24 4.25 -0.15 2.97 2.96 -0.80 -2.29 118.68 126.87 3g6j s LEU 1364Ca -0.04 0.95 0.01 0.00 -0.22 0.00 0.00 54.13 54.83 3g6j s LEU 1364Cb -0.18 -2.89 0.02 0.00 0.50 0.00 0.00 46.19 43.63 3g6j s LEU 1364CO -0.04 -0.13 -0.18 -0.70 -1.32 0.00 0.00 176.35 173.99 3g6j s GLU 1365N 1.09 2.62 -0.19 1.98 2.12 0.11 -2.28 118.70 124.15 3g6j s GLU 1365Ca 0.31 -0.69 -0.03 0.00 0.36 0.00 0.00 54.97 54.91 3g6j s GLU 1365Cb -0.16 -2.27 -0.02 0.00 0.26 0.00 0.00 34.13 31.94 3g6j s GLU 1365CO 0.13 -0.16 -0.05 0.42 -0.54 0.00 0.00 175.26 175.06 3g6j s ILE 1366N 1.22 3.49 -0.12 -3.70 1.01 -0.40 -0.33 121.20 122.36 3g6j s ILE 1366Ca 0.01 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.18 3g6j s ILE 1366Cb -0.14 -2.55 0.02 0.00 0.01 0.00 0.00 42.46 39.80 3g6j s ILE 1366CO -0.08 0.46 -0.10 0.00 0.00 0.00 0.00 174.94 175.21 3g6j s THR 1368N 1.61 0.43 0.25 0.00 -1.32 0.20 -0.10 115.64 116.71 3g6j s THR 1368Ca 0.05 -1.22 -0.21 0.00 -1.21 0.00 0.00 61.69 59.09 3g6j s THR 1368Cb -0.13 -0.75 0.04 0.00 -1.51 0.00 0.00 72.50 70.15 3g6j s THR 1368CO -0.09 -0.53 0.83 -0.13 -2.21 0.00 0.00 174.62 172.48 3g6j s ARG 1369N -2.07 1.65 -0.27 7.08 0.52 -0.80 -0.40 118.95 124.67 3g6j s ARG 1369Ca -0.07 -0.95 -0.06 0.00 -0.52 0.00 0.00 55.73 54.13 3g6j s ARG 1369Cb -0.06 0.54 0.00 0.00 0.52 0.00 0.00 34.95 35.94 3g6j s ARG 1369CO -0.02 -0.76 0.05 -0.47 0.02 0.00 0.00 175.30 174.12 3g6j s TYR 1370N -3.35 3.10 0.37 -0.53 5.04 0.65 0.37 117.35 122.98 3g6j s TYR 1370Ca 0.13 -0.91 -0.28 0.00 -2.44 0.00 0.00 57.07 53.56 3g6j s TYR 1370Cb -0.04 -2.21 -0.11 0.00 0.35 0.00 0.00 41.96 39.95 3g6j s TYR 1370CO 0.06 -0.54 1.50 1.03 -1.34 0.00 0.00 175.55 176.26 3g6j s ARG 1371N 1.50 4.11 0.00 4.97 0.52 -0.29 -3.77 118.95 126.00 3g6j s ARG 1371Ca 0.04 2.58 0.00 0.00 -0.52 0.00 0.00 55.73 57.82 3g6j s ARG 1371Cb -0.16 -2.97 0.00 0.00 0.52 0.00 0.00 34.95 32.33 3g6j s ARG 1371CO 0.01 -0.55 0.00 0.41 0.02 0.00 0.00 175.30 175.19 3g6j n GLY 1372N 0.70 -1.89 3.22 -3.53 0.00 -1.26 -4.90 105.19 97.52 3g6j n GLY 1372Ca 0.02 -0.59 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 3g6j n GLY 1372CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3g6j n ASP 1373N 0.00 4.09 -3.65 1.61 4.64 -1.26 -4.69 116.55 117.29 3g6j n ASP 1373Ca 0.00 -2.84 -0.07 0.00 -1.38 0.00 0.00 54.79 50.50 3g6j n ASP 1373Cb 0.00 -1.65 -0.08 0.00 -1.04 0.00 0.00 41.12 38.35 3g6j n ASP 1373CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3g6j s GLN 1374N 4.17 0.38 -0.17 -0.67 0.00 -1.26 -4.90 119.66 117.20 3g6j s GLN 1374Ca 0.53 1.11 -0.39 0.00 -0.00 0.00 0.00 55.36 56.61 3g6j s GLN 1374Cb 0.08 0.43 -0.18 0.00 0.00 0.00 0.00 33.01 33.34 3g6j s GLN 1374CO 0.03 -0.25 1.17 -0.25 0.00 0.00 0.00 175.29 175.99 3g6j n ASP 1375N 5.40 0.42 -4.77 12.60 9.92 -1.26 -4.85 116.55 134.01 3g6j n ASP 1375Ca -0.09 1.08 -0.36 0.00 -0.53 0.00 0.00 54.79 54.89 3g6j n ASP 1375Cb 0.49 -0.84 0.01 0.00 -0.64 0.00 0.00 41.12 40.15 3g6j n ASP 1375CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3g6j s ALA 1376N 1.04 2.70 0.00 2.24 0.00 0.14 -4.88 121.76 123.01 3g6j s ALA 1376Ca 0.89 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.77 3g6j s ALA 1376Cb -1.25 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 18.47 3g6j s ALA 1376CO 0.61 -0.89 0.00 0.25 0.00 0.00 0.00 175.76 175.74 3g6j n THR 1377N -1.23 0.00 -2.36 0.00 -2.24 -1.26 -2.91 114.28 104.28 3g6j n THR 1377Ca 0.11 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.47 3g6j n THR 1377Cb 0.50 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.70 3g6j n THR 1377CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 3g6j s MET 1378N 0.00 4.33 0.33 -0.78 1.75 -1.21 -3.79 119.30 119.93 3g6j s MET 1378Ca 0.00 1.80 0.06 0.00 -1.25 0.00 0.00 55.69 56.31 3g6j s MET 1378Cb 0.00 -3.54 -0.07 0.00 2.84 0.00 0.00 34.83 34.06 3g6j s MET 1378CO 0.00 -0.48 -0.02 -1.12 -0.65 0.00 0.00 175.02 172.75 3g6j s SER 1379N 1.60 3.10 -0.07 1.11 0.01 0.34 -0.67 113.70 119.13 3g6j s SER 1379Ca 0.59 -1.28 0.02 0.00 1.31 0.00 0.00 55.95 56.59 3g6j s SER 1379Cb -0.28 -0.24 0.01 0.00 0.21 0.00 0.00 66.02 65.73 3g6j s SER 1379CO 0.24 -0.41 -0.13 -0.63 0.41 0.00 0.00 173.24 172.72 3g6j s ILE 1380N -2.94 1.20 -0.25 1.44 1.09 -0.25 -0.54 121.20 120.95 3g6j s ILE 1380Ca 0.33 -0.51 -0.15 0.00 -1.10 0.00 0.00 60.65 59.21 3g6j s ILE 1380Cb 0.06 -1.10 -0.04 0.00 -1.06 0.00 0.00 42.46 40.33 3g6j s ILE 1380CO 0.15 0.37 0.39 -0.76 -0.10 0.00 0.00 174.94 175.00 3g6j s LEU 1381N 0.68 4.08 -0.32 2.97 1.43 -0.58 -2.67 118.68 124.27 3g6j s LEU 1381Ca -0.14 0.38 -0.05 0.00 -1.03 0.00 0.00 54.13 53.29 3g6j s LEU 1381Cb -0.16 -2.47 0.04 0.00 0.03 0.00 0.00 46.19 43.63 3g6j s LEU 1381CO 0.04 -0.16 0.06 -0.62 0.23 0.00 0.00 176.35 175.90 3g6j s ASP 1382N 1.42 5.14 0.05 2.29 -1.08 -0.18 -0.91 116.67 123.40 3g6j s ASP 1382Ca 0.17 -1.14 0.03 0.00 -0.52 0.00 0.00 52.55 51.09 3g6j s ASP 1382Cb -0.15 -1.81 -0.04 0.00 -1.46 0.00 0.00 42.92 39.45 3g6j s ASP 1382CO 0.09 -0.29 0.01 -0.63 0.52 0.00 0.00 175.17 174.87 3g6j s ILE 1383N 1.36 4.14 -0.04 4.11 1.01 0.32 -0.53 121.20 131.57 3g6j s ILE 1383Ca -0.02 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.86 3g6j s ILE 1383Cb -0.19 -2.92 0.01 0.00 0.01 0.00 0.00 42.46 39.36 3g6j s ILE 1383CO 0.01 0.23 -0.11 -0.94 0.00 0.00 0.00 174.94 174.14 3g6j s SER 1384N -1.99 1.48 0.45 3.58 1.04 0.13 -2.10 113.70 116.29 3g6j s SER 1384Ca 0.23 -0.24 -0.21 0.00 0.48 0.00 0.00 55.95 56.22 3g6j s SER 1384Cb -0.12 -0.53 -0.09 0.00 0.10 0.00 0.00 66.02 65.38 3g6j s SER 1384CO 0.15 0.05 1.00 -0.04 0.98 0.00 0.00 173.24 175.39 3g6j s MET 1385N 0.41 4.02 0.69 4.02 -1.94 0.18 -2.51 119.30 124.17 3g6j s MET 1385Ca -0.08 1.29 -0.17 0.00 -1.71 0.00 0.00 55.69 55.03 3g6j s MET 1385Cb -0.12 -2.20 0.01 0.00 2.01 0.00 0.00 34.83 34.53 3g6j s MET 1385CO 0.02 -0.23 1.24 -1.64 -0.01 0.00 0.00 175.02 174.40 3g6j s MET 1386N -3.08 2.37 0.23 2.03 -1.94 -1.26 -4.58 119.30 113.06 3g6j s MET 1386Ca 0.64 1.88 -0.32 0.00 -1.71 0.00 0.00 55.69 56.18 3g6j s MET 1386Cb -0.14 -1.85 -0.12 0.00 2.01 0.00 0.00 34.83 34.72 3g6j s MET 1386CO 0.18 -1.69 1.63 0.25 -0.01 0.00 0.00 175.02 175.39 3g6j n THR 1387N -2.30 0.37 -0.93 2.05 -2.24 -1.23 -1.89 114.28 108.11 3g6j n THR 1387Ca 0.14 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 3g6j n THR 1387Cb 0.49 -1.85 0.00 0.00 -2.10 0.00 0.00 70.33 66.87 3g6j n THR 1387CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3g6j n GLY 1388N 3.20 0.48 3.36 3.38 0.00 -1.26 -4.79 105.19 109.57 3g6j n GLY 1388Ca 0.14 -0.49 -0.30 0.00 0.00 0.00 0.00 46.02 45.37 3g6j n GLY 1388CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3g6j s PHE 1389N -2.00 2.32 0.03 1.61 0.08 -0.79 -0.98 117.98 118.24 3g6j s PHE 1389Ca 0.00 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.65 3g6j s PHE 1389Cb 0.00 -1.34 -0.02 0.00 -0.57 0.00 0.00 43.02 41.09 3g6j s PHE 1389CO 0.00 0.21 -0.04 0.00 -0.10 0.00 0.00 175.22 175.29 3g6j s ALA 1390N -0.90 0.22 0.80 5.36 0.00 -1.07 -4.62 121.76 121.54 3g6j s ALA 1390Ca 0.13 -0.66 -0.11 0.00 0.00 0.00 0.00 51.96 51.32 3g6j s ALA 1390Cb -0.10 0.14 0.07 0.00 0.00 0.00 0.00 23.12 23.23 3g6j s ALA 1390CO 0.04 -0.15 1.09 -2.14 0.00 0.00 0.00 175.76 174.60 3g6j s PRO 1391N -1.62 2.06 -0.36 0.00 0.02 -1.26 -1.21 135.00 132.63 3g6j s PRO 1391Ca -0.14 1.03 -0.23 0.00 0.02 0.00 0.00 61.00 61.69 3g6j s PRO 1391Cb -0.09 -1.88 0.01 0.00 0.02 0.00 0.00 34.50 32.55 3g6j s PRO 1391CO -0.01 -1.74 0.77 0.34 -0.33 0.00 0.00 177.00 176.02 3g6j s ASP 1392N -3.47 6.54 0.22 2.53 3.68 -0.90 -4.80 116.67 120.47 3g6j s ASP 1392Ca 0.61 0.33 -0.10 0.00 2.13 0.00 0.00 52.55 55.53 3g6j s ASP 1392Cb -0.17 -2.39 0.33 0.00 -1.45 0.00 0.00 42.92 39.24 3g6j s ASP 1392CO 0.56 -0.72 1.66 0.74 0.13 0.00 0.00 175.17 177.54 3g6j h THR 1393N 5.74 0.46 -0.76 1.71 2.02 -1.94 0.15 112.91 120.29 3g6j h THR 1393Ca -0.25 -0.04 0.08 0.00 0.77 0.00 0.00 66.41 66.97 3g6j h THR 1393Cb 1.10 0.33 -0.11 0.00 -1.74 0.00 0.00 68.15 67.72 3g6j h THR 1393CO 0.90 0.02 -0.53 -0.78 0.37 0.00 0.00 175.52 175.50 3g6j h ASP 1394N 0.12 -1.89 -0.28 4.18 3.58 -2.00 -1.25 116.42 118.88 3g6j h ASP 1394Ca 0.34 0.29 -0.09 0.00 0.42 0.00 0.00 57.03 57.99 3g6j h ASP 1394Cb 0.57 0.84 -0.01 0.00 1.72 0.00 0.00 39.33 42.45 3g6j h ASP 1394CO -0.56 -0.30 -0.20 0.44 -2.88 0.00 0.00 179.24 175.74 3g6j h ASP 1395N -0.15 0.65 -0.90 2.28 5.19 -1.52 -3.21 116.42 118.76 3g6j h ASP 1395Ca 0.16 -0.44 -0.01 0.00 -0.62 0.00 0.00 57.03 56.11 3g6j h ASP 1395Cb 0.51 -0.18 -0.04 0.00 0.18 0.00 0.00 39.33 39.79 3g6j h ASP 1395CO -0.80 0.95 0.51 -0.07 -3.12 0.00 0.00 179.24 176.71 3g6j h LEU 1396N 0.35 1.11 -1.54 1.55 3.38 -0.71 -2.25 115.31 117.21 3g6j h LEU 1396Ca 0.05 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3g6j h LEU 1396Cb 0.74 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3g6j h LEU 1396CO 0.05 0.88 0.09 0.11 0.09 0.00 0.00 178.44 179.66 3g6j h LYS 1397N 1.26 0.39 -0.07 1.13 1.57 -1.24 -1.60 116.57 118.00 3g6j h LYS 1397Ca 0.32 -0.05 -0.16 0.00 -1.87 0.00 0.00 60.65 58.89 3g6j h LYS 1397Cb 0.00 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 3g6j h LYS 1397CO -0.05 0.35 -0.65 0.37 -0.57 0.00 0.00 179.45 178.90 3g6j h GLN 1398N 0.39 0.27 -0.25 3.15 