#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2win n ASP 730 N 0.00 0.89 -4.57 1.45 2.03 -1.26 -5.00 116.55 110.10 2win n ASP 730 Ca 0.00 -0.90 -0.31 0.00 0.52 0.00 0.00 54.79 54.10 2win n ASP 730 Cb 0.00 1.06 0.18 0.00 -0.72 0.00 0.00 41.12 41.64 2win n ASP 730 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2win n GLU 731 N -1.52 -0.88 -1.28 -0.67 1.02 -1.26 -4.84 120.64 111.21 2win n GLU 731 Ca 0.03 -0.20 -0.26 0.00 -0.02 0.00 0.00 57.16 56.71 2win n GLU 731 Cb 0.32 -2.22 -0.09 0.00 -0.02 0.00 0.00 31.44 29.43 2win n GLU 731 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2win n ASP 732 N -3.78 6.84 -3.30 1.62 -0.08 -1.26 -4.83 116.55 111.76 2win n ASP 732 Ca 0.09 -2.70 -0.13 0.00 -1.51 0.00 0.00 54.79 50.54 2win n ASP 732 Cb 0.53 -1.43 -0.03 0.00 2.34 0.00 0.00 41.12 42.53 2win n ASP 732 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 2win s ILE 733 N 0.61 0.00 -0.16 5.18 2.07 -1.26 -1.09 121.20 126.55 2win s ILE 733 Ca 0.65 -1.49 -0.06 0.00 -1.41 0.00 0.00 60.65 58.34 2win s ILE 733 Cb 0.27 -2.62 -0.04 0.00 0.13 0.00 0.00 42.46 40.20 2win s ILE 733 CO -0.06 0.00 0.05 -0.63 -1.91 0.00 0.00 174.94 172.39 2win s ILE 734 N -3.07 4.70 0.94 2.00 1.09 -1.26 -5.00 121.20 120.60 2win s ILE 734 Ca 0.27 -0.07 -0.12 0.00 -1.10 0.00 0.00 60.65 59.63 2win s ILE 734 Cb -0.01 -3.09 0.15 0.00 -1.06 0.00 0.00 42.46 38.45 2win s ILE 734 CO 0.17 0.50 1.09 0.00 -0.10 0.00 0.00 174.94 176.60 2win s ALA 735 N 0.10 1.30 0.34 9.38 0.00 -1.26 -4.85 121.76 126.77 2win s ALA 735 Ca 0.05 -0.16 0.09 0.00 0.00 0.00 0.00 51.96 51.94 2win s ALA 735 Cb -0.12 -3.17 0.61 0.00 0.00 0.00 0.00 23.12 20.44 2win s ALA 735 CO 0.01 -2.55 1.79 1.49 0.00 0.00 0.00 175.76 176.49 2win h GLU 736 N -1.69 0.16 0.00 0.00 4.22 -1.99 -2.57 114.58 112.71 2win h GLU 736 Ca -0.51 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 58.86 2win h GLU 736 Cb 1.30 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2win h GLU 736 CO 0.55 0.48 0.00 0.39 -2.18 0.00 0.00 179.01 178.26 2win n GLU 737 N -4.10 0.24 -0.14 1.92 4.71 -1.26 -2.91 120.64 119.11 2win n GLU 737 Ca -0.01 0.09 0.05 0.00 -0.01 0.00 0.00 57.16 57.28 2win n GLU 737 Cb 0.41 -1.50 0.13 0.00 -1.01 0.00 0.00 31.44 29.46 2win n GLU 737 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 2win n ASN 738 N -1.33 2.69 -4.20 1.62 5.03 -0.97 -4.89 115.26 113.20 2win n ASN 738 Ca 0.09 -1.90 -0.39 0.00 0.87 0.00 0.00 54.58 53.25 2win n ASN 738 Cb 0.19 -0.18 -0.10 0.00 -1.02 0.00 0.00 39.78 38.67 2win n ASN 738 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2win s ILE 739 N -0.98 3.87 -0.41 2.41 1.01 -1.14 -4.95 121.20 121.01 2win s ILE 739 Ca 0.20 -1.70 -0.29 0.00 0.00 0.00 0.00 60.65 58.86 2win s ILE 739 Cb 0.11 -3.49 0.02 0.00 0.01 0.00 0.00 42.46 39.11 2win s ILE 739 CO 0.14 -0.61 1.14 -0.69 0.00 0.00 0.00 174.94 174.92 2win s VAL 740 N 1.31 4.30 0.49 2.92 1.01 -1.26 -4.84 120.40 124.32 2win s VAL 740 Ca 0.05 1.40 -0.21 0.00 0.00 0.00 0.00 61.98 63.22 2win s VAL 740 Cb -0.24 -4.49 -0.08 0.00 0.00 0.00 0.00 36.38 31.58 2win s VAL 740 CO -0.01 -0.78 1.09 -0.44 0.00 0.00 0.00 175.10 174.97 2win s SER 741 N 2.25 6.18 -0.11 3.32 0.01 -1.26 -4.41 113.70 119.68 2win s SER 741 Ca 0.48 2.10 -0.25 0.00 1.31 0.00 0.00 55.95 59.59 2win s SER 741 Cb -0.10 -2.58 -0.02 0.00 0.21 0.00 0.00 66.02 63.53 2win s SER 741 CO 0.25 -0.90 0.80 -0.13 0.41 0.00 0.00 173.24 173.68 2win s ARG 742 N -3.03 4.39 0.00 12.44 0.52 0.12 -4.81 118.95 128.57 2win s ARG 742 Ca 0.67 1.02 0.00 0.00 -0.52 0.00 0.00 55.73 56.90 2win s ARG 742 Cb -0.22 -3.51 0.00 0.00 0.52 0.00 0.00 34.95 31.74 2win s ARG 742 CO 0.26 -0.14 0.00 -1.13 0.02 0.00 0.00 175.30 174.31 2win n SER 743 N 4.50 4.12 -4.55 0.23 3.41 -1.26 -1.06 113.62 119.01 2win n SER 743 Ca 0.03 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.28 2win n SER 743 Cb 0.50 0.28 -0.04 0.00 -0.26 0.00 0.00 64.21 64.69 2win n SER 743 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2win s GLU 744 N -1.89 2.69 -0.57 4.33 2.02 -1.26 -4.85 118.70 119.18 2win s GLU 744 Ca 0.00 0.24 0.06 0.00 0.02 0.00 0.00 54.97 55.29 2win s GLU 744 Cb 0.00 -4.58 0.30 0.00 0.10 0.00 0.00 34.13 29.95 2win s GLU 744 CO 0.00 -2.83 0.83 1.19 0.02 0.00 0.00 175.26 174.47 2win n PHE 745 N 12.63 3.26 -2.00 1.61 3.72 -1.26 -2.17 117.46 133.24 2win n PHE 745 Ca 0.24 -4.01 -0.34 0.00 -0.05 0.00 0.00 57.45 53.30 2win n PHE 745 Cb 0.50 -0.50 0.02 0.00 -0.94 0.00 0.00 39.48 38.57 2win n PHE 745 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2win s PRO 746 N -2.89 3.09 0.03 -1.08 0.02 -1.26 -4.96 135.00 127.94 2win s PRO 746 Ca 0.44 1.46 0.18 0.00 0.02 0.00 0.00 61.00 63.10 2win s PRO 746 Cb 0.24 -1.98 -0.16 0.00 0.02 0.00 0.00 34.50 32.61 2win s PRO 746 CO -0.09 -1.03 0.71 0.39 -0.33 0.00 0.00 177.00 176.65 2win n GLU 747 N -1.90 0.63 -3.65 5.54 1.02 -1.26 -4.88 120.64 116.15 2win n GLU 747 Ca 0.11 0.15 -0.09 0.00 -0.02 0.00 0.00 57.16 57.31 2win n GLU 747 Cb 0.52 -1.74 -0.10 0.00 -0.02 0.00 0.00 31.44 30.10 2win n GLU 747 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2win s SER 748 N -5.60 -0.22 0.00 1.62 1.04 -1.26 -5.11 113.70 104.17 2win s SER 748 Ca -0.04 0.95 0.00 0.00 0.48 0.00 0.00 55.95 57.34 2win s SER 748 Cb 0.09 1.32 0.00 0.00 0.10 0.00 0.00 66.02 67.53 2win s SER 748 CO 0.82 -0.23 0.00 -2.67 0.98 0.00 0.00 173.24 172.14 2win n TRP 749 N 5.39 0.00 -3.76 5.02 4.27 -1.26 -4.90 117.44 122.19 2win n TRP 749 Ca -0.08 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.26 2win n TRP 749 Cb 0.49 0.00 0.05 0.00 -1.36 0.00 0.00 31.31 30.50 2win n TRP 749 CO 0.00 0.00 0.00 -0.11 -2.29 0.00 0.00 177.69 175.29 2win n LEU 750 N 0.00 -2.97 -3.41 5.67 7.94 -1.26 -4.86 117.00 118.11 2win n LEU 750 Ca 0.00 -0.66 -0.40 0.00 -1.11 0.00 0.00 56.01 53.84 2win n LEU 750 Cb 0.00 -2.79 -0.02 0.00 0.53 0.00 0.00 43.42 41.14 2win n LEU 750 CO 0.00 0.56 3.03 1.87 -1.11 0.00 0.00 177.39 181.74 2win n TRP 751 N -4.85 2.57 -3.63 1.96 -0.00 -1.26 -4.92 117.44 107.31 2win n TRP 751 Ca 0.03 -3.00 -0.23 0.00 -0.00 0.00 0.00 57.50 54.29 2win n TRP 751 Cb 0.54 -2.30 -0.01 0.00 -0.00 0.00 0.00 31.31 29.54 2win n TRP 751 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 2win s ASN 752 N 1.71 4.88 -0.06 5.87 0.02 -1.26 -5.13 114.94 120.96 2win s ASN 752 Ca 0.63 -0.96 -0.01 0.00 -1.02 0.00 0.00 52.86 51.50 2win s ASN 752 Cb 0.18 -0.07 0.03 0.00 0.02 0.00 0.00 41.25 41.40 2win s ASN 752 CO -0.07 -0.92 -0.01 -0.69 0.02 0.00 0.00 177.10 175.43 2win s VAL 753 N -2.62 0.41 -0.02 1.60 1.01 -1.26 -5.14 120.40 114.38 2win s VAL 753 Ca 0.44 0.05 0.04 0.00 0.00 0.00 0.00 61.98 62.51 2win s VAL 753 Cb -0.03 -0.52 -0.01 0.00 0.00 0.00 0.00 36.38 35.82 2win s VAL 753 CO 0.27 0.24 -0.14 -1.61 0.00 0.00 0.00 175.10 173.86 2win s GLU 754 N 1.59 1.30 -0.09 2.72 0.41 -1.26 -5.14 118.70 118.22 2win s GLU 754 Ca -0.01 -0.51 -0.04 0.00 -0.41 0.00 0.00 54.97 54.01 2win s GLU 754 Cb -0.13 -1.21 -0.04 0.00 -1.78 0.00 0.00 34.13 30.98 2win s GLU 754 CO -0.03 0.26 0.06 -0.51 -0.49 0.00 0.00 175.26 174.54 2win s ASP 755 N -0.15 5.68 -1.14 -0.19 1.11 -1.26 -5.05 116.67 115.67 2win s ASP 755 Ca 0.02 0.26 -0.11 0.00 0.18 0.00 0.00 52.55 52.90 2win s ASP 755 Cb -0.08 -1.70 0.25 0.00 1.07 0.00 0.00 42.92 42.46 2win s ASP 755 CO 0.00 0.38 1.20 -0.76 1.18 0.00 0.00 175.17 177.18 2win s LEU 756 N -0.99 5.97 0.00 1.23 1.43 -1.26 -4.72 118.68 120.33 2win s LEU 756 Ca 0.14 -3.41 0.15 0.00 -1.03 0.00 0.00 54.13 49.99 2win s LEU 756 Cb -0.12 -2.27 0.43 0.00 0.03 0.00 0.00 46.19 44.27 2win s LEU 756 CO 0.04 -0.43 1.36 0.29 0.23 0.00 0.00 176.35 177.84 2win n LYS 757 N 3.59 2.79 -1.43 1.70 4.76 -1.26 -4.96 118.16 123.34 2win n LYS 757 Ca 0.27 -2.27 -0.32 0.00 -2.87 0.00 0.00 58.31 53.12 2win n LYS 757 Cb 0.40 -1.38 0.08 0.00 -1.84 0.00 0.00 35.03 