5.75 -1.43 -2.76 115.11 120.23 3g6j h GLN 1398Ca 0.10 -0.20 -0.09 0.00 -0.15 0.00 0.00 58.65 58.31 3g6j h GLN 1398Cb 0.12 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 3g6j h GLN 1398CO -0.01 0.83 -0.22 -0.07 -2.65 0.00 0.00 178.83 176.71 3g6j h LEU 1399N 0.20 0.45 -0.64 -2.39 3.38 -0.89 -3.08 115.31 112.35 3g6j h LEU 1399Ca -0.01 -0.14 -0.12 0.00 0.09 0.00 0.00 57.88 57.69 3g6j h LEU 1399Cb 1.18 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 3g6j h LEU 1399CO 0.10 0.68 -0.59 0.00 0.09 0.00 0.00 178.44 178.73 3g6j h ALA 1400N 1.36 0.86 -0.40 1.53 0.00 -1.28 -3.25 119.26 118.08 3g6j h ALA 1400Ca 0.07 -0.54 0.01 0.00 0.00 0.00 0.00 54.91 54.45 3g6j h ALA 1400Cb 0.61 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 3g6j h ALA 1400CO 0.04 0.74 0.25 -0.91 0.00 0.00 0.00 179.25 179.37 3g6j h ASN 1401N 0.00 0.41 -2.69 0.00 -0.26 -1.39 -3.43 115.58 108.21 3g6j h ASN 1401Ca -0.01 -0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 55.17 3g6j h ASN 1401Cb 1.16 -0.09 0.07 0.00 -1.06 0.00 0.00 38.32 38.40 3g6j h ASN 1401CO 0.08 0.30 0.78 0.61 -1.06 0.00 0.00 177.43 178.13 3g6j n GLY 1402N -1.21 1.11 3.74 2.83 0.00 -1.23 -4.98 105.19 105.44 3g6j n GLY 1402Ca 0.01 0.55 -0.36 0.00 0.00 0.00 0.00 46.02 46.22 3g6j n GLY 1402CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s VAL 1403N 0.40 2.33 0.00 1.61 0.11 -1.26 -2.83 120.40 120.75 3g6j s VAL 1403Ca 0.71 0.19 0.00 0.00 -2.93 0.00 0.00 61.98 59.95 3g6j s VAL 1403Cb -0.60 -2.96 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 3g6j s VAL 1403CO 0.44 -0.06 0.00 0.47 -3.33 0.00 0.00 175.10 172.62 3g6j n ASP 1404N -2.08 -0.75 -3.80 3.54 10.43 -1.26 -5.03 116.55 117.60 3g6j n ASP 1404Ca 0.14 0.00 -0.13 0.00 2.57 0.00 0.00 54.79 57.38 3g6j n ASP 1404Cb 0.49 -0.13 -0.12 0.00 1.84 0.00 0.00 41.12 43.21 3g6j n ASP 1404CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 3g6j s ARG 1405N -0.14 0.24 -0.04 -1.24 0.52 -1.13 -2.01 118.95 115.14 3g6j s ARG 1405Ca 0.00 0.29 -0.02 0.00 -0.52 0.00 0.00 55.73 55.49 3g6j s ARG 1405Cb 0.00 0.12 0.03 0.00 0.52 0.00 0.00 34.95 35.62 3g6j s ARG 1405CO 0.00 -0.03 0.04 -0.47 0.02 0.00 0.00 175.30 174.86 3g6j s TYR 1406N 0.13 0.18 -0.06 -0.53 5.04 -0.45 -4.68 117.35 116.98 3g6j s TYR 1406Ca -0.00 0.16 0.05 0.00 -2.44 0.00 0.00 57.07 54.84 3g6j s TYR 1406Cb -0.02 -0.52 -0.02 0.00 0.35 0.00 0.00 41.96 41.75 3g6j s TYR 1406CO 0.00 -0.21 -0.20 0.42 -1.34 0.00 0.00 175.55 174.22 3g6j s ILE 1407N 2.02 2.49 0.57 3.14 1.01 -1.26 -1.48 121.20 127.69 3g6j s ILE 1407Ca 0.04 -0.92 -0.08 0.00 0.00 0.00 0.00 60.65 59.68 3g6j s ILE 1407Cb -0.12 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 3g6j s ILE 1407CO -0.03 0.57 0.93 -0.94 0.00 0.00 0.00 174.94 175.47 3g6j s SER 1408N -0.33 6.12 0.17 3.58 1.04 -1.26 -4.91 113.70 118.12 3g6j s SER 1408Ca 0.02 1.15 -0.18 0.00 0.48 0.00 0.00 55.95 57.42 3g6j s SER 1408Cb -0.13 -2.28 0.11 0.00 0.10 0.00 0.00 66.02 63.83 3g6j s SER 1408CO 0.02 -0.82 1.64 0.50 0.98 0.00 0.00 173.24 175.56 3g6j h LYS 1409N -0.13 -0.10 -1.00 4.02 3.64 -2.00 -1.66 116.57 119.35 3g6j h LYS 1409Ca -0.45 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 58.97 3g6j h LYS 1409Cb 1.21 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.99 3g6j h LYS 1409CO 0.62 -0.06 0.65 -0.92 -2.27 0.00 0.00 179.45 177.47 3g6j h TYR 1410N -0.10 1.22 -0.04 1.91 3.20 -1.99 0.99 116.97 122.16 3g6j h TYR 1410Ca 0.21 0.03 -0.18 0.00 3.14 0.00 0.00 58.73 61.93 3g6j h TYR 1410Cb 0.42 -0.41 -0.01 0.00 1.54 0.00 0.00 36.73 38.27 3g6j h TYR 1410CO -0.44 0.69 -0.74 1.49 -1.64 0.00 0.00 178.16 177.53 3g6j h GLU 1411N 1.25 0.26 0.11 1.82 4.57 -1.81 -2.32 114.58 118.45 3g6j h GLU 1411Ca 0.40 -0.23 -0.29 0.00 -1.18 0.00 0.00 59.36 58.06 3g6j h GLU 1411Cb 0.02 0.05 0.03 0.00 -0.16 0.00 0.00 28.75 28.69 3g6j h GLU 1411CO -0.13 0.89 -1.22 -0.07 -1.18 0.00 0.00 179.01 177.30 3g6j h LEU 1412N 0.17 0.84 0.68 1.64 4.07 -0.97 -3.37 115.31 118.37 3g6j h LEU 1412Ca -0.03 -0.77 -0.03 0.00 0.08 0.00 0.00 57.88 57.13 3g6j h LEU 1412Cb 1.31 -0.26 0.01 0.00 1.08 0.00 0.00 40.66 42.79 3g6j h LEU 1412CO 0.12 1.57 -0.33 0.44 -1.08 0.00 0.00 178.44 179.16 3g6j h ASP 1413N 0.27 -0.77 -0.15 -0.43 3.32 -0.80 -3.41 116.42 114.46 3g6j h ASP 1413Ca -0.18 -0.01 -0.55 0.00 0.02 0.00 0.00 57.03 56.32 3g6j h ASP 1413Cb 1.89 0.20 -0.02 0.00 0.22 0.00 0.00 39.33 41.62 3g6j h ASP 1413CO 0.23 -0.45 0.82 1.17 -1.72 0.00 0.00 179.24 179.30 3g6j n LYS 1414N -5.42 0.00 -0.15 3.56 3.00 -0.88 -4.88 118.16 113.39 3g6j n LYS 1414Ca -0.13 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.16 3g6j n LYS 1414Cb 0.38 -1.04 0.02 0.00 0.00 0.00 0.00 35.03 34.39 3g6j n LYS 1414CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3g6j n ALA 1415N 4.67 -0.15 0.15 3.14 0.00 -1.26 -4.84 120.51 122.22 3g6j n ALA 1415Ca 0.35 -0.14 0.09 0.00 0.00 0.00 0.00 53.44 53.73 3g6j n ALA 1415Cb -0.03 -0.01 0.48 0.00 0.00 0.00 0.00 19.45 19.89 3g6j n ALA 1415CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3g6j n PHE 1416N -2.23 0.59 0.00 0.00 0.99 -1.26 -3.47 117.46 112.08 3g6j n PHE 1416Ca 0.01 0.31 0.00 0.00 -0.00 0.00 0.00 57.45 57.77 3g6j n PHE 1416Cb 0.05 -0.93 0.00 0.00 -1.00 0.00 0.00 39.48 37.60 3g6j n PHE 1416CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 3g6j n SER 1417N -2.14 0.00 -2.93 4.37 2.88 -1.26 -4.21 113.62 110.32 3g6j n SER 1417Ca -0.01 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.40 3g6j n SER 1417Cb 0.13 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.62 3g6j n SER 1417CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3g6j n ASP 1418N -0.25 -0.68 -3.25 -3.46 9.92 -1.23 -4.90 116.55 112.70 3g6j n ASP 1418Ca 0.00 -3.27 -0.38 0.00 -0.53 0.00 0.00 54.79 50.61 3g6j n ASP 1418Cb 0.00 0.60 0.00 0.00 -0.64 0.00 0.00 41.12 41.08 3g6j n ASP 1418CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 3g6j n ARG 1419N 0.25 4.15 0.05 -1.24 0.63 -1.23 -4.53 116.66 114.75 3g6j n ARG 1419Ca 0.14 -3.69 0.12 0.00 -0.92 0.00 0.00 57.85 53.50 3g6j n ARG 1419Cb 0.70 -2.42 0.20 0.00 0.45 0.00 0.00 32.46 31.39 3g6j n ARG 1419CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 3g6j n ASN 1420N 0.52 0.66 -4.62 6.15 6.94 -1.26 -4.38 115.26 119.27 3g6j n ASN 1420Ca 0.53 0.11 -0.24 0.00 -0.02 0.00 0.00 54.58 54.96 3g6j n ASN 1420Cb 0.30 0.12 -0.08 0.00 -2.36 0.00 0.00 39.78 37.76 3g6j n ASN 1420CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 3g6j s THR 1421N -3.14 2.79 -0.29 5.53 -4.23 -1.26 0.51 115.64 115.56 3g6j s THR 1421Ca 0.07 -1.99 -0.23 0.00 -1.18 0.00 0.00 61.69 58.36 3g6j s THR 1421Cb 0.14 -2.76 0.14 0.00 1.34 0.00 0.00 72.50 71.36 3g6j s THR 1421CO 0.71 -0.25 1.11 -0.22 -0.54 0.00 0.00 174.62 175.42 3g6j s LEU 1422N -3.69 -0.37 -0.11 4.79 2.96 -0.89 -4.96 118.68 116.40 3g6j s LEU 1422Ca 0.34 0.68 0.03 0.00 -0.22 0.00 0.00 54.13 54.96 3g6j s LEU 1422Cb -0.02 1.67 0.01 0.00 0.50 0.00 0.00 46.19 48.35 3g6j s LEU 1422CO 0.19 -0.12 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.26 3g6j s ILE 1423N 0.47 1.93 -0.37 6.68 1.01 -1.26 -0.52 121.20 129.14 3g6j s ILE 1423Ca 0.01 -0.93 -0.01 0.00 0.00 0.00 0.00 60.65 59.73 3g6j s ILE 1423Cb -0.05 -1.70 0.10 0.00 0.01 0.00 0.00 42.46 40.82 3g6j s ILE 1423CO -0.10 0.53 0.13 -0.63 0.00 0.00 0.00 174.94 174.86 3g6j s ILE 1424N 0.61 2.95 0.29 2.92 1.01 -0.09 -4.67 121.20 124.23 3g6j s ILE 1424Ca -0.13 -2.03 -0.29 0.00 0.00 0.00 0.00 60.65 58.21 3g6j s ILE 1424Cb -0.17 -3.00 -0.09 0.00 0.01 0.00 0.00 42.46 39.21 3g6j s ILE 1424CO 0.03 -0.57 1.06 -0.31 0.00 0.00 0.00 174.94 175.16 3g6j s TYR 1425N 1.09 3.62 -0.05 3.97 1.51 -0.55 -1.52 117.35 125.41 3g6j s TYR 1425Ca 0.07 1.74 0.06 0.00 -1.01 0.00 0.00 57.07 57.92 3g6j s TYR 1425Cb -0.21 -3.20 -0.01 0.00 -0.11 0.00 0.00 41.96 38.43 3g6j s TYR 1425CO -0.05 -0.36 -0.23 -0.51 -1.11 0.00 0.00 175.55 173.29 3g6j s LEU 1426N -1.55 2.03 0.22 -1.29 1.43 0.30 -1.35 118.68 118.47 3g6j s LEU 1426Ca 0.45 -0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 53.04 3g6j s LEU 1426Cb -0.29 -1.27 0.20 0.00 0.03 0.00 0.00 46.19 44.86 3g6j s LEU 1426CO 0.37 0.22 1.68 0.44 0.23 0.00 0.00 176.35 179.30 3g6j h ASP 1427N 6.10 0.86 -5.20 2.29 5.19 -1.68 0.99 116.42 124.97 3g6j h ASP 1427Ca -0.32 -0.25 -0.07 0.00 -0.62 0.00 0.00 57.03 55.76 3g6j h ASP 1427Cb 1.17 -0.23 -0.06 0.00 0.18 0.00 0.00 39.33 40.39 3g6j h ASP 1427CO 0.47 0.97 0.02 -1.59 -3.12 0.00 0.00 179.24 175.98 3g6j s LYS 1428N -4.87 1.82 0.00 3.56 0.00 -1.25 -3.32 119.74 115.69 3g6j s LYS 1428Ca -0.10 -1.35 0.00 0.00 0.00 0.00 0.00 55.97 54.52 3g6j s LYS 1428Cb 0.14 0.53 0.00 0.00 0.00 0.00 0.00 37.83 38.49 3g6j s LYS 1428CO 0.83 -0.80 0.00 1.55 0.00 0.00 0.00 175.35 176.94 3g6j n VAL 1429N -0.47 0.00 -0.41 1.79 3.14 -1.15 -4.87 118.33 116.37 3g6j n VAL 1429Ca -0.03 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.35 3g6j n VAL 1429Cb 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.39 3g6j n VAL 1429CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 3g6j n SER 1430N 0.00 0.00 -2.13 6.55 2.88 -1.26 0.29 113.62 119.95 3g6j n SER 1430Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 3g6j n SER 1430Cb 0.00 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 63.49 3g6j