32.29 2win n LYS 757 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2win s GLU 758 N -1.01 2.35 -0.33 1.97 8.01 -1.26 -4.87 118.70 123.56 2win s GLU 758 Ca 0.33 1.36 -0.37 0.00 0.01 0.00 0.00 54.97 56.30 2win s GLU 758 Cb 0.17 -1.90 -0.13 0.00 -4.31 0.00 0.00 34.13 27.97 2win s GLU 758 CO 0.23 -1.60 2.07 -2.30 0.01 0.00 0.00 175.26 173.67 2win n PRO 759 N -3.05 1.07 -2.42 0.39 -0.02 -1.26 -4.82 135.00 124.89 2win n PRO 759 Ca 0.10 0.33 -0.39 0.00 -2.02 0.00 0.00 63.50 61.52 2win n PRO 759 Cb 0.52 -2.32 -0.04 0.00 -0.02 0.00 0.00 33.50 31.65 2win n PRO 759 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 2win s PRO 760 N 5.51 4.44 -0.16 0.52 0.02 -1.26 -4.73 135.00 139.35 2win s PRO 760 Ca 1.07 1.80 -0.03 0.00 0.02 0.00 0.00 61.00 63.86 2win s PRO 760 Cb -0.95 -2.99 0.05 0.00 0.02 0.00 0.00 34.50 30.63 2win s PRO 760 CO 0.54 0.03 0.04 0.15 -0.33 0.00 0.00 177.00 177.44 2win s LYS 761 N -1.78 0.51 -1.15 5.54 1.02 -1.21 -4.78 119.74 117.88 2win s LYS 761 Ca 0.49 -0.22 -0.01 0.00 0.02 0.00 0.00 55.97 56.25 2win s LYS 761 Cb -0.31 -1.77 0.00 0.00 -0.52 0.00 0.00 37.83 35.23 2win s LYS 761 CO 0.40 -0.56 0.11 0.09 -0.92 0.00 0.00 175.35 174.46 2win n ASN 762 N 5.12 -4.38 -0.42 2.83 5.03 -1.26 -2.54 115.26 119.63 2win n ASN 762 Ca -0.08 -0.06 -0.06 0.00 0.87 0.00 0.00 54.58 55.25 2win n ASN 762 Cb 0.48 -3.47 -0.02 0.00 -1.02 0.00 0.00 39.78 35.75 2win n ASN 762 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2win n GLY 763 N -1.08 0.76 2.88 7.41 0.00 -1.26 -4.98 105.19 108.92 2win n GLY 763 Ca -0.14 -0.34 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 2win n GLY 763 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2win s ILE 764 N -2.01 1.50 0.78 -0.61 -1.09 -1.05 -5.10 121.20 113.61 2win s ILE 764 Ca 0.00 -1.65 -0.11 0.00 -2.23 0.00 0.00 60.65 56.66 2win s ILE 764 Cb 0.00 -2.02 0.06 0.00 -1.58 0.00 0.00 42.46 38.91 2win s ILE 764 CO 0.00 -0.49 1.10 -0.44 -1.23 0.00 0.00 174.94 173.88 2win s SER 765 N 1.33 4.70 -0.18 3.58 0.01 -1.26 -3.34 113.70 118.54 2win s SER 765 Ca 0.06 1.29 -0.04 0.00 1.31 0.00 0.00 55.95 58.57 2win s SER 765 Cb -0.18 -2.04 0.09 0.00 0.21 0.00 0.00 66.02 64.10 2win s SER 765 CO -0.14 -1.83 0.24 -0.89 0.41 0.00 0.00 173.24 171.02 2win s THR 766 N -3.19 -0.36 -0.15 1.44 2.01 -1.26 -5.01 115.64 109.12 2win s THR 766 Ca 0.60 0.00 -0.04 0.00 0.31 0.00 0.00 61.69 62.56 2win s THR 766 Cb -0.14 -0.61 -0.03 0.00 0.01 0.00 0.00 72.50 71.73 2win s THR 766 CO 0.54 -0.11 -0.02 -0.75 -0.69 0.00 0.00 174.62 173.59 2win s LYS 767 N 2.36 3.66 -0.39 4.92 2.20 -1.26 -4.93 119.74 126.30 2win s LYS 767 Ca 0.06 -0.48 -0.11 0.00 -0.36 0.00 0.00 55.97 55.08 2win s LYS 767 Cb -0.15 -2.95 0.04 0.00 -1.51 0.00 0.00 37.83 33.26 2win s LYS 767 CO -0.11 0.29 0.23 -0.51 -0.36 0.00 0.00 175.35 174.89 2win s LEU 768 N 0.24 4.85 -0.02 5.43 1.43 -1.26 -5.08 118.68 124.28 2win s LEU 768 Ca -0.01 -1.11 -0.10 0.00 -1.03 0.00 0.00 54.13 51.88 2win s LEU 768 Cb -0.14 -2.02 -0.05 0.00 0.03 0.00 0.00 46.19 44.01 2win s LEU 768 CO 0.02 -0.43 0.29 -0.04 0.23 0.00 0.00 176.35 176.43 2win s MET 769 N 1.53 3.67 -0.76 1.70 -1.94 -1.26 -5.05 119.30 117.19 2win s MET 769 Ca 0.02 0.09 -0.07 0.00 -1.71 0.00 0.00 55.69 54.02 2win s MET 769 Cb -0.20 -3.14 0.20 0.00 2.01 0.00 0.00 34.83 33.69 2win s MET 769 CO 0.06 0.68 0.63 1.21 -0.01 0.00 0.00 175.02 177.59 2win s ASN 770 N -1.35 5.96 0.52 3.03 3.04 -1.26 -5.07 114.94 119.81 2win s ASN 770 Ca 0.24 -2.96 -0.08 0.00 0.04 0.00 0.00 52.86 50.10 2win s ASN 770 Cb -0.14 -2.00 -0.04 0.00 -1.54 0.00 0.00 41.25 37.53 2win s ASN 770 CO 0.12 -0.41 0.88 0.27 -3.04 0.00 0.00 177.10 174.92 2win s ILE 771 N -0.23 4.82 -0.52 -5.21 -4.36 -1.26 -5.05 121.20 109.38 2win s ILE 771 Ca 0.19 0.51 -0.03 0.00 -0.26 0.00 0.00 60.65 61.07 2win s ILE 771 Cb -0.15 -3.85 0.14 0.00 1.25 0.00 0.00 42.46 39.85 2win s ILE 771 CO -0.07 -0.92 0.33 -0.36 0.24 0.00 0.00 174.94 174.16 2win s PHE 772 N -2.86 3.48 0.37 1.37 2.99 -1.26 -5.08 117.98 117.00 2win s PHE 772 Ca 0.51 -2.59 -0.27 0.00 0.00 0.00 0.00 56.93 54.58 2win s PHE 772 Cb -0.11 -3.20 -0.11 0.00 0.00 0.00 0.00 43.02 39.60 2win s PHE 772 CO 0.46 -0.90 1.23 1.28 -0.00 0.00 0.00 175.22 177.29 2win n LEU 773 N 3.98 3.43 0.00 -0.37 4.77 -1.26 -4.99 117.00 122.57 2win n LEU 773 Ca 0.03 1.16 -0.08 0.00 -0.03 0.00 0.00 56.01 57.09 2win n LEU 773 Cb 0.39 -1.46 0.06 0.00 -2.33 0.00 0.00 43.42 40.08 2win n LEU 773 CO 0.33 -0.73 0.23 0.29 -1.33 0.00 0.00 177.39 176.18 2win n LYS 774 N 0.37 -0.52 0.15 3.23 4.76 -1.26 -4.99 118.16 119.89 2win n LYS 774 Ca 0.06 -0.54 0.12 0.00 -2.87 0.00 0.00 58.31 55.08 2win n LYS 774 Cb 0.37 -0.38 0.08 0.00 -1.84 0.00 0.00 35.03 33.26 2win n LYS 774 CO 0.00 0.00 0.00 -0.44 -1.37 0.00 0.00 177.40 175.59 2win h ASP 775 N -0.61 0.00 -2.10 4.39 3.32 -1.82 -3.46 116.42 116.14 2win h ASP 775 Ca -0.12 -0.01 -0.58 0.00 0.02 0.00 0.00 57.03 56.34 2win h ASP 775 Cb 0.32 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.89 2win h ASP 775 CO 0.08 0.00 1.24 -1.20 -1.72 0.00 0.00 179.24 177.64 2win n SER 776 N -2.81 3.65 -4.50 6.45 7.64 -1.19 -4.90 113.62 117.97 2win n SER 776 Ca 0.02 0.79 -0.43 0.00 1.01 0.00 0.00 58.87 60.26 2win n SER 776 Cb 0.54 -1.46 -0.03 0.00 -1.01 0.00 0.00 64.21 62.25 2win n SER 776 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2win s ILE 777 N 5.10 4.37 0.00 0.44 1.01 -1.26 -4.88 121.20 125.98 2win s ILE 777 Ca 0.94 -1.19 0.00 0.00 0.00 0.00 0.00 60.65 60.39 2win s ILE 777 Cb -0.54 -4.90 0.00 0.00 0.01 0.00 0.00 42.46 37.03 2win s ILE 777 CO 0.45 -1.69 0.00 1.07 0.00 0.00 0.00 174.94 174.77 2win n THR 778 N 6.10 0.00 -3.82 2.92 5.66 -0.83 -4.94 114.28 119.36 2win n THR 778 Ca 0.27 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.91 2win n THR 778 Cb 0.50 0.00 -0.13 0.00 -1.55 0.00 0.00 70.33 69.15 2win n THR 778 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 2win s THR 779 N -2.82 3.76 0.36 1.09 2.01 -1.26 -0.61 115.64 118.17 2win s THR 779 Ca 0.00 -0.58 -0.14 0.00 0.31 0.00 0.00 61.69 61.28 2win s THR 779 Cb 0.00 -2.84 -0.08 0.00 0.01 0.00 0.00 72.50 69.58 2win s THR 779 CO 0.00 0.23 0.77 0.26 -0.69 0.00 0.00 174.62 175.20 2win s TRP 780 N 1.50 3.39 -0.27 4.92 0.52 0.12 -4.84 118.94 124.29 2win s TRP 780 Ca 0.04 1.22 0.02 0.00 0.02 0.00 0.00 56.10 57.40 2win s TRP 780 Cb -0.16 -2.55 0.07 0.00 -1.15 0.00 0.00 33.47 29.68 2win s TRP 780 CO 0.00 0.00 -0.04 -2.00 0.02 0.00 0.00 176.95 174.93 2win s GLU 781 N -3.27 1.74 -0.19 4.98 2.12 -1.26 -0.59 118.70 122.23 2win s GLU 781 Ca 0.54 -1.27 -0.19 0.00 0.36 0.00 0.00 54.97 54.41 2win s GLU 781 Cb -0.10 -2.76 -0.03 0.00 0.26 0.00 0.00 34.13 31.50 2win s GLU 781 CO 0.21 -0.67 0.56 0.42 -0.54 0.00 0.00 175.26 175.23 2win s ILE 782 N 1.23 5.08 -0.16 -3.70 1.01 0.20 -4.88 121.20 119.98 2win s ILE 782 Ca -0.03 1.04 -0.03 0.00 0.00 0.00 0.00 60.65 61.63 2win s ILE 782 Cb -0.19 -3.88 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 2win s ILE 782 CO -0.07 0.16 -0.05 -0.22 0.00 0.00 0.00 174.94 174.76 2win s LEU 783 N 1.67 3.11 -0.01 2.97 2.96 -1.26 -1.45 118.68 126.67 2win s LEU 783 Ca 0.26 -0.20 0.07 0.00 -0.22 0.00 0.00 54.13 54.04 2win s LEU 783 Cb -0.16 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.76 2win s LEU 783 CO 0.10 0.14 -0.21 0.00 -1.32 0.00 0.00 176.35 175.07 2win s ALA 784 N 0.50 2.43 -0.09 5.97 0.00 -1.26 -5.05 121.76 124.26 2win s ALA 784 Ca -0.04 -1.11 -0.02 0.00 0.00 0.00 0.00 51.96 50.79 2win s ALA 784 Cb -0.15 -0.71 0.03 0.00 0.00 0.00 0.00 23.12 22.29 2win s ALA 784 CO 0.03 0.55 0.02 0.08 0.00 0.00 0.00 175.76 176.44 2win s VAL 785 N -0.74 0.31 -0.14 0.00 1.01 -1.26 -1.00 120.40 118.57 2win s VAL 785 Ca 0.12 0.07 -0.08 0.00 0.00 0.00 0.00 61.98 62.08 2win s VAL 785 Cb -0.10 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.69 