n SER 1430CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 3g6j n HIS 1431N 0.00 0.40 0.00 0.66 -0.00 -1.25 0.24 115.22 115.27 3g6j n HIS 1431Ca 0.00 -1.30 0.00 0.00 0.46 0.00 0.00 57.72 56.88 3g6j n HIS 1431Cb 0.00 -0.02 0.00 0.00 -0.12 0.00 0.00 29.99 29.85 3g6j n HIS 1431CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 3g6j n SER 1432N -0.16 0.00 0.00 0.26 7.64 -1.26 -4.91 113.62 115.19 3g6j n SER 1432Ca 0.02 0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.91 3g6j n SER 1432Cb 0.95 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.15 3g6j n SER 1432CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3g6j n GLU 1433N -0.01 2.13 -4.74 1.43 4.71 -1.26 -5.09 120.64 117.80 3g6j n GLU 1433Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.16 56.90 3g6j n GLU 1433Cb 0.00 0.00 -0.16 0.00 -1.01 0.00 0.00 31.44 30.27 3g6j n GLU 1433CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 3g6j s ASP 1434N -1.00 2.00 -0.29 1.62 1.11 -1.26 -4.87 116.67 113.98 3g6j s ASP 1434Ca 0.00 -0.33 -0.29 0.00 0.18 0.00 0.00 52.55 52.11 3g6j s ASP 1434Cb 0.00 -0.67 0.01 0.00 1.07 0.00 0.00 42.92 43.33 3g6j s ASP 1434CO 0.00 0.11 1.13 -1.81 1.18 0.00 0.00 175.17 175.78 3g6j s ASP 1435N 0.23 6.92 -0.02 0.27 1.01 0.46 -4.88 116.67 120.66 3g6j s ASP 1435Ca -0.07 1.20 0.05 0.00 0.71 0.00 0.00 52.55 54.43 3g6j s ASP 1435Cb -0.13 -2.54 -0.01 0.00 1.01 0.00 0.00 42.92 41.25 3g6j s ASP 1435CO 0.03 -0.87 -0.17 0.00 0.21 0.00 0.00 175.17 174.37 3g6j s LEU 1437N -0.26 2.01 -0.10 0.00 0.05 -0.51 -5.02 118.68 114.86 3g6j s LEU 1437Ca 0.03 -0.80 -0.21 0.00 0.05 0.00 0.00 54.13 53.20 3g6j s LEU 1437Cb -0.08 0.55 0.05 0.00 -2.05 0.00 0.00 46.19 44.66 3g6j s LEU 1437CO 0.00 -0.63 0.51 0.00 -0.55 0.00 0.00 176.35 175.68 3g6j s ALA 1438N -3.66 -1.28 0.06 1.48 0.00 -1.26 -1.27 121.76 115.82 3g6j s ALA 1438Ca 0.04 1.08 -0.11 0.00 0.00 0.00 0.00 51.96 52.97 3g6j s ALA 1438Cb 0.05 -0.31 0.01 0.00 0.00 0.00 0.00 23.12 22.87 3g6j s ALA 1438CO -0.09 -0.29 0.24 -0.59 0.00 0.00 0.00 175.76 175.03 3g6j s PHE 1439N -0.66 0.01 0.65 0.00 -0.71 -0.97 -5.01 117.98 111.29 3g6j s PHE 1439Ca -0.08 -0.26 -0.13 0.00 -1.04 0.00 0.00 56.93 55.42 3g6j s PHE 1439Cb -0.03 0.03 -0.01 0.00 -1.21 0.00 0.00 43.02 41.79 3g6j s PHE 1439CO 0.05 -0.50 1.06 0.15 -1.34 0.00 0.00 175.22 174.64 3g6j s LYS 1440N -2.98 3.07 -0.06 1.99 1.02 -1.26 -1.90 119.74 119.62 3g6j s LYS 1440Ca -0.02 1.12 -0.02 0.00 0.02 0.00 0.00 55.97 57.06 3g6j s LYS 1440Cb 0.01 -2.00 0.04 0.00 -0.52 0.00 0.00 37.83 35.35 3g6j s LYS 1440CO -0.06 -1.01 0.11 0.14 -0.92 0.00 0.00 175.35 173.61 3g6j s VAL 1441N -2.71 -0.16 -0.21 3.17 -7.23 0.40 -2.11 120.40 111.56 3g6j s VAL 1441Ca 0.61 0.33 -0.08 0.00 -1.81 0.00 0.00 61.98 61.04 3g6j s VAL 1441Cb -0.16 -0.21 -0.04 0.00 0.56 0.00 0.00 36.38 36.53 3g6j s VAL 1441CO 0.45 0.14 0.08 -1.00 -0.31 0.00 0.00 175.10 174.46 3g6j s HIS 1442N 1.92 3.21 -0.49 2.82 0.09 -0.35 -0.76 115.29 121.73 3g6j s HIS 1442Ca 0.00 -0.04 -0.28 0.00 -0.00 0.00 0.00 55.06 54.75 3g6j s HIS 1442Cb -0.12 -2.15 -0.00 0.00 -0.00 0.00 0.00 32.58 30.31 3g6j s HIS 1442CO -0.05 0.00 1.61 -1.14 -0.00 0.00 0.00 174.74 175.16 3g6j s GLN 1443N 0.80 3.20 -0.16 1.40 0.74 -0.53 -2.59 119.66 122.53 3g6j s GLN 1443Ca 0.04 0.81 -0.19 0.00 0.05 0.00 0.00 55.36 56.07 3g6j s GLN 1443Cb -0.13 -4.18 -0.23 0.00 1.10 0.00 0.00 33.01 29.56 3g6j s GLN 1443CO 0.02 -2.03 0.40 0.10 -0.55 0.00 0.00 175.29 173.23 3g6j h TYR 1444N 12.32 0.20 -3.46 1.67 -0.00 -1.37 -3.41 116.97 122.93 3g6j h TYR 1444Ca -0.28 -0.15 -0.61 0.00 0.00 0.00 0.00 58.73 57.70 3g6j h TYR 1444Cb 1.13 -0.01 -0.12 0.00 0.00 0.00 0.00 36.73 37.73 3g6j h TYR 1444CO 1.01 1.50 -0.38 0.12 -0.00 0.00 0.00 178.16 180.40 3g6j s PHE 1445N -2.41 3.37 -0.15 0.10 2.19 -1.19 -4.96 117.98 114.94 3g6j s PHE 1445Ca -0.24 0.42 -0.23 0.00 0.33 0.00 0.00 56.93 57.21 3g6j s PHE 1445Cb 0.05 -2.34 -0.02 0.00 -1.31 0.00 0.00 43.02 39.39 3g6j s PHE 1445CO 0.68 0.11 0.72 1.21 1.83 0.00 0.00 175.22 179.77 3g6j s ASN 1446N 0.85 6.87 0.09 6.13 3.84 -1.26 -4.68 114.94 126.78 3g6j s ASN 1446Ca 0.13 1.06 -0.14 0.00 0.21 0.00 0.00 52.86 54.12 3g6j s ASN 1446Cb -0.13 -2.40 0.02 0.00 -0.55 0.00 0.00 41.25 38.18 3g6j s ASN 1446CO 0.04 -0.27 0.33 0.54 -2.79 0.00 0.00 177.10 174.96 3g6j s VAL 1447N 1.65 0.09 0.99 -5.21 0.11 -1.26 -5.15 120.40 111.62 3g6j s VAL 1447Ca 0.35 -0.72 -0.16 0.00 -2.93 0.00 0.00 61.98 58.52 3g6j s VAL 1447Cb -0.17 -1.13 0.20 0.00 -1.53 0.00 0.00 36.38 33.75 3g6j s VAL 1447CO 0.13 -0.40 1.24 -1.83 -3.33 0.00 0.00 175.10 170.91 3g6j s GLU 1448N -3.36 0.45 0.09 1.54 -1.05 -1.26 -4.65 118.70 110.46 3g6j s GLU 1448Ca 0.01 -0.18 0.00 0.00 -0.15 0.00 0.00 54.97 54.64 3g6j s GLU 1448Cb 0.02 -1.80 0.00 0.00 -0.44 0.00 0.00 34.13 31.90 3g6j s GLU 1448CO -0.09 -2.58 0.00 1.28 0.95 0.00 0.00 175.26 174.82 3g6j n LEU 1449N -3.94 0.00 -1.95 1.83 4.77 -1.26 -4.88 117.00 111.58 3g6j n LEU 1449Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.11 3g6j n LEU 1449Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 3g6j n LEU 1449CO 0.48 0.00 -0.47 2.30 -1.33 0.00 0.00 177.39 178.38 3g6j n ILE 1450N 0.00-10.14 -2.95 -0.08 -5.35 -1.26 -4.96 119.36 94.62 3g6j n ILE 1450Ca 0.00 3.05 -0.40 0.00 -0.27 0.00 0.00 62.75 65.13 3g6j n ILE 1450Cb 0.00 -4.61 -0.04 0.00 -1.74 0.00 0.00 39.64 33.24 3g6j n ILE 1450CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 3g6j s GLN 1451N -1.32 4.47 0.17 6.28 0.74 -1.26 -4.87 119.66 123.87 3g6j s GLN 1451Ca 0.00 1.04 -0.32 0.00 0.05 0.00 0.00 55.36 56.13 3g6j s GLN 1451Cb 0.00 -3.45 -0.16 0.00 1.10 0.00 0.00 33.01 30.50 3g6j s GLN 1451CO 0.00 0.04 0.98 -2.30 -0.55 0.00 0.00 175.29 173.46 3g6j n PRO 1452N 3.78 0.73 -1.84 1.67 -0.02 -1.26 -3.58 135.00 134.49 3g6j n PRO 1452Ca 0.01 0.26 -0.30 0.00 -2.02 0.00 0.00 63.50 61.45 3g6j n PRO 1452Cb 0.51 -1.63 0.07 0.00 -0.02 0.00 0.00 33.50 32.44 3g6j n PRO 1452CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3g6j s GLY 1453N -0.31 1.61 0.07 -1.23 0.00 0.01 -4.78 107.32 102.69 3g6j s GLY 1453Ca 0.72 -0.47 0.01 0.00 0.00 0.00 0.00 44.72 44.98 3g6j s GLY 1453CO 0.55 -0.03 -0.05 0.00 0.00 0.00 0.00 173.10 173.57 3g6j s ALA 1454N -3.43 0.69 -0.11 3.20 0.00 -1.04 -0.58 121.76 120.48 3g6j s ALA 1454Ca 0.60 -1.19 -0.04 0.00 0.00 0.00 0.00 51.96 51.34 3g6j s ALA 1454Cb -0.12 0.19 0.06 0.00 0.00 0.00 0.00 23.12 23.26 3g6j s ALA 1454CO 0.51 -0.27 0.20 0.08 0.00 0.00 0.00 175.76 176.28 3g6j s VAL 1455N -3.39 -0.31 0.02 0.00 1.01 -0.61 -0.69 120.40 116.42 3g6j s VAL 1455Ca 0.06 0.27 0.05 0.00 0.00 0.00 0.00 61.98 62.36 3g6j s VAL 1455Cb 0.04 -0.39 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 3g6j s VAL 1455CO -0.06 0.09 -0.13 -0.75 0.00 0.00 0.00 175.10 174.25 3g6j s LYS 1456N 2.33 2.30 -0.02 2.72 2.20 0.31 -1.75 119.74 127.83 3g6j s LYS 1456Ca 0.03 -0.86 0.03 0.00 -0.36 0.00 0.00 55.97 54.81 3g6j s LYS 1456Cb -0.13 -2.33 0.00 0.00 -1.51 0.00 0.00 37.83 33.86 3g6j s LYS 1456CO -0.07 0.57 -0.09 0.14 -0.36 0.00 0.00 175.35 175.53 3g6j s VAL 1457N -0.95 0.79 0.18 4.02 -7.23 -0.45 -1.01 120.40 115.74 3g6j s VAL 1457Ca 0.16 -0.37 -0.21 0.00 -1.81 0.00 0.00 61.98 59.74 3g6j s VAL 1457Cb -0.11 -0.70 0.06 0.00 0.56 0.00 0.00 36.38 36.18 3g6j s VAL 1457CO 0.06 0.25 0.59 -0.72 -0.31 0.00 0.00 175.10 174.97 3g6j s TYR 1458N 0.16 -0.41 0.21 2.82 -0.85 -1.09 -2.34 117.35 115.86 3g6j s TYR 1458Ca -0.03 0.14 -0.28 0.00 -0.52 0.00 0.00 57.07 56.38 3g6j s TYR 1458Cb -0.08 0.53 -0.09 0.00 0.38 0.00 0.00 41.96 42.70 3g6j s TYR 1458CO 0.00 -0.90 0.88 0.00 -1.52 0.00 0.00 175.55 174.02 3g6j s ALA 1459N -3.79 3.38 0.30 9.51 0.00 -1.26 -1.09 121.76 128.81 3g6j s ALA 1459Ca 0.03 0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.58 3g6j s ALA 1459Cb -0.01 -3.12 0.75 0.00 0.00 0.00 0.00 23.12 20.73 3g6j s ALA 1459CO -0.09 0.24 1.74 0.10 0.00 0.00 0.00 175.76 177.75 3g6j h TYR 1460N 4.21 0.93 0.00 0.00 -0.00 -1.23 0.10 116.97 120.98 3g6j h TYR 1460Ca -0.46 0.04 0.00 0.00 0.00 0.00 0.00 58.73 58.31 3g6j h TYR 1460Cb 1.20 -0.26 0.00 0.00 0.00 0.00 0.00 36.73 37.67 3g6j h TYR 1460CO 0.62 0.12 0.00 2.48 -0.00 0.00 0.00 178.16 181.38 3g6j n TYR 1461N -4.87 0.00 -3.43 0.10 0.18 -1.26 -4.55 117.16 103.33 3g6j n TYR 1461Ca 0.23 0.00 -0.26 0.00 1.88 0.00 0.00 57.90 59.75 3g6j n TYR 1461Cb 0.62 -0.25 -0.11 0.00 -0.38 0.00 0.00 39.34 39.22 3g6j n TYR 1461CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 3g6j s ASN 1462N -2.51 2.45 0.29 9.48 3.04 0.02 -4.98 114.94 122.74 3g6j s ASN 1462Ca 0.30 -2.15 0.12 0.00 0.04 0.00 0.00 52.86 51.18 3g6j s ASN 1462Cb 0.20 -0.20 0.40 0.00 -1.54 0.00 0.00 41.25 40.11 3g6j s ASN 1462CO 0.44 -0.29 1.62 0.25 -3.04 0.00 0.00 177.10 176.09 3g6j h LEU 1463N 6.88 0.00 -0.16 3.21 5.85 -1.80 -3.30 115.31 125.99 3g6j h LEU 1463Ca 0.08 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.69 3g6j h LEU 1463Cb 0.98 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.01 3g6j h LEU 1463CO 0.26 0.58 -0.30 -0.33 -0.34 0.00 0.00 178.44 178.30 3g6j h GLU 1464N 0.00 0.49 -5.79 1.25 5.08 -1.94 -3.36 114.58 110.32 3g6j h GLU 1464Ca -0.01 -0.31 -0.46 0.00 -1.00 0.00 0.00 59.36 57.58 3g6j h GLU 1464Cb 1.09 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 3g6j h GLU 1464CO 0.07 0.91 1.33 -1.21 -1.00 0.00 0.00 179.01 179.11 3g6j s GLU 1465N -4.05 3.11 0.26 2.33 2.02 -1.24 -4.92 118.70 116.21 3g6j s GLU 1465Ca -0.13 -1.08 0.03 0.00 0.02 0.00 0.00 54.97 53.81 3g6j s GLU 1465Cb 0.06 -5.29 -0.06 0.00 0.10 0.00 0.00 34.13 28.95 3g6j s GLU 1465CO 0.80 -2.99 0.03 -1.54 0.02 0.00 0.00 175.26 171.57 3g6j s SER 1466N 6.06 1.88 -0.01 -0.19 1.04 -1.26 -4.51 113.70 116.71 3g6j s SER 1466Ca 0.60 -1.29 0.03 0.00 0.48 0.00 0.00 55.95 55.77 3g6j s SER 1466Cb -0.01 0.01 -0.00 0.00 0.10 0.00 0.00 66.02 66.11 3g6j s SER 1466CO 0.02 -0.58 -0.10 0.00 0.98 0.00 0.00 173.24 173.56 3g6j s THR 1468N -0.12 0.87 -0.02 0.00 2.01 -1.26 -1.34 115.64 115.78 3g6j s THR 1468Ca 0.02 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.70 3g6j s THR 1468Cb -0.05 -0.82 0.01 0.00 0.01 0.00 0.00 72.50 71.64 3g6j s THR 1468CO -0.00 0.29 -0.05 -0.13 -0.69 0.00 0.00 174.62 174.04 3g6j s ARG 1469N 0.68 0.60 0.48 4.92 3.00 -0.72 -4.99 118.95 122.92 3g6j s ARG 1469Ca -0.12 -0.16 0.05 0.00 0.00 0.00 0.00 55.73 55.50 3g6j s ARG 1469Cb -0.14 -0.60 0.02 0.00 0.00 0.00 0.00 34.95 34.22 3g6j s ARG 1469CO 0.02 0.05 0.67 -0.06 0.00 0.00 0.00 175.30 175.97 3g6j s PHE 1470N 0.28 2.82 -0.14 -0.53 0.40 -1.25 -1.58 117.98 117.97 3g6j s PHE 1470Ca -0.03 -0.23 -0.21 0.00 -0.60 0.00 0.00 56.93 55.86 3g6j s PHE 1470Cb -0.07 -2.55 0.05 0.00 0.51 0.00 0.00 43.02 40.96 3g6j s PHE 1470CO -0.00 -0.64 0.55 1.52 0.70 0.00 0.00 175.22 177.35 3g6j s TYR 1471N -2.54 -0.56 0.05 0.36 -0.85 0.25 -3.72 117.35 110.34 3g6j s TYR 1471Ca 0.56 1.22 -0.19 0.00 -0.52 0.00 0.00 57.07 58.15 3g6j s TYR 1471Cb -0.10 0.24 0.04 0.00 0.38 0.00 0.00 41.96 42.51 3g6j s TYR 1471CO 0.35 -0.38 0.43 -1.58 -1.52 0.00 0.00 175.55 172.85 3g6j s HIS 1472N -0.30 -0.29 -0.45 -3.49 2.46 -1.26 -0.81 115.29 111.16 3g6j s HIS 1472Ca -0.05 0.24 0.05 0.00 0.47 0.00 0.00 55.06 55.77 3g6j s HIS 1472Cb -0.03 0.25 0.37 0.00 -0.13 0.00 0.00 32.58 33.03 3g6j s HIS 1472CO 0.03 -0.60 1.25 -0.35 -2.47 0.00 0.00 174.74 172.61 3g6j n PRO 1473N 0.42 2.34 0.05 2.88 -0.05 -1.26 -4.19 135.00 135.18 3g6j n PRO 1473Ca -0.18 -1.50 0.00 0.00 -0.05 0.00 0.00 63.50 61.77 3g6j n PRO 1473Cb 0.60 -1.74 0.00 0.00 -0.05 0.00 0.00 33.50 32.31 3g6j n PRO 1473CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 3g6j n GLU 1474N 0.04 0.00 0.13 0.54 1.02 -1.26 -4.95 120.64 116.16 3g6j n GLU 1474Ca 0.20 0.00 -0.02 0.00 -0.02 0.00 0.00 57.16 57.32 3g6j n GLU 1474Cb 0.87 0.00 0.12 0.00 -0.02 0.00 0.00 31.44 32.41 3g6j n GLU 1474CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 3g6j h LYS 1475N 0.00 0.00 -3.81 3.49 1.57 -1.89 -3.50 116.57 112.43 3g6j h LYS 1475Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3g6j h LYS 1475Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3g6j h LYS 1475CO 0.00 0.67 -0.83 0.39 -0.57 0.00 0.00 179.45 179.11 3g6j n GLU 1476N -3.69 -4.26 -0.75 3.15 -0.58 -1.26 -4.57 120.64 108.68 3g6j n GLU 1476Ca -0.01 3.15 0.00 0.00 -0.42 0.00 0.00 57.16 59.88 3g6j n GLU 1476Cb 0.67 -3.61 0.00 0.00 -0.57 0.00 0.00 31.44 27.93 3g6j n GLU 1476CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3g6j n ASP 1477N -0.52 -2.21 -3.88 1.62 10.43 -1.26 -3.79 116.55 116.94 3g6j n ASP 1477Ca 0.00 0.00 -0.31 0.00 2.57 0.00 0.00 54.79 57.05 3g6j n ASP 1477Cb 0.00 -2.43 -0.01 0.00 1.84 0.00 0.00 41.12 40.52 3g6j n ASP 1477CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3g6j n GLY 1478N -1.07 -0.47 3.79 0.44 0.00 -1.24 -3.91 105.19 102.71 3g6j n GLY 1478Ca 0.00 0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 3g6j n GLY 1478CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3g6j s LYS 1479N -6.57 4.07 0.58 1.61 3.01 -1.25 -4.53 119.74 116.66 3g6j s LYS 1479Ca 0.63 0.35 -0.18 0.00 -1.01 0.00 0.00 55.97 55.75 3g6j s LYS 1479Cb -0.33 -3.31 -0.04 0.00 -1.01 0.00 0.00 37.83 33.13 3g6j s LYS 1479CO 0.77 0.47 1.11 -0.51 0.51 0.00 0.00 175.35 177.70 3g6j s LEU 1480N -0.35 3.62 -0.40 3.17 1.43 -1.26 -4.85 118.68 120.04 3g6j s LEU 1480Ca 0.23 2.07 -0.28 0.00 -1.03 0.00 0.00 54.13 55.11 3g6j s LEU 1480Cb -0.15 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.49 3g6j s LEU 1480CO 0.10 -1.31 1.62 0.20 0.23 0.00 0.00 176.35 177.20 3g6j s ASN 1481N -2.13 6.04 -0.01 2.29 0.02 -1.26 -4.98 114.94 114.92 3g6j s ASN 1481Ca 0.70 0.97 0.02 0.00 -1.02 0.00 0.00 52.86 53.53 3g6j s ASN 1481Cb -0.22 -2.53 -0.00 0.00 0.02 0.00 0.00 41.25 38.52 3g6j s ASN 1481CO 0.32 -1.65 -0.05 -1.59 0.02 0.00 0.00 177.10 174.14 3g6j s LYS 1482N 5.47 0.45 -0.13 -0.60 -2.85 -1.26 0.38 119.74 121.19 3g6j s LYS 1482Ca 0.70 -0.18 -0.18 0.00 -1.00 0.00 0.00 55.97 55.31 3g6j s LYS 1482Cb -0.17 -0.44 -0.04 0.00 -2.06 0.00 0.00 37.83 35.12 3g6j s LYS 1482CO 0.32 0.10 0.48 -1.17 0.10 0.00 0.00 175.35 175.18 3g6j s LEU 1483N -0.05 4.26 0.01 2.77 2.96 -0.34 -4.91 118.68 123.38 3g6j s LEU 1483Ca 0.01 0.80 0.02 0.00 -0.22 0.00 0.00 54.13 54.74 3g6j s LEU 1483Cb -0.03 -2.69 -0.01 0.00 0.50 0.00 0.00 46.19 43.96 3g6j s LEU 1483CO -0.00 -0.02 -0.06 0.00 -1.32 0.00 0.00 176.35 174.95 3g6j s ARG 1485N -0.64 0.53 5.49 0.00 3.52 -1.13 -5.05 118.95 121.67 3g6j s ARG 1485Ca -0.02 1.29 0.00 0.00 -0.13 0.00 0.00 55.73 56.87 3g6j s ARG 1485Cb -0.05 0.60 0.00 0.00 -1.56 0.00 0.00 34.95 33.94 3g6j s ARG 1485CO 0.00 -0.20 0.00 -0.25 -0.81 0.00 0.00 175.30 174.04 3g6j n ASP 1486N 5.21 0.00 -0.08 -2.12 8.00 -1.26 -3.58 116.55 122.73 3g6j n ASP 1486Ca -0.13 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.23 3g6j n ASP 1486Cb 0.51 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.51 3g6j n ASP 1486CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3g6j h GLU 1487N 0.00 0.00 -6.25 -1.24 5.08 -1.98 -3.48 114.58 106.71 3g6j h GLU 1487Ca 0.00 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.91 3g6j h GLU 1487Cb 0.00 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 3g6j h GLU 1487CO 0.00 0.82 -0.39 -0.48 -1.00 0.00 0.00 179.01 177.96 3g6j s LEU 1488N -8.16 4.17 0.01 1.33 2.34 -1.23 -4.97 118.68 112.16 3g6j s LEU 1488Ca -0.19 -0.04 -0.03 0.00 0.06 0.00 0.00 54.13 53.93 3g6j s LEU 1488Cb 0.00 -2.81 -0.01 0.00 -0.56 0.00 0.00 46.19 42.81 3g6j s LEU 1488CO 0.55 -0.23 0.04 0.00 -1.06 0.00 0.00 176.35 175.65 3g6j s ARG 1490N -1.14 2.34 -0.13 0.00 1.81 0.19 -4.95 118.95 117.07 3g6j s ARG 1490Ca -0.12 -0.88 -0.25 0.00 -1.72 0.00 0.00 55.73 52.76 3g6j s ARG 1490Cb -0.07 -2.40 -0.02 0.00 -0.45 0.00 0.00 34.95 32.00 3g6j s ARG 1490CO 0.00 0.55 0.78 0.00 -0.68 0.00 0.00 175.30 175.95 3g6j n ALA 1492N 4.66 2.79 0.31 0.00 0.00 0.16 -4.31 120.51 124.11 3g6j n ALA 1492Ca 0.02 -0.63 0.17 0.00 0.00 0.00 0.00 53.44 52.99 3g6j n ALA 1492Cb 0.50 -0.87 0.69 0.00 0.00 0.00 0.00 19.45 19.77 3g6j n ALA 1492CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3g6j h GLU 1493N 3.66 0.00 -7.00 0.00 4.39 -1.91 -3.45 114.58 110.28 3g6j h GLU 1493Ca 0.00 0.00 -0.41 0.00 0.34 0.00 0.00 59.36 59.29 3g6j h GLU 1493Cb 0.85 0.00 0.22 0.00 -0.10 0.00 0.00 28.75 29.72 3g6j h GLU 1493CO 0.00 0.00 -0.16 -0.85 -1.16 0.00 0.00 179.01 176.84 3g6j n GLU 1494N -2.89 -3.18 -1.63 2.33 0.28 -1.26 -4.96 120.64 109.32 3g6j n GLU 1494Ca 0.01 -0.92 -0.37 0.00 -0.16 0.00 0.00 57.16 55.72 3g6j n GLU 1494Cb 0.26 -2.04 0.06 0.00 1.43 0.00 0.00 31.44 31.16 3g6j n GLU 1494CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 3g6j n ASN 1495N -4.90 1.22 -0.11 -1.84 3.02 -1.26 -4.88 115.26 106.52 3g6j n ASN 1495Ca 0.05 0.79 -0.11 0.00 -0.03 0.00 0.00 54.58 55.28 3g6j n ASN 1495Cb 0.56 -1.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.24 3g6j n ASN 1495CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3g6j s PHE 1497N -5.00 0.03 -0.00 0.00 -0.12 -1.25 -3.67 117.98 107.96 3g6j s PHE 1497Ca -0.13 -0.46 -0.30 0.00 -0.05 0.00 0.00 56.93 55.99 3g6j s PHE 1497Cb 0.09 0.71 -0.08 0.00 -0.63 0.00 0.00 43.02 43.10 3g6j s PHE 1497CO 0.77 -1.01 2.00 0.42 -0.05 0.00 0.00 175.22 177.35 3g6j s ILE 1498N -2.45 3.03 -0.00 -4.49 1.01 -0.98 -4.76 121.20 112.56 3g6j s ILE 1498Ca 0.19 0.04 -0.06 0.00 0.00 0.00 0.00 60.65 60.82 3g6j s ILE 1498Cb -0.03 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.39 3g6j s ILE 1498CO 0.06 -0.01 0.67 0.06 0.00 0.00 0.00 174.94 175.72 3g6j h GLN 1499N 11.26 -0.19 -2.84 2.79 3.07 -1.93 -3.44 115.11 123.82 3g6j h GLN 1499Ca -0.48 0.01 0.04 0.00 0.09 0.00 0.00 58.65 58.32 3g6j h GLN 1499Cb 1.24 0.04 -0.01 0.00 0.08 0.00 0.00 27.48 28.83 3g6j h GLN 1499CO 0.94 -0.13 0.38 0.21 0.09 0.00 0.00 178.83 180.32 3g6j s LYS 1500N -2.67 1.92 0.00 0.06 2.20 -1.26 -5.12 119.74 114.86 3g6j s LYS 1500Ca -0.03 -1.23 0.00 0.00 -0.36 0.00 0.00 55.97 54.35 3g6j s LYS 1500Cb 0.00 0.54 0.00 0.00 -1.51 0.00 0.00 37.83 36.86 3g6j s LYS 1500CO 0.09 -0.90 0.00 -3.47 -0.36 0.00 0.00 175.35 170.71 3g6j n ASP 1503N -1.31 0.00 -4.55 1.43 4.64 -1.26 -4.94 116.55 110.55 3g6j n ASP 1503Ca -0.06 0.00 -0.36 0.00 -1.38 0.00 0.00 54.79 52.99 3g6j n ASP 1503Cb 0.60 0.00 -0.03 0.00 -1.04 0.00 0.00 41.12 40.64 3g6j n ASP 1503CO 0.00 0.00 0.00 -1.59 -0.82 0.00 0.00 177.20 174.79 3g6j s LYS 1504N 0.00 2.36 -0.48 -0.67 -2.85 -1.26 -4.89 119.74 111.95 3g6j s LYS 1504Ca 0.00 0.88 0.03 0.00 -1.00 0.00 0.00 55.97 55.88 3g6j s LYS 1504Cb 0.00 -4.52 0.13 