2win s VAL 785 CO 0.01 0.17 0.15 -0.94 0.00 0.00 0.00 175.10 174.49 2win s SER 786 N 1.99 6.35 -0.56 3.32 1.04 -0.56 -4.96 113.70 120.32 2win s SER 786 Ca 0.04 0.41 0.04 0.00 0.48 0.00 0.00 55.95 56.92 2win s SER 786 Cb -0.13 -2.08 0.15 0.00 0.10 0.00 0.00 66.02 64.05 2win s SER 786 CO -0.05 0.33 0.34 -0.32 0.98 0.00 0.00 173.24 174.51 2win s MET 787 N -0.56 1.98 -0.00 4.02 1.75 -1.26 -1.57 119.30 123.65 2win s MET 787 Ca 0.13 -2.75 -0.07 0.00 -1.25 0.00 0.00 55.69 51.76 2win s MET 787 Cb -0.12 -3.09 -0.05 0.00 2.84 0.00 0.00 34.83 34.41 2win s MET 787 CO 0.02 -1.19 0.26 0.45 -0.65 0.00 0.00 175.02 173.91 2win s SER 788 N -0.57 6.49 0.00 1.11 0.15 -0.90 -4.98 113.70 115.00 2win s SER 788 Ca 0.21 0.55 0.14 0.00 0.70 0.00 0.00 55.95 57.55 2win s SER 788 Cb -0.17 -2.09 0.73 0.00 -1.71 0.00 0.00 66.02 62.78 2win s SER 788 CO -0.07 0.26 1.49 -0.90 1.20 0.00 0.00 173.24 175.22 2win n ASP 789 N 1.17 0.51 -0.01 5.45 5.68 -1.26 -1.13 116.55 126.96 2win n ASP 789 Ca -0.12 -1.66 -0.02 0.00 -0.50 0.00 0.00 54.79 52.49 2win n ASP 789 Cb 0.53 -0.04 -0.01 0.00 -1.14 0.00 0.00 41.12 40.45 2win n ASP 789 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 2win n LYS 790 N -0.38 0.07 -0.24 0.11 5.02 -1.26 -4.76 118.16 116.72 2win n LYS 790 Ca 0.11 0.02 0.07 0.00 -2.02 0.00 0.00 58.31 56.49 2win n LYS 790 Cb 0.13 -0.98 0.19 0.00 -0.02 0.00 0.00 35.03 34.35 2win n LYS 790 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2win n LYS 791 N -2.68 2.90 0.00 1.97 4.76 -1.25 -5.09 118.16 118.78 2win n LYS 791 Ca -0.05 -2.23 0.00 0.00 -2.87 0.00 0.00 58.31 53.15 2win n LYS 791 Cb 0.55 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.36 2win n LYS 791 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2win n GLY 792 N 0.55 0.92 3.84 0.72 0.00 -0.28 -4.77 105.19 106.17 2win n GLY 792 Ca 0.15 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 2win n GLY 792 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2win s ILE 793 N 0.00 4.52 -0.27 -0.61 2.07 -1.26 -2.11 121.20 123.54 2win s ILE 793 Ca 0.00 1.22 -0.10 0.00 -1.41 0.00 0.00 60.65 60.36 2win s ILE 793 Cb 0.00 -3.66 0.11 0.00 0.13 0.00 0.00 42.46 39.04 2win s ILE 793 CO 0.00 -0.47 0.60 0.00 -1.91 0.00 0.00 174.94 173.16 2win s VAL 795 N 2.54 5.06 0.71 0.00 1.01 -1.26 -1.49 120.40 126.96 2win s VAL 795 Ca -0.06 0.10 -0.12 0.00 0.00 0.00 0.00 61.98 61.90 2win s VAL 795 Cb -0.11 -3.96 0.02 0.00 0.00 0.00 0.00 36.38 32.34 2win s VAL 795 CO -0.18 -0.25 1.08 0.00 0.00 0.00 0.00 175.10 175.76 2win s ALA 796 N 2.27 2.46 0.11 5.51 0.00 -0.17 -4.99 121.76 126.95 2win s ALA 796 Ca 0.16 0.30 -0.31 0.00 0.00 0.00 0.00 51.96 52.11 2win s ALA 796 Cb -0.16 -3.26 -0.07 0.00 0.00 0.00 0.00 23.12 19.64 2win s ALA 796 CO 0.13 -1.41 1.27 -0.51 0.00 0.00 0.00 175.76 175.24 2win s ASP 797 N -3.23 6.99 0.15 0.00 1.01 -1.26 -4.50 116.67 115.82 2win s ASP 797 Ca 0.62 2.17 -0.34 0.00 0.71 0.00 0.00 52.55 55.71 2win s ASP 797 Cb -0.17 -2.59 -0.15 0.00 1.01 0.00 0.00 42.92 41.02 2win s ASP 797 CO 0.50 -0.52 1.35 -2.65 0.21 0.00 0.00 175.17 174.07 2win n PRO 798 N 3.64 1.49 -3.87 8.23 -0.02 -1.26 -4.86 135.00 138.36 2win n PRO 798 Ca 0.09 0.53 -0.35 0.00 -2.02 0.00 0.00 63.50 61.75 2win n PRO 798 Cb 0.45 -2.17 -0.14 0.00 -0.02 0.00 0.00 33.50 31.62 2win n PRO 798 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2win s PHE 799 N 0.32 3.00 -0.08 6.00 5.36 -0.53 -4.92 117.98 127.13 2win s PHE 799 Ca 0.78 -0.86 -0.13 0.00 -0.96 0.00 0.00 56.93 55.76 2win s PHE 799 Cb -0.83 -2.14 -0.05 0.00 -0.34 0.00 0.00 43.02 39.66 2win s PHE 799 CO 0.47 -0.52 0.31 -1.21 -1.46 0.00 0.00 175.22 172.81 2win s GLU 800 N 1.50 3.93 -0.20 10.12 2.02 -1.26 -0.63 118.70 134.19 2win s GLU 800 Ca 0.05 0.19 0.01 0.00 0.02 0.00 0.00 54.97 55.24 2win s GLU 800 Cb -0.15 -3.29 0.04 0.00 0.10 0.00 0.00 34.13 30.83 2win s GLU 800 CO -0.02 0.55 -0.12 0.08 0.02 0.00 0.00 175.26 175.77 2win s VAL 801 N -0.51 1.74 -0.26 2.63 1.01 0.24 -4.95 120.40 120.31 2win s VAL 801 Ca 0.19 -1.02 -0.21 0.00 0.00 0.00 0.00 61.98 60.94 2win s VAL 801 Cb -0.14 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 2win s VAL 801 CO 0.08 0.23 0.68 -0.89 0.00 0.00 0.00 175.10 175.20 2win s THR 802 N 1.36 4.94 -0.35 3.92 2.01 -1.26 -0.70 115.64 125.56 2win s THR 802 Ca -0.00 1.19 -0.02 0.00 0.31 0.00 0.00 61.69 63.17 2win s THR 802 Cb -0.16 -3.99 0.08 0.00 0.01 0.00 0.00 72.50 68.44 2win s THR 802 CO -0.09 -0.03 0.08 -0.69 -0.69 0.00 0.00 174.62 173.21 2win s VAL 803 N 2.61 3.09 0.27 3.82 1.01 0.22 -4.99 120.40 126.43 2win s VAL 803 Ca 0.28 -1.69 0.03 0.00 0.00 0.00 0.00 61.98 60.60 2win s VAL 803 Cb -0.15 -2.94 -0.06 0.00 0.00 0.00 0.00 36.38 33.23 2win s VAL 803 CO 0.09 -0.36 0.04 -0.32 0.00 0.00 0.00 175.10 174.55 2win s MET 804 N 1.19 1.46 -0.03 2.72 0.00 -1.26 -1.96 119.30 121.41 2win s MET 804 Ca 0.01 -1.77 -0.04 0.00 0.00 0.00 0.00 55.69 53.89 2win s MET 804 Cb -0.21 -0.61 0.01 0.00 0.00 0.00 0.00 34.83 34.02 2win s MET 804 CO -0.03 -0.17 0.11 -1.14 0.00 0.00 0.00 175.02 173.79 2win s GLN 805 N -3.91 0.19 0.57 4.11 0.74 -1.26 -5.03 119.66 115.07 2win s GLN 805 Ca 0.33 0.03 0.29 0.00 0.05 0.00 0.00 55.36 56.07 2win s GLN 805 Cb 0.07 0.09 1.46 0.00 1.10 0.00 0.00 33.01 35.73 2win s GLN 805 CO 0.12 -0.03 1.88 -0.44 -0.55 0.00 0.00 175.29 176.27 2win h ASP 806 N 5.65 0.00 -3.65 6.67 3.32 -1.96 -3.40 116.42 123.04 2win h ASP 806 Ca -0.26 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.67 2win h ASP 806 Cb 1.20 0.00 -0.25 0.00 0.22 0.00 0.00 39.33 40.50 2win h ASP 806 CO 0.43 0.00 -0.25 0.12 -1.72 0.00 0.00 179.24 177.82 2win s PHE 807 N -4.72 -0.51 0.28 4.55 5.36 -1.26 -2.51 117.98 119.16 2win s PHE 807 Ca -0.04 1.18 -0.19 0.00 -0.96 0.00 0.00 56.93 56.92 2win s PHE 807 Cb 0.17 0.20 0.07 0.00 -0.34 0.00 0.00 43.02 43.11 2win s PHE 807 CO 0.61 -0.26 0.92 -0.59 -1.46 0.00 0.00 175.22 174.44 2win s PHE 808 N 0.63 0.09 -0.04 10.12 -0.12 -1.21 -4.84 117.98 122.61 2win s PHE 808 Ca -0.03 -0.62 0.06 0.00 -0.05 0.00 0.00 56.93 56.29 2win s PHE 808 Cb -0.05 0.77 -0.01 0.00 -0.63 0.00 0.00 43.02 43.10 2win s PHE 808 CO -0.04 -1.22 -0.22 0.42 -0.05 0.00 0.00 175.22 174.11 2win s ILE 809 N -2.24 1.77 -0.83 -4.49 1.01 -1.26 -2.25 121.20 112.91 2win s ILE 809 Ca 0.19 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 59.92 2win s ILE 809 Cb -0.04 -1.49 0.24 0.00 0.01 0.00 0.00 42.46 41.18 2win s ILE 809 CO 0.08 0.50 0.86 -0.67 0.00 0.00 0.00 174.94 175.71 2win n ASP 810 N 2.85 4.31 -4.62 3.58 2.03 0.39 -4.92 116.55 120.18 2win n ASP 810 Ca -0.17 -3.29 -0.43 0.00 0.52 0.00 0.00 54.79 51.42 2win n ASP 810 Cb 0.52 -0.93 -0.03 0.00 -0.72 0.00 0.00 41.12 39.96 2win n ASP 810 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2win s LEU 811 N -1.99 3.79 -0.34 -2.67 2.96 -1.26 -3.35 118.68 115.81 2win s LEU 811 Ca 0.32 1.76 -0.08 0.00 -0.22 0.00 0.00 54.13 55.90 2win s LEU 811 Cb 0.02 -3.53 0.03 0.00 0.50 0.00 0.00 46.19 43.22 2win s LEU 811 CO -0.06 -1.47 0.14 -0.13 -1.32 0.00 0.00 176.35 173.51 2win s ARG 812 N 5.20 2.80 -0.05 1.98 0.52 -0.92 -5.00 118.95 123.48 2win s ARG 812 Ca 0.82 -1.07 0.02 0.00 -0.52 0.00 0.00 55.73 54.97 2win s ARG 812 Cb -0.28 -3.55 -0.03 0.00 0.52 0.00 0.00 34.95 31.61 2win s ARG 812 CO 0.33 -0.63 -0.08 -0.51 0.02 0.00 0.00 175.30 174.42 2win s LEU 813 N 1.48 3.09 0.87 2.53 1.02 -1.26 -3.74 118.68 122.66 2win s LEU 813 Ca 0.01 -0.07 -0.11 0.00 0.02 0.00 0.00 54.13 53.98 2win s LEU 813 Cb -0.19 -1.68 0.12 0.00 0.02 0.00 0.00 46.19 44.46 2win s LEU 813 CO 0.04 0.35 1.15 -2.84 0.02 0.00 0.00 176.35 175.08 2win s PRO 814 N -0.88 1.34 0.15 1.29 0.02 -1.26 -4.93 135.00 130.74 2win s PRO 814 Ca 0.13 1.56 -0.16 0.00 0.02 0.00 0.00 61.00 62.54 2win s PRO 814 Cb -0.11 -1.76 0.05 0.00 0.02 0.00 0.00 34.50 32.70 2win s PRO 814 CO 0.02 -2.39 