0.00 -2.06 0.00 0.00 37.83 31.38 3g6j s LYS 1504CO 0.00 -3.07 0.25 0.08 0.10 0.00 0.00 175.35 172.70 3g6j s VAL 1505N 10.68 2.04 0.89 1.79 1.01 -1.26 -5.10 120.40 130.45 3g6j s VAL 1505Ca 0.81 -2.95 -0.11 0.00 0.00 0.00 0.00 61.98 59.73 3g6j s VAL 1505Cb -0.14 -2.42 0.13 0.00 0.00 0.00 0.00 36.38 33.94 3g6j s VAL 1505CO 0.21 -0.84 1.11 -0.89 0.00 0.00 0.00 175.10 174.69 3g6j s THR 1506N 0.03 2.58 0.18 3.92 2.01 -1.26 -4.94 115.64 118.16 3g6j s THR 1506Ca 0.17 0.19 -0.13 0.00 0.31 0.00 0.00 61.69 62.23 3g6j s THR 1506Cb -0.25 -2.45 0.09 0.00 0.01 0.00 0.00 72.50 69.90 3g6j s THR 1506CO -0.00 -0.25 1.74 0.25 -0.69 0.00 0.00 174.62 175.67 3g6j h LEU 1507N -1.65 0.14 -1.05 4.42 6.46 -1.96 -2.87 115.31 118.80 3g6j h LEU 1507Ca -0.46 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.38 3g6j h LEU 1507Cb 1.26 0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 41.21 3g6j h LEU 1507CO 0.48 0.11 0.64 -0.08 -0.62 0.00 0.00 178.44 178.97 3g6j h GLU 1508N 0.32 1.26 0.15 1.25 4.81 -1.98 -1.51 114.58 118.88 3g6j h GLU 1508Ca 0.24 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.38 3g6j h GLU 1508Cb 0.27 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.36 3g6j h GLU 1508CO -0.26 0.83 -0.07 0.93 -0.73 0.00 0.00 179.01 179.71 3g6j h GLU 1509N 1.29 -0.19 0.24 1.92 4.39 -1.88 -1.15 114.58 119.21 3g6j h GLU 1509Ca 0.36 0.01 0.00 0.00 0.34 0.00 0.00 59.36 60.08 3g6j h GLU 1509Cb -0.12 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.56 3g6j h GLU 1509CO -0.09 -0.06 -0.24 0.00 -1.16 0.00 0.00 179.01 177.47 3g6j h ARG 1510N -0.28 -0.49 -0.90 2.33 3.08 -1.35 0.18 114.38 116.94 3g6j h ARG 1510Ca -0.02 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.17 3g6j h ARG 1510Cb 0.22 0.11 -0.08 0.00 0.08 0.00 0.00 29.97 30.31 3g6j h ARG 1510CO 0.03 -0.33 0.54 -0.07 -1.07 0.00 0.00 179.97 179.08 3g6j h LEU 1511N -0.51 0.79 0.28 3.04 3.38 -1.22 0.22 115.31 121.28 3g6j h LEU 1511Ca -0.00 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 3g6j h LEU 1511Cb 0.48 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3g6j h LEU 1511CO -0.05 0.44 -0.13 0.44 0.09 0.00 0.00 178.44 179.23 3g6j h ASP 1512N 0.89 -0.31 -0.88 -0.43 3.32 -0.91 -2.01 116.42 116.09 3g6j h ASP 1512Ca 0.44 -0.18 0.07 0.00 0.02 0.00 0.00 57.03 57.37 3g6j h ASP 1512Cb 0.40 0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.97 3g6j h ASP 1512CO -0.25 0.04 0.57 0.11 -1.72 0.00 0.00 179.24 177.99 3g6j h LYS 1513N -0.70 0.93 0.00 3.56 1.57 -0.21 -2.01 116.57 119.72 3g6j h LYS 1513Ca -0.04 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.60 3g6j h LYS 1513Cb 0.48 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 3g6j h LYS 1513CO 0.06 0.62 -0.42 0.00 -0.57 0.00 0.00 179.45 179.14 3g6j h ALA 1514N 1.53 0.75 -0.00 3.86 0.00 -0.62 -3.29 119.26 121.49 3g6j h ALA 1514Ca 0.38 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3g6j h ALA 1514Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3g6j h ALA 1514CO -0.15 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 179.47 3g6j s GLU 1516N -2.53 4.24 0.42 0.00 2.02 -1.15 -4.91 118.70 116.79 3g6j s GLU 1516Ca 0.26 2.12 0.29 0.00 0.02 0.00 0.00 54.97 57.66 3g6j s GLU 1516Cb 0.20 -2.95 1.30 0.00 0.10 0.00 0.00 34.13 32.78 3g6j s GLU 1516CO 0.50 -0.25 1.88 -1.00 0.02 0.00 0.00 175.26 176.41 3g6j h PRO 1517N 3.14 0.00 -0.67 0.39 0.13 -1.93 -2.22 132.00 130.83 3g6j h PRO 1517Ca -0.49 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 3g6j h PRO 1517Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 3g6j h PRO 1517CO 0.64 0.00 0.36 0.78 -0.23 0.00 0.00 178.00 179.55 3g6j h GLY 1518N 1.70 0.99 -7.18 1.56 0.00 -1.95 -3.39 103.07 94.80 3g6j h GLY 1518Ca 0.00 -0.44 -0.54 0.00 0.00 0.00 0.00 47.33 46.35 3g6j h GLY 1518CO 0.00 0.43 1.22 0.14 0.00 0.00 0.00 176.54 178.33 3g6j s VAL 1519N -5.60 3.58 0.02 4.60 1.01 -0.84 -4.32 120.40 118.85 3g6j s VAL 1519Ca -0.11 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.16 3g6j s VAL 1519Cb 0.17 -4.12 -0.22 0.00 0.00 0.00 0.00 36.38 32.21 3g6j s VAL 1519CO 0.79 -0.94 1.13 -0.78 0.00 0.00 0.00 175.10 175.30 3g6j h ASP 1520N 12.73 0.58 -3.29 3.32 1.82 -1.70 -3.47 116.42 126.40 3g6j h ASP 1520Ca -0.28 -0.73 -0.45 0.00 -0.39 0.00 0.00 57.03 55.18 3g6j h ASP 1520Cb 1.13 -0.18 -0.15 0.00 0.68 0.00 0.00 39.33 40.82 3g6j h ASP 1520CO 1.16 1.24 -0.74 -0.72 -1.61 0.00 0.00 179.24 178.57 3g6j s TYR 1521N -3.32 1.69 -0.20 0.28 -0.85 -1.25 -3.37 117.35 110.34 3g6j s TYR 1521Ca -0.13 -0.57 -0.05 0.00 -0.52 0.00 0.00 57.07 55.81 3g6j s TYR 1521Cb 0.04 -0.80 0.10 0.00 0.38 0.00 0.00 41.96 41.69 3g6j s TYR 1521CO 0.83 0.34 0.37 0.08 -1.52 0.00 0.00 175.55 175.65 3g6j s VAL 1522N -2.86 -0.58 0.08 -3.49 1.01 -0.80 -4.23 120.40 109.53 3g6j s VAL 1522Ca 0.21 0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.34 3g6j s VAL 1522Cb -0.01 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.65 3g6j s VAL 1522CO 0.06 -0.01 -0.16 -0.31 0.00 0.00 0.00 175.10 174.69 3g6j s TYR 1523N 2.55 1.38 -0.27 5.22 2.02 -0.51 -1.44 117.35 126.29 3g6j s TYR 1523Ca 0.05 -0.46 -0.18 0.00 -0.37 0.00 0.00 57.07 56.11 3g6j s TYR 1523Cb -0.13 -0.76 -0.02 0.00 -0.40 0.00 0.00 41.96 40.64 3g6j s TYR 1523CO -0.13 0.10 0.53 0.21 -1.57 0.00 0.00 175.55 174.69 3g6j s LYS 1524N -1.86 4.01 0.41 -0.62 2.20 -1.01 -1.51 119.74 121.36 3g6j s LYS 1524Ca 0.01 0.28 0.08 0.00 -0.36 0.00 0.00 55.97 55.98 3g6j s LYS 1524Cb -0.10 -3.67 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 3g6j s LYS 1524CO 0.03 -0.40 0.25 0.95 -0.36 0.00 0.00 175.35 175.82 3g6j s THR 1525N 2.35 2.49 -0.12 3.43 -4.23 0.37 -0.82 115.64 119.11 3g6j s THR 1525Ca 0.21 -1.57 -0.02 0.00 -1.18 0.00 0.00 61.69 59.13 3g6j s THR 1525Cb -0.16 -3.00 0.04 0.00 1.34 0.00 0.00 72.50 70.73 3g6j s THR 1525CO 0.10 -0.02 0.02 -0.60 -0.54 0.00 0.00 174.62 173.58 3g6j s ARG 1526N -3.98 0.57 -0.39 3.99 3.52 0.52 -1.74 118.95 121.44 3g6j s ARG 1526Ca 0.43 -0.06 -0.28 0.00 -0.13 0.00 0.00 55.73 55.69 3g6j s ARG 1526Cb 0.01 -1.38 -0.02 0.00 -1.56 0.00 0.00 34.95 32.00 3g6j s ARG 1526CO 0.24 -0.43 1.82 -1.17 -0.81 0.00 0.00 175.30 174.95 3g6j s LEU 1527N 1.95 3.46 -0.12 -0.88 2.96 -0.39 -1.35 118.68 124.32 3g6j s LEU 1527Ca 0.03 1.09 -0.13 0.00 -0.22 0.00 0.00 54.13 54.90 3g6j s LEU 1527Cb -0.14 -3.28 -0.12 0.00 0.50 0.00 0.00 46.19 43.15 3g6j s LEU 1527CO -0.06 -1.87 0.36 0.58 -1.32 0.00 0.00 176.35 174.03 3g6j h VAL 1528N 6.84 0.81 -3.86 1.68 2.07 -1.43 0.32 116.25 122.68 3g6j h VAL 1528Ca -0.32 -1.60 -0.35 0.00 0.82 0.00 0.00 66.70 65.25 3g6j h VAL 1528Cb 1.17 1.53 -0.29 0.00 -1.52 0.00 0.00 31.29 32.18 3g6j h VAL 1528CO 1.07 0.27 -0.76 -0.75 0.02 0.00 0.00 177.57 177.43 3g6j s LYS 1529N -1.88 0.54 -0.49 1.57 2.20 -1.15 -4.56 119.74 115.98 3g6j s LYS 1529Ca -0.09 -0.20 0.01 0.00 -0.36 0.00 0.00 55.97 55.33 3g6j s LYS 1529Cb -0.01 -0.54 0.13 0.00 -1.51 0.00 0.00 37.83 35.90 3g6j s LYS 1529CO 0.31 0.10 0.25 0.08 -0.36 0.00 0.00 175.35 175.73 3g6j s VAL 1530N 0.03 2.95 -0.55 4.02 1.01 -1.26 -1.10 120.40 125.49 3g6j s VAL 1530Ca 0.00 -2.76 -0.22 0.00 0.00 0.00 0.00 61.98 59.00 3g6j s VAL 1530Cb -0.04 -3.03 0.05 0.00 0.00 0.00 0.00 36.38 33.36 3g6j s VAL 1530CO -0.00 -0.75 0.83 -1.10 0.00 0.00 0.00 175.10 174.08 3g6j s GLN 1531N 0.31 3.22 0.94 2.72 -0.21 -1.11 -5.02 119.66 120.51 3g6j s GLN 1531Ca 0.14 -0.60 -0.14 0.00 0.02 0.00 0.00 55.36 54.78 3g6j s GLN 1531Cb -0.22 -4.10 0.16 0.00 1.00 0.00 0.00 33.01 29.85 3g6j s GLN 1531CO -0.04 -1.45 1.18 -0.51 -2.12 0.00 0.00 175.29 172.35 3g6j s LEU 1532N 3.49 2.08 0.28 2.90 1.02 -1.26 -1.74 118.68 125.45 3g6j s LEU 1532Ca 0.23 0.74 -0.19 0.00 0.02 0.00 0.00 54.13 54.93 3g6j s LEU 1532Cb -0.16 -2.95 0.07 0.00 0.02 0.00 0.00 46.19 43.17 3g6j s LEU 1532CO 0.15 -2.68 0.93 -0.55 0.02 0.00 0.00 176.35 174.22 3g6j s SER 1533N -4.30 0.02 0.02 2.29 0.15 -1.26 -4.84 113.70 105.78 3g6j s SER 1533Ca 0.67 -0.90 0.15 0.00 0.70 0.00 0.00 55.95 56.56 3g6j s SER 1533Cb -0.11 0.66 -0.17 0.00 -1.71 0.00 0.00 66.02 64.68 3g6j s SER 1533CO 0.53 -1.31 0.78 0.78 1.20 0.00 0.00 173.24 175.22 3g6j h ASN 1534N 2.00 0.00 0.00 5.45 2.35 -2.02 -3.44 115.58 119.92 3g6j h ASN 1534Ca -0.30 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 3g6j h ASN 1534Cb 1.23 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.60 3g6j h ASN 1534CO 0.39 0.77 -0.03 -0.90 -1.65 0.00 0.00 177.43 176.01 3g6j n ASP 1535N -2.98 0.08 -4.21 5.81 5.75 -1.26 -4.84 116.55 114.91 3g6j n ASP 1535Ca -0.12 0.01 -0.34 0.00 -0.01 0.00 0.00 54.79 54.33 3g6j n ASP 1535Cb 0.93 -0.31 -0.15 0.00 -1.03 0.00 0.00 41.12 40.57 3g6j n ASP 1535CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3g6j s PHE 1536N -1.08 2.89 0.25 2.11 -0.12 -1.26 -1.89 117.98 118.87 3g6j s PHE 1536Ca -0.01 -1.34 -0.26 0.00 -0.05 0.00 0.00 56.93 55.27 3g6j s PHE 1536Cb 0.00 -2.01 -0.09 0.00 -0.63 0.00 0.00 43.02 40.29 3g6j s PHE 1536CO 0.01 -0.69 0.88 -0.51 -0.05 0.00 0.00 175.22 174.86 3g6j s ASP 1537N 1.37 7.42 0.06 1.98 1.01 -0.14 -4.45 116.67 123.93 3g6j s ASP 1537Ca 0.05 1.78 0.05 0.00 0.71 0.00 0.00 52.55 55.14 3g6j s ASP 1537Cb -0.14 -2.55 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 3g6j s ASP 1537CO -0.08 0.09 -0.07 -1.61 0.21 0.00 0.00 175.17 173.70 3g6j s GLU 1538N -1.54 2.36 -0.15 8.23 2.02 -0.71 -1.28 118.70 127.63 3g6j s GLU 1538Ca 0.43 -0.88 -0.02 0.00 0.02 0.00 0.00 54.97 54.53 3g6j s GLU 1538Cb -0.22 -2.41 0.05 0.00 0.10 0.00 0.00 34.13 31.64 3g6j s GLU 1538CO 0.27 0.55 -0.00 0.71 0.02 0.00 0.00 175.26 176.80 3g6j s TYR 1539N -1.14 1.18 -0.46 1.61 2.02 0.92 -2.76 117.35 118.73 3g6j s TYR 1539Ca 0.20 -0.76 -0.24 0.00 -0.37 0.00 0.00 57.07 55.90 3g6j s TYR 1539Cb -0.11 -1.07 0.03 0.00 -0.40 0.00 0.00 41.96 40.40 3g6j s TYR 1539CO 0.12 -0.54 0.85 0.42 -1.57 0.00 0.00 175.55 174.83 3g6j s ILE 1540N 1.81 4.56 -0.23 2.71 1.09 -0.26 -0.15 121.20 130.72 3g6j s ILE 1540Ca 0.01 0.56 -0.07 0.00 -1.10 0.00 0.00 60.65 60.05 3g6j s ILE 1540Cb -0.15 -4.38 -0.03 0.00 -1.06 0.00 0.00 42.46 36.84 3g6j s ILE 1540CO -0.07 -0.78 0.07 -0.04 -0.10 0.00 0.00 174.94 174.02 3g6j s MET 1541N 3.52 3.74 0.16 2.79 -1.94 0.17 -1.07 119.30 126.66 3g6j s MET 1541Ca 0.33 -0.44 -0.30 0.00 -1.71 0.00 0.00 55.69 53.57 3g6j s MET 1541Cb -0.11 -3.30 -0.07 0.00 2.01 0.00 0.00 34.83 33.36 3g6j s MET 1541CO 0.24 -0.07 0.95 0.00 -0.01 0.00 0.00 175.02 176.14 3g6j s ALA 1542N 1.30 3.28 -0.58 3.03 0.00 -0.45 -1.27 121.76 127.07 3g6j s ALA 1542Ca 0.05 0.59 -0.18 0.00 0.00 0.00 0.00 51.96 52.42 3g6j s ALA 1542Cb -0.15 -3.25 0.10 0.00 0.00 0.00 0.00 23.12 19.82 3g6j s ALA 1542CO 0.04 0.06 0.67 0.42 0.00 0.00 0.00 175.76 176.95 3g6j s ILE 1543N -0.44 4.88 0.09 0.00 1.01 -0.96 -0.35 121.20 125.41 3g6j s ILE 1543Ca 0.45 -1.04 -0.18 0.00 0.00 0.00 0.00 60.65 59.88 3g6j s ILE 1543Cb -0.24 -4.46 -0.08 0.00 0.01 0.00 0.00 42.46 37.69 3g6j s ILE 1543CO 0.31 -1.07 1.50 -0.33 0.00 0.00 0.00 174.94 175.34 3g6j h GLU 1544N 9.14 0.49 -2.65 2.79 4.39 -1.28 -1.32 114.58 126.13 3g6j h GLU 1544Ca -0.29 -0.17 -0.11 0.00 0.34 0.00 0.00 59.36 59.12 3g6j h GLU 1544Cb 1.09 -0.03 -0.24 0.00 -0.10 0.00 0.00 28.75 29.46 3g6j h GLU 1544CO 1.09 0.68 -0.22 1.14 -1.16 0.00 0.00 179.01 180.54 3g6j s GLN 1545N -4.86 0.49 -1.05 2.33 -2.07 -1.11 -4.73 119.66 108.65 3g6j s GLN 1545Ca -0.13 0.67 -0.18 0.00 -1.82 0.00 0.00 55.36 53.89 3g6j s GLN 1545Cb 0.08 0.18 0.12 0.00 -1.09 0.00 0.00 33.01 32.29 3g6j s GLN 1545CO 0.76 -0.09 1.33 0.95 -1.32 0.00 0.00 175.29 176.92 3g6j s THR 1546N 0.56 4.56 0.03 3.63 -4.23 -1.26 -2.41 115.64 116.51 3g6j s THR 1546Ca -0.03 -1.68 -0.25 0.00 -1.18 0.00 0.00 61.69 58.55 3g6j s THR 1546Cb -0.04 -4.92 -0.18 0.00 1.34 0.00 0.00 72.50 68.70 3g6j s THR 1546CO -0.03 -1.68 1.43 0.40 -0.54 0.00 0.00 174.62 174.20 3g6j h ILE 1547N 5.74 1.04 -3.19 2.99 2.04 -1.70 -3.41 117.51 121.03 3g6j h ILE 1547Ca 0.23 -0.58 -0.54 0.00 1.00 0.00 0.00 64.86 64.97 3g6j h ILE 1547Cb 0.97 1.41 -0.36 0.00 -0.74 0.00 0.00 36.82 38.10 3g6j h ILE 1547CO 1.25 0.14 -0.81 -0.75 0.00 0.00 0.00 178.15 177.98 3g6j s LYS 1548N -5.08 1.70 0.10 2.37 2.47 -0.52 -4.69 119.74 116.09 3g6j s LYS 1548Ca -0.15 -0.33 -0.08 0.00 -1.56 0.00 0.00 55.97 53.86 3g6j s LYS 1548Cb 0.03 -1.68 -0.06 0.00 -1.46 0.00 0.00 37.83 34.67 3g6j s LYS 1548CO 0.64 -0.23 0.38 -1.12 0.16 0.00 0.00 175.35 175.18 3g6j s SER 1549N 1.57 6.57 0.00 1.43 0.01 -1.26 -1.90 113.70 120.12 3g6j s SER 1549Ca 0.03 0.70 0.00 0.00 1.31 0.00 0.00 55.95 57.99 3g6j s SER 1549Cb -0.13 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 63.96 3g6j s SER 1549CO -0.08 0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.31 3g6j n GLY 1550N 0.58 5.38 0.37 3.44 0.00 -1.22 -4.83 105.19 108.91 3g6j n GLY 1550Ca -0.06 -1.37 0.04 0.00 0.00 0.00 0.00 46.02 44.63 3g6j n GLY 1550CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3g6j h SER 1551N 0.00 0.97 -3.43 1.61 0.87 -1.99 -3.34 113.55 108.23 3g6j h SER 1551Ca 0.00 0.01 -0.57 0.00 -1.23 0.00 0.00 61.79 60.00 3g6j h SER 1551Cb 0.00 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 61.70 3g6j h SER 1551CO 0.00 0.61 0.89 -0.62 -0.53 0.00 0.00 176.83 177.19 3g6j s ASP 1552N -5.95 6.79 -1.03 6.23 3.68 -1.26 -4.94 116.67 120.20 3g6j s ASP 1552Ca -0.12 0.86 -0.03 0.00 2.13 0.00 0.00 52.55 55.39 3g6j s ASP 1552Cb 0.20 -2.55 0.22 0.00 -1.45 0.00 0.00 42.92 39.34 3g6j s ASP 1552CO 0.81 -1.04 2.18 -0.62 0.13 0.00 0.00 175.17 176.63 3g6j n GLU 1553N 7.27 4.36 -1.57 4.34 1.02 -1.26 -4.98 120.64 129.82 3g6j n GLU 1553Ca 0.12 -3.76 -0.32 0.00 -0.02 0.00 0.00 57.16 53.18 3g6j n GLU 1553Cb 0.48 -2.45 0.06 0.00 -0.02 0.00 0.00 31.44 29.51 3g6j n GLU 1553CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3g6j s VAL 1554N -3.05 3.33 0.05 2.62 0.11 -1.26 -5.06 120.40 117.15 3g6j s VAL 1554Ca 0.49 0.54 0.09 0.00 -2.93 0.00 0.00 61.98 60.17 3g6j s VAL 1554Cb 0.25 -3.05 -0.03 0.00 -1.53 0.00 0.00 36.38 32.02 3g6j s VAL 1554CO -0.17 -0.46 -0.26 -1.58 -3.33 0.00 0.00 175.10 169.30 3g6j s GLN 1555N -4.44 1.72 0.04 1.54 2.00 -1.26 -5.00 119.66 114.26 3g6j s GLN 1555Ca 0.64 -1.11 -0.37 0.00 -2.00 0.00 0.00 55.36 52.53 3g6j s GLN 1555Cb -0.19 -1.92 -0.16 0.00 0.80 0.00 0.00 33.01 31.55 3g6j s GLN 1555CO 0.47 0.49 1.45 0.28 -0.50 0.00 0.00 175.29 177.49 3g6j n VAL 1556N 1.72 0.07 0.00 1.34 0.31 -1.26 -1.56 118.33 118.94 3g6j n VAL 1556Ca -0.17 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.15 3g6j n VAL 1556Cb 0.52 -1.02 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 3g6j n VAL 1556CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3g6j n GLY 1557N 2.96 2.79 3.72 2.92 0.00 -0.50 -5.02 105.19 112.06 3g6j n GLY 1557Ca 0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 3g6j n GLY 1557CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g6j s GLN 1558N -0.21 0.98 0.13 1.61 -0.21 -0.60 -4.71 119.66 116.65 3g6j s GLN 1558Ca 0.00 0.58 0.09 0.00 0.02 0.00 0.00 55.36 56.06 3g6j s GLN 1558Cb 0.00 -1.80 -0.04 0.00 1.00 0.00 0.00 33.01 32.17 3g6j s GLN 1558CO 0.00 -2.37 -0.18 -0.65 -2.12 0.00 0.00 175.29 169.97 3g6j s GLN 1559N -5.03 1.78 0.02 2.91 -0.21 -1.26 -2.28 119.66 115.59 3g6j s GLN 1559Ca 0.64 -1.24 -0.04 0.00 0.02 0.00 0.00 55.36 54.74 3g6j s GLN 1559Cb -0.17 -2.08 -0.01 0.00 1.00 0.00 0.00 33.01 31.74 3g6j s GLN 1559CO 0.56 0.46 0.06 1.03 -2.12 0.00 0.00 175.29 175.29 3g6j s ARG 1560N -2.29 0.47 -0.21 2.91 1.81 -0.40 -4.97 118.95 116.27 3g6j s ARG 1560Ca 0.19 -0.63 -0.07 0.00 -1.72 0.00 0.00 55.73 53.51 3g6j s ARG 1560Cb -0.10 0.18 -0.03 0.00 -0.45 0.00 0.00 34.95 34.55 3g6j s ARG 1560CO 0.11 -0.10 0.05 0.99 -0.68 0.00 0.00 175.30 175.66 3g6j s THR 1561N -1.94 4.41 -0.17 0.02 2.01 -1.26 0.41 115.64 119.12 3g6j s THR 1561Ca -0.11 -0.16 -0.06 0.00 0.31 0.00 0.00 61.69 61.68 3g6j s THR 1561Cb -0.05 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.41 3g6j s THR 1561CO -0.02 0.41 0.03 -0.36 -0.69 0.00 0.00 174.62 173.99 3g6j s PHE 1562N 0.96 3.19 -0.03 4.92 0.40 0.78 -1.07 117.98 127.14 3g6j s PHE 1562Ca 0.03 -0.01 -0.01 0.00 -0.60 0.00 0.00 56.93 56.34 3g6j s PHE 1562Cb -0.14 -2.02 -0.04 0.00 0.51 0.00 0.00 43.02 41.33 3g6j s PHE 1562CO 0.03 0.14 0.08 0.42 0.70 0.00 0.00 175.22 176.58 3g6j s ILE 1563N 0.26 4.75 -0.10 0.64 1.01 0.24 -0.05 121.20 127.94 3g6j s ILE 1563Ca 0.02 -0.33 -0.17 0.00 0.00 0.00 0.00 60.65 60.18 3g6j s ILE 1563Cb -0.13 -3.14 0.04 0.00 0.01 0.00 0.00 42.46 39.24 3g6j s ILE 1563CO 0.01 0.41 0.41 -0.55 0.00 0.00 0.00 174.94 175.23 3g6j s SER 1564N -1.55 -0.38 0.66 3.58 0.15 -0.40 -1.01 113.70 114.75 3g6j s SER 1564Ca 0.21 0.58 -0.17 0.00 0.70 0.00 0.00 55.95 57.26 3g6j s SER 1564Cb -0.12 0.65 -0.00 0.00 -1.71 0.00 0.00 66.02 64.83 3g6j s SER 1564CO 0.11 -0.30 1.26 -2.84 1.20 0.00 0.00 173.24 172.68 3g6j s PRO 1565N -0.46 2.50 0.35 5.44 0.02 -1.26 -0.96 135.00 140.63 3g6j s PRO 1565Ca -0.06 1.97 0.04 0.00 0.02 0.00 0.00 61.00 62.97 3g6j s PRO 1565Cb -0.03 -1.85 0.68 0.00 0.02 0.00 0.00 34.50 33.31 3g6j s PRO 1565CO 0.03 -1.61 1.98 0.97 -0.33 0.00 0.00 177.00 178.03 3g6j h ILE 1566N 0.39 1.08 0.00 2.83 -0.00 -1.70 -1.67 117.51 118.45 3g6j h ILE 1566Ca -0.50 -0.28 0.00 0.00 -0.00 0.00 0.00 64.86 64.08 3g6j h ILE 1566Cb 1.32 0.19 0.00 0.00 -0.00 0.00 0.00 36.82 38.33 3g6j h ILE 1566CO 0.52 0.15 0.00 2.29 -0.00 0.00 0.00 178.15 181.12 3g6j n LYS 1567N -4.46 0.12 -0.11 2.19 -0.00 -1.26 -1.73 118.16 112.91 3g6j n LYS 1567Ca 0.09 0.47 0.11 0.00 -0.00 0.00 0.00 58.31 58.98 3g6j n LYS 1567Cb 0.15 -1.79 0.32 0.00 -0.00 0.00 0.00 35.03 33.71 3g6j n LYS 1567CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 3g6j h ARG 1569N 2.76 -0.63 0.00 0.00 2.43 -1.46 -2.30 114.38 115.19 3g6j h ARG 1569Ca 0.00 0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.13 3g6j h ARG 1569Cb 0.61 0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.29 3g6j h ARG 1569CO 0.00 -0.37 -0.41 1.49 -1.51 0.00 0.00 179.97 179.17 3g6j h GLU 1570N -0.78 0.00 -0.23 0.20 4.81 -1.83 -2.92 114.58 113.84 3g6j h GLU 1570Ca -0.07 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.00 3g6j h GLU 1570Cb 0.56 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 3g6j h GLU 1570CO 0.11 0.41 -0.53 0.00 -0.73 0.00 0.00 179.01 178.27 3g6j h ALA 1571N 1.59 0.64 -0.12 2.92 0.00 -1.83 -3.25 119.26 119.21 3g6j h ALA 1571Ca -0.00 -0.50 -0.23 0.00 0.00 0.00 0.00 54.91 54.17 3g6j h ALA 1571Cb 1.29 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 19.00 3g6j h ALA 1571CO 0.05 0.68 -0.84 -0.07 0.00 0.00 0.00 179.25 179.08 