1.75 -0.92 -0.33 0.00 0.00 177.00 175.13 2win h TYR 815 N -1.51 0.22 -3.29 6.54 3.20 -1.99 -3.44 116.97 116.70 2win h TYR 815 Ca -0.44 0.02 -0.17 0.00 3.14 0.00 0.00 58.73 61.27 2win h TYR 815 Cb 1.27 -0.05 -0.25 0.00 1.54 0.00 0.00 36.73 39.24 2win h TYR 815 CO 0.50 0.09 -0.49 -1.54 -1.64 0.00 0.00 178.16 175.08 2win s SER 816 N -5.36 -0.17 -0.05 -2.11 1.04 -1.26 -3.40 113.70 102.38 2win s SER 816 Ca -0.13 0.31 0.05 0.00 0.48 0.00 0.00 55.95 56.66 2win s SER 816 Cb 0.12 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.60 2win s SER 816 CO 0.71 -0.11 -0.21 0.68 0.98 0.00 0.00 173.24 175.30 2win s VAL 817 N -0.09 1.72 0.23 5.02 -7.23 -0.74 -4.97 120.40 114.33 2win s VAL 817 Ca -0.02 -0.87 -0.30 0.00 -1.81 0.00 0.00 61.98 58.98 2win s VAL 817 Cb -0.02 -1.47 -0.09 0.00 0.56 0.00 0.00 36.38 35.36 2win s VAL 817 CO 0.00 0.49 1.25 -0.69 -0.31 0.00 0.00 175.10 175.84 2win s VAL 818 N 0.01 3.28 0.37 1.32 1.01 -1.26 -2.37 120.40 122.77 2win s VAL 818 Ca -0.05 1.12 -0.28 0.00 0.00 0.00 0.00 61.98 62.77 2win s VAL 818 Cb -0.13 -3.71 -0.10 0.00 0.00 0.00 0.00 36.38 32.43 2win s VAL 818 CO 0.03 0.20 1.42 -0.60 0.00 0.00 0.00 175.10 176.16 2win s ARG 819 N -0.61 4.12 0.00 2.72 3.52 -1.02 -2.47 118.95 125.21 2win s ARG 819 Ca 0.52 2.43 0.00 0.00 -0.13 0.00 0.00 55.73 58.56 2win s ARG 819 Cb -0.35 -2.95 0.00 0.00 -1.56 0.00 0.00 34.95 30.09 2win s ARG 819 CO 0.40 -0.47 0.00 0.09 -0.81 0.00 0.00 175.30 174.51 2win n ASN 820 N 0.45 0.00 -4.69 -2.12 5.03 -0.38 -4.90 115.26 108.66 2win n ASN 820 Ca 0.01 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.04 2win n ASN 820 Cb 0.40 -0.13 -0.03 0.00 -1.02 0.00 0.00 39.78 39.01 2win n ASN 820 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 2win s GLU 821 N 0.00 4.43 -0.22 3.52 2.02 -1.03 -4.88 118.70 122.54 2win s GLU 821 Ca 0.00 1.40 -0.29 0.00 0.02 0.00 0.00 54.97 56.11 2win s GLU 821 Cb 0.00 -3.54 0.01 0.00 0.10 0.00 0.00 34.13 30.70 2win s GLU 821 CO 0.00 -0.31 1.02 -1.14 0.02 0.00 0.00 175.26 174.85 2win s GLN 822 N 1.97 4.27 0.18 1.61 0.74 -1.26 -4.37 119.66 122.80 2win s GLN 822 Ca 0.49 1.32 0.05 0.00 0.05 0.00 0.00 55.36 57.27 2win s GLN 822 Cb -0.19 -3.63 -0.05 0.00 1.10 0.00 0.00 33.01 30.25 2win s GLN 822 CO 0.19 -0.59 -0.08 0.14 -0.55 0.00 0.00 175.29 174.40 2win s VAL 823 N 3.04 1.22 -0.18 1.34 -7.23 -1.04 -5.01 120.40 112.55 2win s VAL 823 Ca 0.44 -2.08 -0.06 0.00 -1.81 0.00 0.00 61.98 58.47 2win s VAL 823 Cb -0.15 -2.02 -0.03 0.00 0.56 0.00 0.00 36.38 34.73 2win s VAL 823 CO 0.07 -0.60 0.02 -0.70 -0.31 0.00 0.00 175.10 173.58 2win s GLU 824 N -3.76 3.81 -0.07 4.82 2.12 -1.26 -2.32 118.70 122.04 2win s GLU 824 Ca 0.21 -0.43 -0.00 0.00 0.36 0.00 0.00 54.97 55.10 2win s GLU 824 Cb 0.03 -3.09 -0.03 0.00 0.26 0.00 0.00 34.13 31.30 2win s GLU 824 CO 0.04 0.22 -0.04 0.96 -0.54 0.00 0.00 175.26 175.90 2win s ILE 825 N 0.48 3.98 0.14 -3.70 -4.36 -0.52 -4.94 121.20 112.27 2win s ILE 825 Ca 0.00 -0.41 -0.11 0.00 -0.26 0.00 0.00 60.65 59.87 2win s ILE 825 Cb -0.13 -2.66 -0.07 0.00 1.25 0.00 0.00 42.46 40.85 2win s ILE 825 CO 0.02 0.58 0.49 -0.13 0.24 0.00 0.00 174.94 176.14 2win s ARG 826 N -0.92 3.85 -0.39 0.37 1.81 -1.25 -2.00 118.95 120.43 2win s ARG 826 Ca 0.13 0.32 0.01 0.00 -1.72 0.00 0.00 55.73 54.47 2win s ARG 826 Cb -0.11 -2.89 0.14 0.00 -0.45 0.00 0.00 34.95 31.64 2win s ARG 826 CO 0.03 0.47 0.24 0.00 -0.68 0.00 0.00 175.30 175.36 2win s ALA 827 N -1.52 1.31 -0.13 2.13 0.00 -0.84 -2.16 121.76 120.54 2win s ALA 827 Ca 0.38 -2.14 -0.29 0.00 0.00 0.00 0.00 51.96 49.92 2win s ALA 827 Cb -0.14 -1.67 -0.01 0.00 0.00 0.00 0.00 23.12 21.30 2win s ALA 827 CO 0.19 -2.08 0.98 0.08 0.00 0.00 0.00 175.76 174.93 2win s VAL 828 N 0.73 4.80 -0.36 0.00 1.01 -1.21 -1.80 120.40 123.56 2win s VAL 828 Ca 0.20 1.96 -0.11 0.00 0.00 0.00 0.00 61.98 64.04 2win s VAL 828 Cb -0.19 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 31.93 2win s VAL 828 CO -0.03 -0.00 0.19 -0.76 0.00 0.00 0.00 175.10 174.51 2win s LEU 829 N 2.12 4.56 0.06 3.92 1.02 0.24 -0.46 118.68 130.14 2win s LEU 829 Ca 0.46 -0.86 -0.17 0.00 0.02 0.00 0.00 54.13 53.58 2win s LEU 829 Cb -0.18 -2.02 -0.06 0.00 0.02 0.00 0.00 46.19 43.95 2win s LEU 829 CO 0.16 -0.33 0.51 -0.31 0.02 0.00 0.00 176.35 176.40 2win s TYR 830 N 1.57 3.74 -0.27 0.29 2.02 -0.96 -1.89 117.35 121.86 2win s TYR 830 Ca 0.03 1.14 -0.01 0.00 -0.37 0.00 0.00 57.07 57.85 2win s TYR 830 Cb -0.19 -2.40 0.08 0.00 -0.40 0.00 0.00 41.96 39.06 2win s TYR 830 CO 0.07 0.58 0.06 1.21 -1.57 0.00 0.00 175.55 175.90 2win s ASN 831 N -1.23 3.66 -0.34 2.29 2.47 -0.28 -3.36 114.94 118.15 2win s ASN 831 Ca 0.29 -1.33 0.08 0.00 0.42 0.00 0.00 52.86 52.31 2win s ASN 831 Cb -0.18 -0.80 0.58 0.00 -1.45 0.00 0.00 41.25 39.40 2win s ASN 831 CO 0.17 -0.36 1.65 -1.22 -3.72 0.00 0.00 177.10 173.62 2win n TYR 832 N 4.90 1.88 -2.44 0.43 4.02 -1.05 -1.25 117.16 123.65 2win n TYR 832 Ca -0.05 -1.62 -0.35 0.00 -0.01 0.00 0.00 57.90 55.87 2win n TYR 832 Cb 0.44 -0.66 -0.02 0.00 -0.02 0.00 0.00 39.34 39.08 2win n TYR 832 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 176.86 176.88 2win s ARG 833 N -3.23 3.77 0.00 -0.72 1.81 -1.26 -4.75 118.95 114.58 2win s ARG 833 Ca 0.50 1.50 0.00 0.00 -1.72 0.00 0.00 55.73 56.01 2win s ARG 833 Cb 0.43 -2.21 0.00 0.00 -0.45 0.00 0.00 34.95 32.72 2win s ARG 833 CO 0.05 -0.48 0.81 0.00 -0.68 0.00 0.00 175.30 175.01 2win n GLN 834 N -0.79 0.00 -2.98 3.54 -0.00 -1.26 -3.08 117.38 112.81 2win n GLN 834 Ca 0.09 0.55 -0.17 0.00 -0.00 0.00 0.00 57.00 57.46 2win n GLN 834 Cb 0.51 -1.31 -0.01 0.00 -0.00 0.00 0.00 30.24 29.42 2win n GLN 834 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.06 177.33 2win n ASN 835 N -1.82 1.56 -3.51 2.61 0.23 -1.26 -4.58 115.26 108.50 2win n ASN 835 Ca 0.00 -3.03 -0.29 0.00 -0.53 0.00 0.00 54.58 50.73 2win n ASN 835 Cb 0.00 -0.58 -0.14 0.00 -2.08 0.00 0.00 39.78 36.98 2win n ASN 835 CO 0.00 0.00 0.00 -1.58 -0.93 0.00 0.00 177.26 174.75 2win s GLN 836 N -2.78 0.34 0.21 -3.83 2.00 -1.26 -5.02 119.66 109.32 2win s GLN 836 Ca 0.38 -0.87 -0.30 0.00 -2.00 0.00 0.00 55.36 52.56 2win s GLN 836 Cb 0.38 -1.22 -0.09 0.00 0.80 0.00 0.00 33.01 32.87 2win s GLN 836 CO -0.06 -1.10 1.41 -1.83 -0.50 0.00 0.00 175.29 173.21 2win s GLU 837 N 1.66 4.30 -0.19 1.67 -1.05 -1.26 -4.56 118.70 119.27 2win s GLU 837 Ca 0.13 2.21 -0.11 0.00 -0.15 0.00 0.00 54.97 57.04 2win s GLU 837 Cb -0.19 -3.15 -0.05 0.00 -0.44 0.00 0.00 34.13 30.30 2win s GLU 837 CO -0.21 -0.39 0.19 -0.51 0.95 0.00 0.00 175.26 175.29 2win s LEU 838 N 0.03 4.22 -0.69 1.83 1.43 -0.56 -4.90 118.68 120.04 2win s LEU 838 Ca 0.60 0.33 -0.26 0.00 -1.03 0.00 0.00 54.13 53.77 2win s LEU 838 Cb -0.40 -2.19 0.04 0.00 0.03 0.00 0.00 46.19 43.68 2win s LEU 838 CO 0.39 0.15 1.16 -0.75 0.23 0.00 0.00 176.35 177.53 2win s LYS 839 N 0.38 3.21 -0.01 1.70 2.47 -1.26 -1.78 119.74 124.44 2win s LYS 839 Ca 0.11 -0.36 -0.02 0.00 -1.56 0.00 0.00 55.97 54.15 2win s LYS 839 Cb -0.12 -4.17 -0.04 0.00 -1.46 0.00 0.00 37.83 32.05 2win s LYS 839 CO 0.00 -1.96 0.12 0.08 0.16 0.00 0.00 175.35 173.75 2win s VAL 840 N 5.05 5.02 -0.31 4.02 1.01 -0.25 -0.56 120.40 134.38 2win s VAL 840 Ca 0.32 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 62.05 2win s VAL 840 Cb -0.11 -3.30 0.09 0.00 0.00 0.00 0.00 36.38 33.06 2win s VAL 840 CO 0.15 0.36 0.01 -0.60 0.00 0.00 0.00 175.10 175.02 2win s ARG 841 N -1.76 1.60 -0.12 2.72 3.52 0.23 -2.16 118.95 122.98 2win s ARG 841 Ca 0.24 -1.61 -0.05 0.00 -0.13 0.00 0.00 55.73 54.18 2win s ARG 841 Cb -0.12 -2.98 -0.04 0.00 -1.56 0.00 0.00 34.95 30.26 2win s ARG 841 CO 0.15 -0.83 0.05 0.54 -0.81 0.00 0.00 175.30 174.40 2win s VAL 842 N 1.05 4.72 0.00 7.11 0.11 -1.01 -1.88 120.40 130.50 2win s VAL 842 Ca 0.05 -0.08 0.02 0.00 -2.93 0.00 0.00 61.98 59.04 2win s VAL 842 Cb -0.19 -3.05 -0.01 0.00 -1.53 0.00 0.00 36.38 31.60 2win s VAL 842 CO -0.09 0.56 -0.07 -0.70 -3.33 0.00 0.00 175.10 171.48 2win s GLU 843 N -0.52 0.56 -0.43 1.54 2.12 0.74 -1.09 118.70 121.63 2win s GLU 843 Ca 0.10 -0.31 -0.12 0.00 0.36 0.00 0.00 54.97 54.99 2win s GLU 843 Cb -0.12 -0.53 0.06 0.00 0.26 0.00 0.00 34.13 33.81 2win s GLU 843 CO 0.02 0.14 0.30 -1.17 -0.54 0.00 0.00 175.26 174.01 2win s LEU 844 N -0.34 5.23 0.52 2.70 2.96 -1.06 -1.35 118.68 127.34 2win s LEU 844 Ca 0.01 -1.29 -0.22 0.00 -0.22 0.00 0.00 54.13 52.41 2win s LEU 844 Cb -0.04 -2.08 -0.06 0.00 0.50 0.00 0.00 46.19 44.51 2win s LEU 844 CO -0.00 -0.54 1.20 0.18 -1.32 0.00 0.00 176.35 175.87 2win n LEU 845 N 5.05 4.43 -4.79 -0.68 4.32 -0.93 -4.51 117.00 119.88 2win n LEU 845 Ca -0.11 0.96 -0.35 0.00 -0.02 0.00 0.00 56.01 56.49 2win n LEU 845 Cb 0.44 -1.49 -0.05 0.00 -1.62 0.00 0.00 43.42 40.71 2win n LEU 845 CO 0.42 -1.05 0.71 -2.28 -1.22 0.00 0.00 177.39 173.97 2win s HIS 846 N -1.33 3.23 -0.19 -1.77 5.65 -1.26 -4.76 115.29 114.86 2win s HIS 846 Ca 0.70 1.63 -0.07 0.00 0.25 0.00 0.00 55.06 57.57 2win s HIS 846 Cb -0.45 -3.04 0.09 0.00 -1.18 0.00 0.00 32.58 28.00 2win s HIS 846 CO 0.51 -0.52 0.40 1.21 -0.65 0.00 0.00 174.74 175.69 2win s ASN 847 N -1.81 -0.17 0.65 9.88 3.84 -1.26 -5.03 114.94 121.05 2win s ASN 847 Ca 0.61 0.93 0.29 0.00 0.21 0.00 0.00 52.86 54.89 2win s ASN 847 Cb -0.18 1.26 1.56 0.00 -0.55 0.00 0.00 41.25 43.34 2win s ASN 847 CO 0.22 -0.23 1.89 1.55 -2.79 0.00 0.00 177.10 177.74 2win h PRO 848 N 8.19 0.00 0.00 0.43 0.13 -1.97 0.21 132.00 138.99 2win h PRO 848 Ca -0.16 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.93 2win h PRO 848 Cb 1.11 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.23 2win h PRO 848 CO 0.12 0.00 -0.22 0.00 -0.23 0.00 0.00 178.00 177.68 2win h ALA 849 N 1.33 0.92 -2.16 -0.56 0.00 -1.96 -3.46 119.26 113.38 2win h ALA 849 Ca 0.04 -0.20 -0.61 0.00 0.00 0.00 0.00 54.91 54.15 2win h ALA 849 Cb 0.80 -0.03 -0.14 0.00 0.00 0.00 0.00 17.79 18.42 2win h ALA 849 CO -0.00 0.27 -0.74 -0.06 0.00 0.00 0.00 179.25 178.72 2win s PHE 850 N -3.37 2.34 -0.35 0.00 0.40 0.75 -0.60 117.98 117.14 2win s PHE 850 Ca 0.03 -0.35 0.03 0.00 -0.60 0.00 0.00 56.93 56.04 2win s PHE 850 Cb 0.08 -1.07 0.10 0.00 0.51 0.00 0.00 43.02 42.64 2win s PHE 850 CO 0.66 0.69 0.09 0.00 0.70 0.00 0.00 175.22 177.36 2win n SER 852 N 4.25 1.24 0.28 0.00 3.41 -1.26 -3.16 113.62 118.38 2win n SER 852 Ca 0.03 -1.51 0.18 0.00 -0.26 0.00 0.00 58.87 57.31 2win n SER 852 Cb 0.41 0.21 0.79 0.00 -0.26 0.00 0.00 64.21 65.36 2win n SER 852 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2win h LEU 853 N 0.00 0.00 -8.97 1.04 3.38 -1.94 -3.41 115.31 105.41 2win h LEU 853 Ca -0.08 0.00 -0.60 0.00 0.09 0.00 0.00 57.88 57.29 2win h LEU 853 Cb 0.29 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.94 2win h LEU 853 CO 0.13 0.00 0.40 0.00 0.09 0.00 0.00 178.44 179.05 2win s ALA 854 N -3.75 3.59 0.11 1.53 0.00 -1.26 -4.60 121.76 117.37 2win s ALA 854 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 51.96 51.65 2win s ALA 854 Cb 0.10 -3.26 0.00 0.00 0.00 0.00 0.00 23.12 19.96 2win s ALA 854 CO 0.50 -1.05 0.03 0.25 0.00 0.00 0.00 175.76 175.50 2win n THR 855 N 5.39 0.00 0.21 0.00 -2.24 0.00 -4.66 114.28 112.98 2win n THR 855 Ca 0.04 -0.48 0.04 0.00 -2.27 0.00 0.00 64.05 61.38 2win n THR 855 Cb 0.48 -0.09 0.45 0.00 -2.10 0.00 0.00 70.33 69.07 2win n THR 855 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 2win h THR 856 N 0.86 1.18 -0.00 4.28 1.35 -1.97 -3.12 112.91 115.49 2win h THR 856 Ca -0.08 -0.85 0.00 0.00 -0.55 0.00 0.00 66.41 64.93 2win h THR 856 Cb 0.27 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 68.14 2win h THR 856 CO 0.13 0.24 -0.02 0.29 -0.25 0.00 0.00 175.52 175.92 2win n LYS 857 N -4.25 0.40 -5.07 4.72 5.02 -1.26 -4.99 118.16 112.73 2win n LYS 857 Ca -0.02 -0.55 -0.30 0.00 -2.02 0.00 0.00 58.31 55.42 2win n LYS 857 Cb 0.30 -0.98 -0.17 0.00 -0.02 0.00 0.00 35.03 34.16 2win n LYS 857 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2win s ARG 858 N -0.36 2.64 -0.22 1.97 3.52 -1.18 -5.12 118.95 120.20 2win s ARG 858 Ca 0.03 -0.77 -0.10 0.00 -0.13 0.00 0.00 55.73 54.75 2win s ARG 858 Cb 0.02 -2.05 -0.05 0.00 -1.56 0.00 0.00 34.95 31.31 2win s ARG 858 CO 0.04 0.18 0.14 1.03 -0.81 0.00 0.00 175.30 175.88 2win s ARG 859 N 0.32 4.13 -0.90 5.12 0.52 -1.26 -0.82 118.95 126.07 2win s ARG 859 Ca -0.15 -0.25 -0.16 0.00 -0.52 0.00 0.00 55.73 54.65 2win s ARG 859 Cb -0.17 -3.47 0.18 0.00 0.52 0.00 0.00 34.95 32.02 2win s ARG 859 CO 0.07 0.19 0.96 -1.58 0.02 0.00 0.00 175.30 174.96 2win s HIS 860 N 0.68 3.51 -0.07 -0.53 5.65 -1.26 -4.93 115.29 118.34 2win s HIS 860 Ca 0.08 -1.78 0.03 0.00 0.25 0.00 0.00 55.06 53.64 2win s HIS 860 Cb -0.12 -4.03 0.01 0.00 -1.18 0.00 0.00 32.58 27.26 2win s HIS 860 CO 0.01 -1.21 -0.15 1.14 -0.65 0.00 0.00 174.74 173.88 2win s GLN 861 N 1.21 1.94 0.45 2.88 -2.07 -1.26 -2.57 119.66 120.24 2win s GLN 861 Ca 0.26 -0.50 0.08 0.00 -1.82 0.00 0.00 55.36 53.37 2win s GLN 861 Cb -0.08 -1.57 0.02 0.00 -1.09 0.00 0.00 33.01 30.30 2win s GLN 861 CO -0.09 0.06 0.59 -0.65 -1.32 0.00 0.00 175.29 173.89 2win s GLN 862 N 0.58 2.72 -0.43 9.60 1.11 -0.25 -4.97 119.66 128.02 2win s GLN 862 Ca -0.15 -1.33 0.05 0.00 0.01 0.00 0.00 55.36 53.93 2win s GLN 862 Cb -0.16 -2.71 0.18 0.00 -1.01 0.00 0.00 33.01 29.31 2win s GLN 862 CO 0.05 -0.37 0.37 2.41 0.01 0.00 0.00 175.29 177.76 2win n THR 863 N -1.89 -0.94 -2.80 -0.19 -1.04 -1.26 -2.41 114.28 103.75 2win n THR 863 Ca 0.09 -3.60 -0.20 0.00 -2.04 0.00 0.00 64.05 58.30 2win n THR 863 Cb 0.60 -1.72 0.04 0.00 -1.82 0.00 0.00 70.33 67.42 2win n THR 863 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2win s VAL 864 N -0.20 2.62 -0.02 12.58 -7.23 -0.92 -4.89 120.40 122.34 2win s VAL 864 Ca 0.33 -0.81 0.05 0.00 -1.81 0.00 0.00 61.98 59.74 2win s VAL 864 Cb 0.05 -2.82 -0.01 0.00 0.56 0.00 0.00 36.38 34.16 2win s VAL 864 CO -0.19 0.00 -0.17 -0.89 -0.31 0.00 0.00 175.10 173.54 2win s THR 865 N -2.67 1.40 -0.17 5.32 2.01 -1.26 -1.09 115.64 119.19 2win s THR 865 Ca 0.58 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.85 2win s THR 865 Cb -0.09 -1.18 0.01 0.00 0.01 0.00 0.00 72.50 71.25 2win s THR 865 CO 0.38 0.40 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.91 2win s ILE 866 N -0.25 2.44 0.76 1.82 1.01 -0.74 -4.85 121.20 121.40 2win s ILE 866 Ca 0.03 -0.83 -0.14 0.00 0.00 0.00 0.00 60.65 59.70 2win s ILE 866 Cb -0.09 -2.03 0.06 0.00 0.01 0.00 0.00 42.46 40.41 2win s ILE 866 CO 0.00 0.52 1.22 -2.84 0.00 0.00 0.00 174.94 173.84 2win s PRO 867 N 1.03 1.93 0.40 2.79 0.02 -1.26 -1.49 135.00 138.41 2win s PRO 867 Ca -0.01 1.80 -0.27 0.00 0.02 0.00 0.00 61.00 62.54 2win s PRO 867 Cb -0.15 -1.80 -0.09 0.00 0.02 0.00 0.00 34.50 32.48 2win s PRO 867 CO -0.05 -2.01 1.37 -2.14 -0.33 0.00 0.00 177.00 173.85 2win s PRO 868 N -3.96 3.97 -1.39 5.54 0.02 -1.26 -3.28 135.00 134.64 2win s PRO 868 Ca 0.75 2.31 -0.08 0.00 0.02 0.00 0.00 61.00 64.00 2win s PRO 868 Cb -0.30 -2.81 0.03 0.00 0.02 0.00 0.00 34.50 31.44 2win s PRO 868 CO 0.47 -0.54 1.04 1.63 -0.33 0.00 0.00 177.00 179.27 2win n LYS 869 N 0.20 -6.66 -3.65 5.54 5.02 -0.38 -4.97 118.16 113.26 2win n LYS 869 Ca 0.03 0.73 -0.11 0.00 -2.02 0.00 0.00 58.31 56.94 2win n LYS 869 Cb 0.42 -5.67 -0.00 0.00 -0.02 0.00 0.00 35.03 29.76 2win n LYS 869 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2win n SER 870 N -2.98 -1.67 -4.45 4.39 3.41 -0.71 -4.99 113.62 106.62 2win n SER 870 Ca -0.06 -2.60 -0.25 0.00 -0.26 0.00 0.00 58.87 55.70 2win n SER 870 Cb 0.58 2.91 -0.10 0.00 -0.26 0.00 0.00 64.21 67.34 2win n SER 870 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2win s SER 871 N -2.94 2.94 -0.21 4.04 1.04 -1.26 -1.12 113.70 116.18 2win s