3g6j h LEU 1572N 0.51 0.93 -0.67 0.00 3.38 -1.44 -3.48 115.31 114.55 3g6j h LEU 1572Ca 0.02 -0.64 -0.41 0.00 0.09 0.00 0.00 57.88 56.94 3g6j h LEU 1572Cb 1.09 -0.28 0.12 0.00 0.09 0.00 0.00 40.66 41.68 3g6j h LEU 1572CO 0.11 1.44 -0.68 0.29 0.09 0.00 0.00 178.44 179.69 3g6j n LYS 1573N -3.91 -7.50 -2.45 1.13 5.02 -1.10 -4.92 118.16 104.42 3g6j n LYS 1573Ca -0.08 0.82 -0.43 0.00 -2.02 0.00 0.00 58.31 56.60 3g6j n LYS 1573Cb 0.78 -5.85 -0.02 0.00 -0.02 0.00 0.00 35.03 29.92 3g6j n LYS 1573CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3g6j s LEU 1574N -7.25 4.13 -0.01 -0.35 1.43 -1.26 -5.01 118.68 110.35 3g6j s LEU 1574Ca 0.57 1.58 0.02 0.00 -1.03 0.00 0.00 54.13 55.27 3g6j s LEU 1574Cb -0.25 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.39 3g6j s LEU 1574CO 0.70 -0.80 -0.05 -1.61 0.23 0.00 0.00 176.35 174.82 3g6j s GLU 1575N 3.57 2.64 0.51 1.70 2.02 -1.26 -5.06 118.70 122.82 3g6j s GLU 1575Ca 0.54 -0.67 -0.22 0.00 0.02 0.00 0.00 54.97 54.64 3g6j s GLU 1575Cb -0.20 -2.56 -0.06 0.00 0.10 0.00 0.00 34.13 31.41 3g6j s GLU 1575CO 0.15 0.62 1.26 -1.21 0.02 0.00 0.00 175.26 176.10 3g6j s GLU 1576N -1.39 3.39 0.00 1.61 2.02 -1.26 -2.91 118.70 120.15 3g6j s GLU 1576Ca 0.17 2.00 0.00 0.00 0.02 0.00 0.00 54.97 57.16 3g6j s GLU 1576Cb -0.11 -2.29 0.00 0.00 0.10 0.00 0.00 34.13 31.83 3g6j s GLU 1576CO 0.08 -0.92 0.00 1.63 0.02 0.00 0.00 175.26 176.06 3g6j n LYS 1577N -0.85 -0.22 -2.90 1.61 5.02 0.11 -5.00 118.16 115.93 3g6j n LYS 1577Ca 0.09 0.06 -0.26 0.00 -2.02 0.00 0.00 58.31 56.18 3g6j n LYS 1577Cb 0.47 -3.54 -0.00 0.00 -0.02 0.00 0.00 35.03 31.93 3g6j n LYS 1577CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3g6j s LYS 1578N -0.57 3.42 0.14 1.97 1.02 -1.15 -4.85 119.74 119.72 3g6j s LYS 1578Ca 0.00 -0.07 0.06 0.00 0.02 0.00 0.00 55.97 55.98 3g6j s LYS 1578Cb 0.00 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 3g6j s LYS 1578CO 0.00 -0.14 0.01 -1.01 -0.92 0.00 0.00 175.35 173.29 3g6j s HIS 1579N -2.60 2.92 0.13 3.18 3.76 -1.26 -1.27 115.29 120.15 3g6j s HIS 1579Ca 0.46 -0.09 -0.04 0.00 -0.15 0.00 0.00 55.06 55.23 3g6j s HIS 1579Cb -0.10 -1.45 -0.03 0.00 1.11 0.00 0.00 32.58 32.11 3g6j s HIS 1579CO 0.41 0.50 0.13 0.71 -0.85 0.00 0.00 174.74 175.64 3g6j s TYR 1580N -1.55 0.60 -0.14 1.40 2.02 -0.71 -1.14 117.35 117.83 3g6j s TYR 1580Ca 0.27 -1.00 0.01 0.00 -0.37 0.00 0.00 57.07 55.98 3g6j s TYR 1580Cb -0.10 -0.29 -0.00 0.00 -0.40 0.00 0.00 41.96 41.16 3g6j s TYR 1580CO 0.19 -0.57 -0.17 -1.17 -1.57 0.00 0.00 175.55 172.26 3g6j s LEU 1581N -2.99 2.42 -0.08 -1.29 2.96 0.02 -0.48 118.68 119.24 3g6j s LEU 1581Ca 0.18 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 3g6j s LEU 1581Cb 0.06 -1.53 0.03 0.00 0.50 0.00 0.00 46.19 45.24 3g6j s LEU 1581CO -0.02 0.12 -0.03 -0.04 -1.32 0.00 0.00 176.35 175.06 3g6j s MET 1582N 0.62 0.89 0.00 1.98 -1.94 -0.57 -1.52 119.30 118.75 3g6j s MET 1582Ca -0.09 -0.03 0.00 0.00 -1.71 0.00 0.00 55.69 53.86 3g6j s MET 1582Cb -0.16 -1.10 0.00 0.00 2.01 0.00 0.00 34.83 35.58 3g6j s MET 1582CO 0.03 -0.24 0.00 0.91 -0.01 0.00 0.00 175.02 175.70 3g6j n TRP 1583N 4.85 0.00 -0.50 -0.03 5.03 -0.37 -1.42 117.44 125.01 3g6j n TRP 1583Ca -0.12 0.00 0.06 0.00 3.03 0.00 0.00 57.50 60.47 3g6j n TRP 1583Cb 0.50 0.00 -0.03 0.00 -1.03 0.00 0.00 31.31 30.75 3g6j n TRP 1583CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3g6j n GLY 1584N 3.32 -2.55 3.51 6.99 0.00 -1.26 -4.02 105.19 111.19 3g6j n GLY 1584Ca 0.00 -1.34 -0.24 0.00 0.00 0.00 0.00 46.02 44.44 3g6j n GLY 1584CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3g6j s LEU 1585N -5.45 2.18 0.24 0.99 1.43 -1.26 -2.52 118.68 114.28 3g6j s LEU 1585Ca 0.00 -1.50 0.03 0.00 -1.03 0.00 0.00 54.13 51.64 3g6j s LEU 1585Cb 0.00 -0.37 0.26 0.00 0.03 0.00 0.00 46.19 46.11 3g6j s LEU 1585CO 0.00 -0.72 1.57 0.28 0.23 0.00 0.00 176.35 177.71 3g6j h SER 1586N 1.92 0.33 0.36 2.29 0.02 -1.97 -2.74 113.55 113.75 3g6j h SER 1586Ca -0.40 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 3g6j h SER 1586Cb 1.26 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3g6j h SER 1586CO 0.67 0.82 0.00 0.77 -1.14 0.00 0.00 176.83 177.95 3g6j h SER 1587N 0.23 0.00 0.88 3.07 4.64 -1.97 -2.87 113.55 117.53 3g6j h SER 1587Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3g6j h SER 1587Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 3g6j h SER 1587CO 0.09 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.52 3g6j n ASP 1588N -2.68 0.00 -4.77 4.97 8.00 -1.03 -4.87 116.55 116.17 3g6j n ASP 1588Ca -0.01 0.42 -0.38 0.00 0.71 0.00 0.00 54.79 55.53 3g6j n ASP 1588Cb 0.14 -0.47 -0.00 0.00 -0.02 0.00 0.00 41.12 40.77 3g6j n ASP 1588CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3g6j s PHE 1589N -2.94 2.81 -0.38 1.24 0.08 -1.08 -0.84 117.98 116.87 3g6j s PHE 1589Ca 0.15 1.49 0.02 0.00 0.12 0.00 0.00 56.93 58.70 3g6j s PHE 1589Cb 0.18 -3.51 0.15 0.00 -0.57 0.00 0.00 43.02 39.27 3g6j s PHE 1589CO 0.49 -1.81 0.29 -0.46 -0.10 0.00 0.00 175.22 173.62 3g6j s TRP 1590N -1.41 0.67 -5.00 0.36 -0.11 0.32 -4.88 118.94 108.89 3g6j s TRP 1590Ca 0.62 -1.76 0.00 0.00 1.22 0.00 0.00 56.10 56.18 3g6j s TRP 1590Cb -0.33 -0.82 0.00 0.00 -1.50 0.00 0.00 33.47 30.82 3g6j s TRP 1590CO 0.41 -0.86 0.00 0.41 -4.62 0.00 0.00 176.95 172.29 3g6j n GLY 1591N 3.61 -0.33 3.49 5.86 0.00 -1.26 -1.90 105.19 114.66 3g6j n GLY 1591Ca 0.18 -1.46 -0.32 0.00 0.00 0.00 0.00 46.02 44.42 3g6j n GLY 1591CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g6j s GLU 1592N -2.00 2.46 0.21 1.61 0.41 -1.26 -4.85 118.70 115.27 3g6j s GLU 1592Ca 0.00 -0.73 -0.32 0.00 -0.41 0.00 0.00 54.97 53.51 3g6j s GLU 1592Cb 0.00 -2.37 -0.12 0.00 -1.78 0.00 0.00 34.13 29.86 3g6j s GLU 1592CO 0.00 0.61 1.73 1.17 -0.49 0.00 0.00 175.26 178.28 3g6j n LYS 1593N 2.12 2.79 0.08 1.61 4.81 -1.26 -0.10 118.16 128.21 3g6j n LYS 1593Ca -0.17 1.00 0.12 0.00 -0.87 0.00 0.00 58.31 58.39 3g6j n LYS 1593Cb 0.52 -2.85 0.03 0.00 0.02 0.00 0.00 35.03 32.75 3g6j n LYS 1593CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 3g6j n PRO 1594N 3.97 0.51 -1.46 1.64 -0.04 -1.26 -4.97 135.00 133.39 3g6j n PRO 1594Ca 0.16 0.09 -0.28 0.00 -0.04 0.00 0.00 63.50 63.44 3g6j n PRO 1594Cb 0.35 -1.77 -0.07 0.00 -0.04 0.00 0.00 33.50 31.97 3g6j n PRO 1594CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3g6j n ASN 1595N -2.48 6.83 -4.73 3.54 4.13 0.85 -4.94 115.26 118.45 3g6j n ASN 1595Ca 0.01 -2.94 -0.42 0.00 1.68 0.00 0.00 54.58 52.92 3g6j n ASN 1595Cb 0.52 -1.35 -0.03 0.00 -1.54 0.00 0.00 39.78 37.38 3g6j n ASN 1595CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3g6j s LEU 1596N -1.35 4.40 0.32 3.41 1.43 -1.16 -4.22 118.68 121.52 3g6j s LEU 1596Ca 0.61 2.44 0.07 0.00 -1.03 0.00 0.00 54.13 56.22 3g6j s LEU 1596Cb 0.30 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.89 3g6j s LEU 1596CO -0.12 -0.61 0.39 -0.44 0.23 0.00 0.00 176.35 175.81 3g6j s SER 1597N 0.58 5.76 0.10 2.29 0.01 -0.80 -4.66 113.70 116.99 3g6j s SER 1597Ca 0.60 -0.27 0.05 0.00 1.31 0.00 0.00 55.95 57.64 3g6j s SER 1597Cb -0.38 -1.20 -0.04 0.00 0.21 0.00 0.00 66.02 64.61 3g6j s SER 1597CO 0.37 -0.36 -0.01 -0.31 0.41 0.00 0.00 173.24 173.34 3g6j s TYR 1598N -2.20 2.96 -0.05 2.43 1.51 -0.23 -0.52 117.35 121.25 3g6j s TYR 1598Ca 0.42 -0.05 0.04 0.00 -1.01 0.00 0.00 57.07 56.47 3g6j s TYR 1598Cb -0.08 -1.51 -0.03 0.00 -0.11 0.00 0.00 41.96 40.23 3g6j s TYR 1598CO 0.29 0.48 -0.15 0.42 -1.11 0.00 0.00 175.55 175.48 3g6j s ILE 1599N -1.35 3.03 -0.55 2.71 1.01 -0.02 -0.59 121.20 125.45 3g6j s ILE 1599Ca 0.26 -0.73 -0.19 0.00 0.00 0.00 0.00 60.65 59.99 3g6j s ILE 1599Cb -0.11 -2.18 0.08 0.00 0.01 0.00 0.00 42.46 40.25 3g6j s ILE 1599CO 0.18 0.59 0.64 -0.63 0.00 0.00 0.00 174.94 175.72 3g6j s ILE 1600N -0.70 4.88 0.31 2.92 1.01 -0.18 -4.89 121.20 124.56 3g6j s ILE 1600Ca 0.11 -0.79 0.00 0.00 0.00 0.00 0.00 60.65 59.97 3g6j s ILE 1600Cb -0.11 -4.38 -0.00 0.00 0.01 0.00 0.00 42.46 37.98 3g6j s ILE 1600CO 0.01 -0.94 0.01 0.61 0.00 0.00 0.00 174.94 174.62 3g6j n GLY 1601N 5.23 3.79 0.44 6.18 0.00 -1.24 -4.76 105.19 114.83 3g6j n GLY 1601Ca -0.09 -2.29 0.35 0.00 0.00 0.00 0.00 46.02 44.00 3g6j n GLY 1601CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3g6j h LYS 1602N 0.00 0.10 -0.32 1.61 2.10 -1.52 -0.69 116.57 117.85 3g6j h LYS 1602Ca -0.25 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.39 3g6j h LYS 1602Cb 0.78 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.08 3g6j h LYS 1602CO 0.42 0.07 0.00 -0.25 -2.00 0.00 0.00 179.45 177.69 3g6j n ASP 1603N -4.76 2.42 -4.53 7.07 8.00 -1.26 -2.86 116.55 120.62 3g6j n ASP 1603Ca 0.36 -1.88 -0.40 0.00 0.71 0.00 0.00 54.79 53.59 3g6j n ASP 1603Cb 1.37 -0.21 -0.11 0.00 -0.02 0.00 0.00 41.12 42.15 3g6j n ASP 1603CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3g6j s THR 1604N -1.58 5.25 -0.23 -3.53 2.01 -0.27 -4.15 115.64 113.13 3g6j s THR 1604Ca 0.34 -0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 3g6j s THR 1604Cb 0.19 -3.67 0.01 0.00 0.01 0.00 0.00 72.50 69.03 3g6j s THR 1604CO 0.26 0.02 1.01 0.86 -0.69 0.00 0.00 174.62 176.09 3g6j s TRP 1605N 1.72 3.33 -0.14 4.92 -0.00 -1.26 -2.31 118.94 125.20 3g6j s TRP 1605Ca 0.06 1.42 0.01 0.00 -0.00 0.00 0.00 56.10 