SER 871 Ca 0.21 -1.47 -0.07 0.00 0.48 0.00 0.00 55.95 55.09 2win s SER 871 Cb -0.03 0.06 0.09 0.00 0.10 0.00 0.00 66.02 66.25 2win s SER 871 CO 0.15 -0.68 0.44 -0.22 0.98 0.00 0.00 173.24 173.91 2win s LEU 872 N -3.60 -0.66 0.24 2.42 2.96 -0.79 -4.87 118.68 114.38 2win s LEU 872 Ca 0.30 1.05 -0.24 0.00 -0.22 0.00 0.00 54.13 55.02 2win s LEU 872 Cb 0.07 1.45 -0.09 0.00 0.50 0.00 0.00 46.19 48.12 2win s LEU 872 CO 0.14 -0.23 0.82 -0.55 -1.32 0.00 0.00 176.35 175.21 2win s SER 873 N 2.56 7.26 -0.22 3.68 0.15 -1.26 -0.59 113.70 125.28 2win s SER 873 Ca -0.03 1.64 -0.01 0.00 0.70 0.00 0.00 55.95 58.25 2win s SER 873 Cb -0.12 -2.50 0.06 0.00 -1.71 0.00 0.00 66.02 61.76 2win s SER 873 CO -0.13 0.05 -0.00 -0.69 1.20 0.00 0.00 173.24 173.66 2win s VAL 874 N -1.44 1.08 0.64 4.45 1.01 -0.74 -4.81 120.40 120.58 2win s VAL 874 Ca 0.43 -0.98 -0.17 0.00 0.00 0.00 0.00 61.98 61.27 2win s VAL 874 Cb -0.19 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.69 2win s VAL 874 CO 0.24 -0.20 1.18 -2.84 0.00 0.00 0.00 175.10 173.48 2win s PRO 875 N 1.60 2.76 -0.26 2.72 0.02 -1.26 -2.00 135.00 138.57 2win s PRO 875 Ca -0.02 1.68 -0.03 0.00 0.02 0.00 0.00 61.00 62.65 2win s PRO 875 Cb -0.18 -1.92 0.15 0.00 0.02 0.00 0.00 34.50 32.57 2win s PRO 875 CO -0.08 -1.34 0.45 0.71 -0.33 0.00 0.00 177.00 176.41 2win s TYR 876 N -1.89 -1.08 -0.14 6.54 2.02 -0.85 -4.94 117.35 117.00 2win s TYR 876 Ca 0.74 1.18 -0.23 0.00 -0.37 0.00 0.00 57.07 58.39 2win s TYR 876 Cb -0.27 0.22 -0.03 0.00 -0.40 0.00 0.00 41.96 41.49 2win s TYR 876 CO 0.37 -0.76 0.70 0.14 -1.57 0.00 0.00 175.55 174.44 2win s VAL 877 N 2.66 5.00 0.07 0.71 -7.23 -1.26 -1.44 120.40 118.90 2win s VAL 877 Ca 0.14 1.38 0.00 0.00 -1.81 0.00 0.00 61.98 61.70 2win s VAL 877 Cb -0.15 -4.02 -0.04 0.00 0.56 0.00 0.00 36.38 32.73 2win s VAL 877 CO -0.17 0.14 -0.05 0.27 -0.31 0.00 0.00 175.10 174.98 2win s ILE 878 N 1.57 0.43 -0.23 -0.62 -4.36 -0.98 -4.55 121.20 112.46 2win s ILE 878 Ca 0.34 -1.84 -0.03 0.00 -0.26 0.00 0.00 60.65 58.86 2win s ILE 878 Cb -0.17 -1.56 0.07 0.00 1.25 0.00 0.00 42.46 42.06 2win s ILE 878 CO 0.13 -0.93 0.07 -0.69 0.24 0.00 0.00 174.94 173.77 2win s VAL 879 N -3.71 0.37 0.30 8.37 1.01 -1.19 -2.48 120.40 123.07 2win s VAL 879 Ca 0.08 -0.67 -0.29 0.00 0.00 0.00 0.00 61.98 61.10 2win s VAL 879 Cb 0.06 -1.05 -0.13 0.00 0.00 0.00 0.00 36.38 35.26 2win s VAL 879 CO -0.07 -0.40 1.38 -2.65 0.00 0.00 0.00 175.10 173.35 2win n PRO 880 N 5.09 2.19 -0.04 2.72 -0.02 -1.26 -2.14 135.00 141.54 2win n PRO 880 Ca -0.07 0.77 -0.05 0.00 -2.02 0.00 0.00 63.50 62.13 2win n PRO 880 Cb 0.46 -2.41 -0.04 0.00 -0.02 0.00 0.00 33.50 31.49 2win n PRO 880 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2win n LEU 881 N 1.43 2.34 -4.25 2.45 4.77 0.23 -1.24 117.00 122.73 2win n LEU 881 Ca 0.07 -0.03 -0.29 0.00 -0.03 0.00 0.00 56.01 55.73 2win n LEU 881 Cb 0.35 -0.18 -0.16 0.00 -2.33 0.00 0.00 43.42 41.10 2win n LEU 881 CO 0.63 0.53 -0.54 -1.59 -1.33 0.00 0.00 177.39 175.08 2win s LYS 882 N -2.15 1.89 0.97 3.23 -2.85 -1.25 -4.79 119.74 114.79 2win s LYS 882 Ca -0.09 -0.81 -0.12 0.00 -1.00 0.00 0.00 55.97 53.95 2win s LYS 882 Cb 0.03 -1.80 0.17 0.00 -2.06 0.00 0.00 37.83 34.17 2win s LYS 882 CO 0.19 0.47 1.09 0.95 0.10 0.00 0.00 175.35 178.16 2win s THR 883 N -0.49 2.19 0.00 3.79 -4.23 -1.26 -4.88 115.64 110.76 2win s THR 883 Ca 0.07 0.06 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 2win s THR 883 Cb -0.09 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.18 2win s THR 883 CO -0.00 -0.08 0.00 0.61 -0.54 0.00 0.00 174.62 174.60 2win n GLY 884 N -1.15 1.29 3.56 3.99 0.00 -0.85 -4.86 105.19 107.15 2win n GLY 884 Ca 0.06 -2.07 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 2win n GLY 884 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2win s LEU 885 N 0.00 3.20 0.00 0.99 2.96 -1.26 -2.39 118.68 122.18 2win s LEU 885 Ca 0.00 -0.14 -0.08 0.00 -0.22 0.00 0.00 54.13 53.68 2win s LEU 885 Cb 0.00 -2.54 0.17 0.00 0.50 0.00 0.00 46.19 44.32 2win s LEU 885 CO 0.00 -2.72 1.10 0.00 -1.32 0.00 0.00 176.35 173.41 2win n GLN 886 N 8.98 -0.68 -3.76 1.98 1.13 -0.97 -4.91 117.38 119.16 2win n GLN 886 Ca 0.33 -2.20 -0.21 0.00 -1.94 0.00 0.00 57.00 52.98 2win n GLN 886 Cb 0.49 -0.97 -0.18 0.00 0.11 0.00 0.00 30.24 29.69 2win n GLN 886 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 2win s GLU 887 N -5.34 0.36 -0.14 -1.09 2.12 -1.26 -2.75 118.70 110.59 2win s GLU 887 Ca 0.66 0.19 -0.03 0.00 0.36 0.00 0.00 54.97 56.15 2win s GLU 887 Cb -0.03 -0.77 -0.03 0.00 0.26 0.00 0.00 34.13 33.56 2win s GLU 887 CO 0.45 -0.29 -0.02 0.08 -0.54 0.00 0.00 175.26 174.94 2win s VAL 888 N 1.93 4.10 -0.05 3.70 1.01 -0.83 -4.98 120.40 125.29 2win s VAL 888 Ca 0.03 -0.30 0.00 0.00 0.00 0.00 0.00 61.98 61.72 2win s VAL 888 Cb -0.12 -2.78 0.02 0.00 0.00 0.00 0.00 36.38 33.50 2win s VAL 888 CO -0.04 0.52 -0.03 -0.70 0.00 0.00 0.00 175.10 174.85 2win s GLU 889 N -0.00 0.71 0.01 2.72 2.12 -1.26 -2.68 118.70 120.32 2win s GLU 889 Ca 0.02 -0.03 0.05 0.00 0.36 0.00 0.00 54.97 55.37 2win s GLU 889 Cb -0.13 -0.84 -0.02 0.00 0.26 0.00 0.00 34.13 33.40 2win s GLU 889 CO 0.02 -0.15 -0.16 0.14 -0.54 0.00 0.00 175.26 174.57 2win s VAL 890 N 1.23 1.30 0.11 3.70 -7.23 -0.76 -2.20 120.40 116.55 2win s VAL 890 Ca -0.06 -0.85 0.06 0.00 -1.81 0.00 0.00 61.98 59.31 2win s VAL 890 Cb -0.14 -1.11 -0.04 0.00 0.56 0.00 0.00 36.38 35.65 2win s VAL 890 CO -0.02 0.25 -0.14 -0.54 -0.31 0.00 0.00 175.10 174.34 2win s LYS 891 N -0.69 0.97 -0.22 4.82 1.02 -0.46 -0.69 119.74 124.49 2win s LYS 891 Ca 0.05 -1.18 -0.18 0.00 0.02 0.00 0.00 55.97 54.68 2win s LYS 891 Cb -0.07 -0.86 0.06 0.00 -0.52 0.00 0.00 37.83 36.44 2win s LYS 891 CO 0.00 0.17 0.57 0.00 -0.92 0.00 0.00 175.35 175.18 2win s ALA 892 N -2.00 -1.45 0.06 5.17 0.00 -1.19 -0.18 121.76 122.16 2win s ALA 892 Ca 0.07 1.75 0.04 0.00 0.00 0.00 0.00 51.96 53.82 2win s ALA 892 Cb -0.06 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.01 2win s ALA 892 CO 0.03 -0.29 -0.11 0.00 0.00 0.00 0.00 175.76 175.39 2win s ALA 893 N 0.68 0.87 0.05 0.00 0.00 -0.79 -2.22 121.76 120.35 2win s ALA 893 Ca -0.03 -0.88 -0.05 0.00 0.00 0.00 0.00 51.96 50.99 2win s ALA 893 Cb -0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 2win s ALA 893 CO -0.05 0.07 0.29 0.14 0.00 0.00 0.00 175.76 176.22 2win s VAL 894 N -1.35 5.27 0.34 0.00 -7.23 -1.12 -0.60 120.40 115.71 2win s VAL 894 Ca -0.06 0.08 -0.26 0.00 -1.81 0.00 0.00 61.98 59.93 2win s VAL 894 Cb -0.10 -3.59 -0.09 0.00 0.56 0.00 0.00 36.38 33.15 2win s VAL 894 CO 0.01 0.25 1.00 -0.31 -0.31 0.00 0.00 175.10 175.74 2win s TYR 895 N -1.42 3.54 0.00 2.82 1.51 0.28 -4.07 117.35 120.01 2win s TYR 895 Ca 0.32 1.73 0.00 0.00 -1.01 0.00 0.00 57.07 58.11 2win s TYR 895 Cb -0.13 -3.04 0.00 0.00 -0.11 0.00 0.00 41.96 38.68 2win s TYR 895 CO 0.20 -0.16 0.00 0.72 -1.11 0.00 0.00 175.55 175.19 2win n HIS 896 N 0.46 0.00 -2.50 2.71 8.25 -0.25 -4.71 115.22 119.18 2win n HIS 896 Ca 0.02 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.07 2win n HIS 896 Cb 0.49 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.56 2win n HIS 896 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2win s HIS 897 N 0.00 3.58 -1.22 4.41 3.76 -1.26 -4.97 115.29 119.60 2win s HIS 897 Ca 0.00 1.58 -0.07 0.00 -0.15 0.00 0.00 55.06 56.43 2win s HIS 897 Cb 0.00 -3.29 0.21 0.00 1.11 0.00 0.00 32.58 30.61 2win s HIS 897 CO 0.00 -0.65 1.87 1.19 -0.85 0.00 0.00 174.74 176.29 2win n PHE 898 N 2.41 2.66 -4.20 1.40 3.01 -1.26 -4.40 117.46 117.08 2win n PHE 898 Ca 0.03 -2.72 -0.15 0.00 1.01 0.00 0.00 57.45 55.63 2win n PHE 898 Cb 0.46 -1.69 -0.11 0.00 -0.01 0.00 0.00 39.48 38.14 2win n PHE 898 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2win s ILE 899 N -1.09 1.04 0.12 4.37 1.01 -1.26 -5.08 