57.60 3g6j s TRP 1605Cb -0.17 -3.25 0.02 0.00 -0.00 0.00 0.00 33.47 30.06 3g6j s TRP 1605CO 0.10 -0.48 -0.17 0.54 -0.00 0.00 0.00 176.95 176.94 3g6j s VAL 1606N 3.17 1.76 -0.04 5.86 0.11 -1.25 -1.23 120.40 128.77 3g6j s VAL 1606Ca 0.43 -0.78 -0.01 0.00 -2.93 0.00 0.00 61.98 58.70 3g6j s VAL 1606Cb -0.15 -1.60 0.03 0.00 -1.53 0.00 0.00 36.38 33.13 3g6j s VAL 1606CO 0.06 0.49 0.03 -0.70 -3.33 0.00 0.00 175.10 171.65 3g6j s GLU 1607N 1.13 0.11 0.26 1.54 2.12 -0.57 -4.96 118.70 118.33 3g6j s GLU 1607Ca -0.02 0.22 -0.30 0.00 0.36 0.00 0.00 54.97 55.23 3g6j s GLU 1607Cb -0.14 -0.49 -0.11 0.00 0.26 0.00 0.00 34.13 33.65 3g6j s GLU 1607CO -0.06 -0.24 1.58 -1.58 -0.54 0.00 0.00 175.26 174.42 3g6j s HIS 1608N 1.57 2.85 -0.32 5.30 5.65 -1.26 -0.80 115.29 128.27 3g6j s HIS 1608Ca -0.02 0.76 -0.01 0.00 0.25 0.00 0.00 55.06 56.04 3g6j s HIS 1608Cb -0.13 -4.02 0.07 0.00 -1.18 0.00 0.00 32.58 27.32 3g6j s HIS 1608CO -0.03 -3.49 0.04 -0.46 -0.65 0.00 0.00 174.74 170.15 3g6j s TRP 1609N 0.23 3.38 1.00 3.88 -0.11 -0.30 -4.87 118.94 122.16 3g6j s TRP 1609Ca 0.64 -2.13 -0.13 0.00 1.22 0.00 0.00 56.10 55.70 3g6j s TRP 1609Cb -0.47 -2.41 0.10 0.00 -1.50 0.00 0.00 33.47 29.19 3g6j s TRP 1609CO 0.44 -0.86 0.52 -2.30 -4.62 0.00 0.00 176.95 170.12 3g6j n PRO 1610N 4.57 -0.82 -3.58 5.86 -0.02 -1.26 -4.07 135.00 135.66 3g6j n PRO 1610Ca -0.09 -0.20 -0.23 0.00 -2.02 0.00 0.00 63.50 60.96 3g6j n PRO 1610Cb 0.43 -1.95 -0.01 0.00 -0.02 0.00 0.00 33.50 31.94 3g6j n PRO 1610CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3g6j s GLU 1611N -3.85 3.45 0.21 -0.52 2.56 -1.26 -4.90 118.70 114.39 3g6j s GLU 1611Ca 0.60 -0.50 -0.13 0.00 0.00 0.00 0.00 54.97 54.93 3g6j s GLU 1611Cb -0.20 -2.74 0.25 0.00 2.00 0.00 0.00 34.13 33.43 3g6j s GLU 1611CO 0.65 0.24 1.62 0.93 -0.56 0.00 0.00 175.26 178.14 3g6j h GLU 1612N 0.89 -0.00 -0.15 4.30 5.08 -2.01 0.63 114.58 123.33 3g6j h GLU 1612Ca -0.50 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 57.71 3g6j h GLU 1612Cb 1.22 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 3g6j h GLU 1612CO 0.61 -0.00 -0.53 0.38 -1.00 0.00 0.00 179.01 178.47 3g6j h ASP 1613N -0.00 0.48 1.09 1.42 2.03 -1.99 -3.12 116.42 116.33 3g6j h ASP 1613Ca 0.31 -0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.36 3g6j h ASP 1613Cb 0.48 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 38.84 3g6j h ASP 1613CO -0.67 0.92 0.00 -0.08 -1.03 0.00 0.00 179.24 178.38 3g6j h GLU 1614N 0.34 0.00 -0.30 4.15 4.81 -1.35 -3.09 114.58 119.14 3g6j h GLU 1614Ca 0.01 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.14 3g6j h GLU 1614Cb 1.04 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 3g6j h GLU 1614CO 0.09 0.00 -0.23 0.00 -0.73 0.00 0.00 179.01 178.15 3g6j n GLN 1616N -4.13 1.86 -3.64 0.00 6.02 -1.17 -4.48 117.38 111.84 3g6j n GLN 1616Ca -0.00 -2.56 -0.05 0.00 -0.01 0.00 0.00 57.00 54.38 3g6j n GLN 1616Cb 0.40 -3.64 -0.07 0.00 1.02 0.00 0.00 30.24 27.95 3g6j n GLN 1616CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 3g6j s ASP 1617N 6.00 -0.53 0.31 1.08 -1.08 -1.26 -5.06 116.67 116.13 3g6j s ASP 1617Ca 0.65 0.91 0.05 0.00 -0.52 0.00 0.00 52.55 53.64 3g6j s ASP 1617Cb 0.01 1.12 0.68 0.00 -1.46 0.00 0.00 42.92 43.28 3g6j s ASP 1617CO 0.12 -0.15 1.84 -0.33 0.52 0.00 0.00 175.17 177.18 3g6j h GLU 1618N 5.55 0.82 -0.19 4.34 5.08 -1.94 -2.87 114.58 125.37 3g6j h GLU 1618Ca -0.28 -0.05 -0.20 0.00 -1.00 0.00 0.00 59.36 57.83 3g6j h GLU 1618Cb 1.19 -0.19 0.01 0.00 0.50 0.00 0.00 28.75 30.26 3g6j h GLU 1618CO 0.16 0.54 -0.66 0.93 -1.00 0.00 0.00 179.01 178.99 3g6j h GLU 1619N 0.85 0.78 -0.49 2.33 5.08 -1.96 -3.19 114.58 117.97 3g6j h GLU 1619Ca 0.49 -0.59 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 3g6j h GLU 1619Cb 0.64 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.00 3g6j h GLU 1619CO -0.26 1.20 0.00 0.09 -1.00 0.00 0.00 179.01 179.04 3g6j n ASN 1620N -4.01 2.17 -0.20 1.42 3.02 -1.10 -4.47 115.26 112.09 3g6j n ASN 1620Ca -0.07 -2.13 -0.10 0.00 -0.03 0.00 0.00 54.58 52.25 3g6j n ASN 1620Cb 0.68 -0.34 0.02 0.00 -0.61 0.00 0.00 39.78 39.54 3g6j n ASN 1620CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 3g6j h GLN 1621N 1.84 1.06 0.08 3.52 4.15 -1.51 -2.80 115.11 121.45 3g6j h GLN 1621Ca 0.00 -0.36 -0.29 0.00 0.77 0.00 0.00 58.65 58.77 3g6j h GLN 1621Cb 0.67 -0.08 0.03 0.00 0.21 0.00 0.00 27.48 28.30 3g6j h GLN 1621CO 0.07 1.06 -1.18 0.87 -1.93 0.00 0.00 178.83 177.72 3g6j h LYS 1622N 0.95 0.65 -0.13 1.69 1.57 -1.85 -2.38 116.57 117.07 3g6j h LYS 1622Ca 0.16 -0.80 -0.04 0.00 -1.87 0.00 0.00 60.65 58.10 3g6j h LYS 1622Cb 0.61 0.25 -0.00 0.00 0.08 0.00 0.00 32.23 33.17 3g6j h LYS 1622CO 0.04 1.36 -0.06 0.37 -0.57 0.00 0.00 179.45 180.59 3g6j h GLN 1623N 0.32 0.27 -0.87 3.15 4.15 -1.87 -0.49 115.11 119.77 3g6j h GLN 1623Ca -0.17 -0.12 -0.01 0.00 0.77 0.00 0.00 58.65 59.12 3g6j h GLN 1623Cb 1.84 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 29.48 3g6j h GLN 1623CO 0.23 0.61 0.49 0.00 -1.93 0.00 0.00 178.83 178.23 3g6j h GLN 1625N 1.20 -0.64 -0.05 0.00 5.75 -1.30 -2.94 115.11 117.14 3g6j h GLN 1625Ca 0.31 0.04 -0.04 0.00 -0.15 0.00 0.00 58.65 58.81 3g6j h GLN 1625Cb -0.01 0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.69 3g6j h GLN 1625CO -0.05 -0.42 -0.13 -0.44 -2.65 0.00 0.00 178.83 175.14 3g6j h ASP 1626N -0.66 0.20 -0.49 -0.69 5.19 -0.52 -2.80 116.42 116.65 3g6j h ASP 1626Ca 0.01 -0.59 0.03 0.00 -0.62 0.00 0.00 57.03 55.85 3g6j h ASP 1626Cb 0.65 -0.06 -0.03 0.00 0.18 0.00 0.00 39.33 40.06 3g6j h ASP 1626CO -0.15 0.75 0.29 -0.07 -3.12 0.00 0.00 179.24 176.94 3g6j h LEU 1627N -0.34 0.45 -1.03 1.55 3.38 -0.39 0.51 115.31 119.44 3g6j h LEU 1627Ca -0.00 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 3g6j h LEU 1627Cb 0.73 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 3g6j h LEU 1627CO 0.03 0.32 0.23 1.23 0.09 0.00 0.00 178.44 180.34 3g6j h GLY 1628N 0.57 0.99 0.96 0.83 0.00 -1.57 -1.72 103.07 103.14 3g6j h GLY 1628Ca 0.20 -0.52 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 3g6j h GLY 1628CO -0.10 0.50 -0.32 0.00 0.00 0.00 0.00 176.54 176.62 3g6j h ALA 1629N 1.35 0.39 0.01 3.60 0.00 -1.13 -3.02 119.26 120.46 3g6j h ALA 1629Ca 0.21 -0.41 0.03 0.00 0.00 0.00 0.00 54.91 54.73 3g6j h ALA 1629Cb 0.20 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3g6j h ALA 1629CO -0.02 0.43 -0.44 0.35 0.00 0.00 0.00 179.25 179.57 3g6j h PHE 1630N 0.40 -1.26 -0.22 0.00 3.57 0.40 -1.12 116.94 118.71 3g6j h PHE 1630Ca 0.03 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.62 3g6j h PHE 1630Cb 0.89 0.55 -0.04 0.00 2.79 0.00 0.00 35.95 40.14 3g6j h PHE 1630CO 0.08 -0.52 -0.05 1.15 -2.23 0.00 0.00 178.31 176.74 3g6j h THR 1631N -0.60 0.78 -0.34 4.41 2.02 -1.40 -1.16 112.91 116.61 3g6j h THR 1631Ca 0.04 -0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.27 3g6j h THR 1631Cb 0.67 0.78 -0.04 0.00 -1.74 0.00 0.00 68.15 67.82 3g6j h THR 1631CO -0.32 0.00 0.08 -0.33 0.37 0.00 0.00 175.52 175.32 3g6j h GLU 1632N 0.00 0.20 0.37 6.66 4.39 -1.37 0.84 114.58 125.66 3g6j h GLU 1632Ca 0.11 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.77 3g6j h GLU 1632Cb 0.16 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3g6j h GLU 1632CO -0.23 0.13 -0.18 1.03 -1.16 0.00 0.00 179.01 178.61 3g6j h SER 1633N 0.20 -0.42 -0.18 1.42 0.87 -0.86 0.30 113.55 114.88 3g6j h SER 1633Ca 0.16 -0.05 0.04 0.00 -1.23 0.00 0.00 61.79 60.71 3g6j h SER 1633Cb 0.17 0.11 -0.04 0.00 -0.44 0.00 0.00 62.40 62.20 3g6j h SER 1633CO -0.20 -0.22 -0.06 0.24 -0.53 0.00 0.00 176.83 176.06 3g6j h MET 1634N -0.60 -0.02 0.24 2.24 2.86 -1.07 -1.20 114.93 117.37 3g6j h MET 1634Ca -0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3g6j h MET 1634Cb 0.44 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.11 3g6j h MET 1634CO 0.08 -0.02 -0.11 0.28 1.06 0.00 0.00 176.91 178.20 3g6j h VAL 1635N -0.03 0.00 -0.21 -2.22 2.07 -0.76 -3.14 116.25 111.96 3g6j h VAL 1635Ca 0.09 -0.27 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 3g6j h VAL 1635Cb 0.17 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.92 3g6j h VAL 1635CO -0.20 0.00 -0.28 0.58 0.02 0.00 0.00 177.57 177.69 3g6j h VAL 1636N -0.59 1.27 0.00 2.57 2.07 -0.48 -3.36 116.25 117.73 3g6j h VAL 1636Ca -0.03 -1.29 -0.02 0.00 0.82 0.00 0.00 66.70 66.18 3g6j h VAL 1636Cb 0.25 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3g6j h VAL 1636CO 0.05 0.40 -1.37 0.49 0.02 0.00 0.00 177.57 177.16 3g6j n PHE 1637N -4.11 0.00 0.00 1.57 3.01 -0.48 -5.06 117.46 112.39 3g6j n PHE 1637Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3g6j n PHE 1637Cb 0.41 -0.20 0.00 0.00 -0.01 0.00 0.00 39.48 39.68 3g6j n PHE 1637CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g6j n GLY 1638N 2.13 -0.09 2.69 1.37 0.00 -1.03 -4.96 105.19 105.31 3g6j n GLY 1638Ca -0.03 -1.95 -0.09 0.00 0.00 0.00 0.00 46.02 43.95 3g6j n GLY 1638CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g6j n PRO 1640N -0.09 0.28 0.00 0.00 -0.04 -1.26 -4.90 135.00 128.99 3g6j n PRO 1640Ca 0.03 0.20 0.13 0.00 -0.04 0.00 0.00 63.50 63.82 3g6j n PRO 1640Cb 0.77 -1.10 0.24 0.00 -0.04 0.00 0.00 33.50 33.37 3g6j n PRO 1640CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55