121.20 120.31 2win s ILE 899 Ca 0.40 -1.73 -0.26 0.00 0.00 0.00 0.00 60.65 59.06 2win s ILE 899 Cb 0.11 -1.48 0.07 0.00 0.01 0.00 0.00 42.46 41.17 2win s ILE 899 CO 0.00 -0.57 0.91 -0.94 0.00 0.00 0.00 174.94 174.34 2win s SER 900 N -2.58 -0.25 -0.30 3.58 1.04 -1.26 -2.78 113.70 111.15 2win s SER 900 Ca 0.08 -0.29 -0.14 0.00 0.48 0.00 0.00 55.95 56.08 2win s SER 900 Cb -0.02 0.48 0.15 0.00 0.10 0.00 0.00 66.02 66.73 2win s SER 900 CO 0.00 -0.86 0.93 -0.62 0.98 0.00 0.00 173.24 173.68 2win s ASP 901 N -2.81 -0.66 0.08 7.02 2.15 -0.94 -4.97 116.67 116.54 2win s ASP 901 Ca 0.10 0.93 0.05 0.00 0.43 0.00 0.00 52.55 54.05 2win s ASP 901 Cb -0.02 1.67 -0.04 0.00 -0.30 0.00 0.00 42.92 44.24 2win s ASP 901 CO -0.01 -0.13 -0.01 -0.83 -0.17 0.00 0.00 175.17 174.02 2win s GLY 902 N 2.31 1.90 -0.12 2.66 0.00 -1.26 -3.20 107.32 109.61 2win s GLY 902 Ca -0.04 -1.10 0.01 0.00 0.00 0.00 0.00 44.72 43.58 2win s GLY 902 CO -0.17 -1.07 -0.14 0.14 0.00 0.00 0.00 173.10 171.86 2win s VAL 903 N -1.28 1.45 -0.65 1.40 1.01 0.13 0.14 120.40 122.61 2win s VAL 903 Ca 0.25 -0.60 0.06 0.00 0.00 0.00 0.00 61.98 61.69 2win s VAL 903 Cb -0.12 -1.35 0.24 0.00 0.00 0.00 0.00 36.38 35.16 2win s VAL 903 CO 0.17 0.43 0.73 -1.14 0.00 0.00 0.00 175.10 175.29 2win n ARG 904 N 4.43 2.48 -2.39 2.72 0.63 -0.22 -1.83 116.66 122.48 2win n ARG 904 Ca -0.18 -4.66 -0.27 0.00 -0.92 0.00 0.00 57.85 51.82 2win n ARG 904 Cb 0.51 -2.26 0.03 0.00 0.45 0.00 0.00 32.46 31.18 2win n ARG 904 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 2win s LYS 905 N -2.40 2.97 -0.03 -0.14 1.02 -1.09 -4.57 119.74 115.50 2win s LYS 905 Ca 0.39 0.04 0.05 0.00 0.02 0.00 0.00 55.97 56.46 2win s LYS 905 Cb 0.13 -2.27 -0.01 0.00 -0.52 0.00 0.00 37.83 35.17 2win s LYS 905 CO -0.02 -0.67 -0.16 -1.12 -0.92 0.00 0.00 175.35 172.45 2win s SER 906 N -4.29 2.00 0.03 2.83 0.01 -1.26 -1.96 113.70 111.06 2win s SER 906 Ca 0.54 -0.32 0.08 0.00 1.31 0.00 0.00 55.95 57.55 2win s SER 906 Cb -0.11 -0.40 -0.02 0.00 0.21 0.00 0.00 66.02 65.70 2win s SER 906 CO 0.45 0.17 -0.22 -1.48 0.41 0.00 0.00 173.24 172.57 2win s LEU 907 N -0.14 2.13 0.08 2.44 2.34 -1.11 -4.97 118.68 119.44 2win s LEU 907 Ca 0.01 -0.50 -0.30 0.00 0.06 0.00 0.00 54.13 53.39 2win s LEU 907 Cb -0.09 -1.10 -0.06 0.00 -0.56 0.00 0.00 46.19 44.38 2win s LEU 907 CO 0.01 0.22 1.15 -0.54 -1.06 0.00 0.00 176.35 176.13 2win s LYS 908 N -0.99 4.48 -0.43 1.48 1.02 -1.22 -2.28 119.74 121.80 2win s LYS 908 Ca 0.09 1.72 -0.06 0.00 0.02 0.00 0.00 55.97 57.74 2win s LYS 908 Cb -0.09 -3.34 0.11 0.00 -0.52 0.00 0.00 37.83 33.99 2win s LYS 908 CO 0.01 -0.16 0.26 0.08 -0.92 0.00 0.00 175.35 174.62 2win s VAL 909 N 0.74 3.69 -0.12 3.17 1.01 -1.00 -1.80 120.40 126.09 2win s VAL 909 Ca 0.56 -1.91 -0.06 0.00 0.00 0.00 0.00 61.98 60.57 2win s VAL 909 Cb -0.29 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2win s VAL 909 CO 0.31 -0.71 0.12 -0.69 0.00 0.00 0.00 175.10 174.13 2win s VAL 910 N 1.24 5.31 0.00 2.92 1.01 -1.00 -2.01 120.40 127.88 2win s VAL 910 Ca 0.07 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.18 2win s VAL 910 Cb -0.24 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.83 2win s VAL 910 CO -0.02 0.61 0.00 -0.81 0.00 0.00 0.00 175.10 174.87 2win n PRO 911 N 2.09 1.15 -3.78 2.72 -0.04 -1.26 -2.43 135.00 133.44 2win n PRO 911 Ca -0.20 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 62.90 2win n PRO 911 Cb 0.55 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.88 2win n PRO 911 CO 0.00 0.00 0.00 -1.83 -0.04 0.00 0.00 175.50 173.63 2win s GLU 912 N -0.06 2.43 0.19 0.54 -1.05 -1.26 -4.48 118.70 115.00 2win s GLU 912 Ca 0.00 -1.38 -0.16 0.00 -0.15 0.00 0.00 54.97 53.27 2win s GLU 912 Cb 0.00 -3.45 0.06 0.00 -0.44 0.00 0.00 34.13 30.30 2win s GLU 912 CO 0.00 -0.78 0.79 0.41 0.95 0.00 0.00 175.26 176.63 2win n GLY 913 N 4.72 0.83 2.90 -3.83 0.00 -1.26 -4.80 105.19 103.74 2win n GLY 913 Ca -0.10 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.64 2win n GLY 913 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2win s ILE 914 N -2.18 0.20 0.61 -0.61 2.07 0.38 -4.85 121.20 116.83 2win s ILE 914 Ca 0.17 -0.07 -0.19 0.00 -1.41 0.00 0.00 60.65 59.15 2win s ILE 914 Cb -0.03 -0.20 -0.02 0.00 0.13 0.00 0.00 42.46 42.34 2win s ILE 914 CO 0.06 0.08 1.30 -0.13 -1.91 0.00 0.00 174.94 174.33 2win s ARG 915 N 0.15 2.76 -0.16 3.50 1.81 -1.26 0.12 118.95 125.87 2win s ARG 915 Ca -0.01 2.07 -0.29 0.00 -1.72 0.00 0.00 55.73 55.77 2win s ARG 915 Cb -0.04 -1.96 0.11 0.00 -0.45 0.00 0.00 34.95 32.62 2win s ARG 915 CO -0.00 -1.44 0.92 -1.64 -0.68 0.00 0.00 175.30 172.45 2win s MET 916 N -3.26 0.69 -0.62 3.54 -1.94 -0.91 -4.72 119.30 112.09 2win s MET 916 Ca 0.79 0.27 0.06 0.00 -1.71 0.00 0.00 55.69 55.11 2win s MET 916 Cb -0.37 0.33 0.25 0.00 2.01 0.00 0.00 34.83 37.04 2win s MET 916 CO 0.41 -0.19 0.72 0.27 -0.01 0.00 0.00 175.02 176.21 2win n ASN 917 N 1.07 3.45 -4.75 3.03 0.23 -1.26 -2.19 115.26 114.84 2win n ASN 917 Ca -0.13 -3.38 -0.41 0.00 -0.53 0.00 0.00 54.58 50.13 2win n ASN 917 Cb 0.57 -0.67 -0.02 0.00 -2.08 0.00 0.00 39.78 37.59 2win n ASN 917 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 2win s LYS 918 N -2.35 4.19 -0.21 -3.83 1.02 -1.14 -4.76 119.74 112.66 2win s LYS 918 Ca 0.39 2.46 -0.25 0.00 0.02 0.00 0.00 55.97 58.59 2win s LYS 918 Cb 0.15 -3.05 -0.01 0.00 -0.52 0.00 0.00 37.83 34.40 2win s LYS 918 CO -0.02 -0.52 0.86 0.99 -0.92 0.00 0.00 175.35 175.73 2win s THR 919 N -0.18 4.84 -0.00 2.17 2.01 -1.26 -2.23 115.64 120.98 2win s THR 919 Ca 0.60 1.66 -0.09 0.00 0.31 0.00 0.00 61.69 64.17 2win s THR 919 Cb -0.45 -4.15 -0.05 0.00 0.01 0.00 0.00 72.50 67.86 2win s THR 919 CO 0.48 -0.04 0.73 0.58 -0.69 0.00 0.00 174.62 175.68 2win h VAL 920 N 5.33 0.00 -2.33 3.82 2.07 -1.78 -3.49 116.25 119.87 2win h VAL 920 Ca -0.25 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.12 2win h VAL 920 Cb 1.11 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.71 2win h VAL 920 CO 0.87 0.00 0.29 0.00 0.02 0.00 0.00 177.57 178.75 2win s ALA 921 N -3.61 -1.74 -0.30 1.67 0.00 -1.21 -5.02 121.76 111.54 2win s ALA 921 Ca -0.05 1.02 -0.03 0.00 0.00 0.00 0.00 51.96 52.90 2win s ALA 921 Cb 0.00 0.28 0.10 0.00 0.00 0.00 0.00 23.12 23.51 2win s ALA 921 CO 0.14 -0.55 0.14 0.14 0.00 0.00 0.00 175.76 175.62 2win s VAL 922 N -2.38 0.01 0.26 0.00 -7.23 -1.26 -2.41 120.40 107.39 2win s VAL 922 Ca -0.03 -0.89 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 2win s VAL 922 Cb -0.01 -1.04 -0.06 0.00 0.56 0.00 0.00 36.38 35.84 2win s VAL 922 CO -0.02 -0.75 -0.03 -0.13 -0.31 0.00 0.00 175.10 173.86 2win s ARG 923 N 1.97 1.45 -0.14 4.82 0.52 -1.09 -5.03 118.95 121.46 2win s ARG 923 Ca 0.10 -1.74 -0.09 0.00 -0.52 0.00 0.00 55.73 53.48 2win s ARG 923 Cb -0.17 -0.88 -0.04 0.00 0.52 0.00 0.00 34.95 34.37 2win s ARG 923 CO -0.33 -0.04 0.18 0.99 0.02 0.00 0.00 175.30 176.12 2win s THR 924 N -3.22 5.42 -0.35 0.02 2.01 -1.26 -2.01 115.64 116.25 2win s THR 924 Ca 0.29 0.29 -0.07 0.00 0.31 0.00 0.00 61.69 62.51 2win s THR 924 Cb 0.05 -3.47 0.04 0.00 0.01 0.00 0.00 72.50 69.13 2win s THR 924 CO 0.10 0.55 0.13 -0.76 -0.69 0.00 0.00 174.62 173.95 2win s LEU 925 N -0.51 4.43 -0.38 4.42 1.43 -1.13 -4.95 118.68 121.99 2win s LEU 925 Ca 0.14 -1.13 0.07 0.00 -1.03 0.00 0.00 54.13 52.18 2win s LEU 925 Cb -0.12 -1.90 0.18 0.00 0.03 0.00 0.00 46.19 44.38 2win s LEU 925 CO 0.03 -0.35 0.59 -0.62 0.23 0.00 0.00 176.35 176.23 2win s ASP 926 N 1.46 -1.21 0.28 2.29 2.15 -1.26 -2.32 116.67 118.06 2win s ASP 926 Ca -0.01 -0.66 -0.01 0.00 0.43 0.00 0.00 52.55 52.29 2win s ASP 926 Cb -0.20 1.81 0.45 0.00 -0.30 0.00 0.00 42.92 44.68 2win s ASP 926 CO 0.04 -0.21 1.91 -0.65 -0.17 0.00 0.00 175.17 176.09 2win h PRO 927 N 7.24 1.10 -0.05 4.34 0.11 -1.78 1.09 132.00 144.05 2win h PRO 927 Ca 0.03 -0.07 0.01 0.00 0.11 0.00 0.00 66.00 66.09 2win h PRO 927 Cb 1.17 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 2win h PRO 927 CO 0.13 0.73 0.12 1.49 -0.21 0.00 0.00 178.00 180.25 2win h GLU 928 N 1.13 0.00 0.00 1.05 4.57 -1.84 -3.33 114.58 116.16 2win h GLU 928 Ca 0.39 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.57 2win h GLU 928 Cb 0.10 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.69 2win h GLU 928 CO -0.14 0.00 -0.89 -2.13 -1.18 0.00 0.00 179.01 174.68 2win n ARG 929 N -3.36 0.00 -3.62 1.92 3.00 -0.57 -4.88 116.66 109.15 2win n ARG 929 Ca -0.02 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.48 2win n ARG 929 Cb 0.20 -0.47 -0.08 0.00 0.00 0.00 0.00 32.46 32.12 2win n ARG 929 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2win s LEU 930 N -5.99 4.22 0.00 6.15 1.43 0.37 -4.08 118.68 120.78 2win s LEU 930 Ca 0.00 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.47 2win s LEU 930 Cb 0.00 -2.24 0.00 0.00 0.03 0.00 0.00 46.19 43.98 2win s LEU 930 CO 0.00 0.13 0.00 0.61 0.23 0.00 0.00 176.35 177.32 2win n GLY 931 N 3.48 1.41 7.00 -3.19 0.00 -1.26 -4.10 105.19 108.53 2win n GLY 931 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2win n GLY 931 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2win n ARG 932 N -2.00 0.00 0.00 1.61 0.63 -1.26 -4.53 116.66 111.11 2win n ARG 932 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2win n ARG 932 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2win n ARG 932 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 2win n GLU 933 N 0.00 0.00 0.00 -0.14 2.13 -1.26 -4.29 120.64 117.08 2win n GLU 933 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2win n GLU 933 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 2win n GLU 933 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2win n GLY 934 N 0.00 0.00 2.25 8.31 0.00 -1.26 -5.06 105.19 109.42 2win n GLY 934 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2win n GLY 934 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2win n VAL 935 N 0.00 -0.10 -1.63 1.61 0.24 -1.26 -4.27 118.33 112.92 2win n VAL 935 Ca 0.00 -4.23 -0.50 0.00 -2.04 0.00 0.00 64.34 57.56 2win n VAL 935 Cb 0.00 -1.98 -0.05 0.00 -1.47 0.00 0.00 33.84 30.34 2win n VAL 935 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2win n GLN 936 N 1.35 1.51 -4.21 7.34 7.27 -1.09 -4.75 117.38 124.80 2win n GLN 936 Ca 0.23 0.55 -0.23 0.00 0.07 0.00 0.00 57.00 57.61 2win n GLN 936 Cb 0.50 -2.24 -0.06 0.00 2.41 0.00 0.00 30.24 30.85 2win n GLN 936 CO 0.00 0.00 0.00 -1.59 0.07 0.00 0.00 177.06 175.54 2win s LYS 937 N 0.97 2.56 -0.22 3.69 0.00 -1.26 -0.85 119.74 124.62 2win s LYS 937 Ca 0.84 -1.21 -0.04 0.00 0.00 0.00 0.00 55.97 55.56 2win s LYS 937 Cb -0.86 -2.36 0.12 0.00 0.00 0.00 0.00 37.83 34.72 2win s LYS 937 CO 0.45 0.40 0.37 -2.00 0.00 0.00 0.00 175.35 174.57 2win s GLU 938 N -3.57 0.32 0.02 1.78 2.56 0.76 -4.96 118.70 115.61 2win s GLU 938 Ca 0.31 0.66 -0.30 0.00 0.00 0.00 0.00 54.97 55.64 2win s GLU 938 Cb -0.08 -0.28 -0.04 0.00 2.00 0.00 0.00 34.13 35.73 2win s GLU 938 CO 0.22 -0.52 1.05 -0.51 -0.56 0.00 0.00 175.26 174.94 2win s ASP 939 N 2.54 7.27 -0.26 -1.70 1.01 -1.26 -0.99 116.67 123.28 2win s ASP 939 Ca 0.08 1.79 0.02 0.00 0.71 0.00 0.00 52.55 55.15 2win s ASP 939 Cb -0.14 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.28 2win s ASP 939 CO -0.14 -0.33 -0.07 -0.63 0.21 0.00 0.00 175.17 174.21 2win s ILE 940 N 1.00 1.97 0.36 0.77 1.01 -0.22 -4.98 121.20 121.11 2win s ILE 940 Ca 0.54 -1.61 -0.28 0.00 0.00 0.00 0.00 60.65 59.31 2win s ILE 940 Cb -0.24 -2.18 -0.10 0.00 0.01 0.00 0.00 42.46 39.95 2win s ILE 940 CO 0.28 -0.14 1.32 -2.84 0.00 0.00 0.00 174.94 173.57 2win s PRO 941 N 1.17 4.21 0.96 2.79 0.02 -1.26 -2.70 135.00 140.18 2win s PRO 941 Ca -0.05 2.23 -0.12 0.00 0.02 0.00 0.00 61.00 63.08 2win s PRO 941 Cb -0.19 -2.96 0.16 0.00 0.02 0.00 0.00 34.50 31.53 2win s PRO 941 CO -0.06 -0.32 1.12 -1.25 -0.33 0.00 0.00 177.00 176.15 2win s PRO 942 N -1.97 0.77 -0.19 5.54 0.04 -1.26 -4.88 135.00 133.05 2win s PRO 942 Ca 0.52 0.39 -0.29 0.00 0.04 0.00 0.00 61.00 61.66 2win s PRO 942 Cb -0.40 -1.79 -0.00 0.00 0.04 0.00 0.00 34.50 32.35 2win s PRO 942 CO 0.53 -2.47 1.09 0.00 0.04 0.00 0.00 177.00 176.19 2win s ALA 943 N -3.13 3.64 0.15 8.56 0.00 -1.26 -4.93 121.76 124.79 2win s ALA 943 Ca 0.65 0.29 -0.11 0.00 0.00 0.00 0.00 51.96 52.78 2win s ALA 943 Cb -0.17 -3.55 0.01 0.00 0.00 0.00 0.00 23.12 19.42 2win s ALA 943 CO 0.55 -1.00 1.58 0.38 0.00 0.00 0.00 175.76 177.27 2win h ASP 944 N 7.57 0.94 -6.72 0.00 -0.00 -2.00 -3.47 116.42 112.73 2win h ASP 944 Ca -0.23 -0.35 -0.19 0.00 -0.00 0.00 0.00 57.03 56.26 2win h ASP 944 Cb 1.09 -0.25 -0.00 0.00 -0.00 0.00 0.00 39.33 40.16 2win h ASP 944 CO 0.96 1.07 -0.35 0.00 -0.00 0.00 0.00 179.24 180.91 2win n LEU 945 N -4.23 -0.22 0.14 0.15 -0.00 -1.26 -4.73 117.00 106.84 2win n LEU 945 Ca 0.01 -0.40 0.11 0.00 -0.00 0.00 0.00 56.01 55.72 2win n LEU 945 Cb 0.38 -0.53 0.51 0.00 -0.00 0.00 0.00 43.42 43.78 2win n LEU 945 CO 0.44 0.23 0.82 -1.54 -0.00 0.00 0.00 177.39 177.35 2win n SER 946 N -0.24 0.56 -1.66 1.45 3.41 -1.26 -2.37 113.62 113.51 2win n SER 946 Ca -0.06 0.70 -0.17 0.00 -0.26 0.00 0.00 58.87 59.09 2win n SER 946 Cb 0.20 -0.80 0.09 0.00 -0.26 0.00 0.00 64.21 63.45 2win n SER 946 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2win n ASP 947 N -2.19 4.24 -4.67 4.04 5.75 -1.26 -5.01 116.55 117.45 2win n ASP 947 Ca 0.00 -3.79 -0.41 0.00 -0.01 0.00 0.00 54.79 50.58 2win n ASP 947 Cb 0.11 -0.50 -0.05 0.00 -1.03 0.00 0.00 41.12 39.65 2win n ASP 947 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 2win s GLN 948 N -3.50 4.26 0.05 0.11 0.74 -1.00 -1.29 119.66 119.02 2win s GLN 948 Ca 0.49 0.83 -0.31 0.00 0.05 0.00 0.00 55.36 56.42 2win s GLN 948 Cb 0.41 -3.57 -0.10 0.00 1.10 0.00 0.00 33.01 30.85 2win s GLN 948 CO 0.01 -0.28 1.92 0.28 -0.55 0.00 0.00 175.29 176.67 2win n VAL 949 N 4.69 0.62 -1.57 1.34 0.31 -1.22 -4.91 118.33 117.58 2win n VAL 949 Ca 0.02 -0.11 -0.39 0.00 -0.01 0.00 0.00 64.34 63.84 2win n VAL 949 Cb 0.49 -2.19 0.03 0.00 -0.91 0.00 0.00 33.84 31.26 2win n VAL 949 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2win n PRO 950 N 6.80 0.95 -2.42 5.55 -0.02 -1.26 -3.19 135.00 141.41 2win n PRO 950 Ca 0.20 0.35 -0.09 0.00 -2.02 0.00 0.00 63.50 61.94 2win n PRO 950 Cb 0.38 -1.98 0.01 0.00 -0.02 0.00 0.00 33.50 31.89 2win n PRO 950 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2win n ASP 951 N 0.07 -3.25 -4.17 2.55 2.03 -1.26 -5.04 116.55 107.47 2win n ASP 951 Ca 0.12 -0.08 -0.21 0.00 0.52 0.00 0.00 54.79 55.14 2win n ASP 951 Cb 0.44 -2.30 -0.13 0.00 -0.72 0.00 0.00 41.12 38.41 2win n ASP 951 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 2win s THR 952 N -2.66 1.22 0.31 5.18 -4.23 -1.19 -5.05 115.64 109.22 2win s THR 952 Ca 0.08 -1.13 -0.08 0.00 -1.18 0.00 0.00 61.69 59.38 2win s THR 952 Cb -0.03 -1.12 -0.06 0.00 1.34 0.00 0.00 72.50 72.63 2win s THR 952 CO 0.10 -0.03 0.62 -1.83 -0.54 0.00 0.00 174.62 172.94 2win s GLU 953 N -1.33 3.72 -0.16 3.99 4.04 -1.26 -5.03 118.70 122.67 2win s GLU 953 Ca 0.02 0.22 -0.08 0.00 0.04 0.00 0.00 54.97 55.16 2win s GLU 953 Cb -0.09 -2.57 0.06 0.00 0.02 0.00 0.00 34.13 31.56 2win s GLU 953 CO 0.02 0.16 0.37 -1.54 -1.84 0.00 0.00 175.26 172.43 2win s SER 954 N -2.96 -0.41 -0.00 0.83 1.04 -1.26 -4.51 113.70 106.42 2win s SER 954 Ca 0.47 0.81 0.00 0.00 0.48 0.00 0.00 55.95 57.71 2win s SER 954 Cb -0.11 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.71 2win s SER 954 CO 0.28 -0.19 0.05 -1.83 0.98 0.00 0.00 173.24 172.53 2win s GLU 955 N 1.50 2.96 -0.16 4.02 -1.05 -1.16 -3.80 118.70 121.01 2win s GLU 955 Ca -0.09 -0.53 -0.02 0.00 -0.15 0.00 0.00 54.97 54.18 2win s GLU 955 Cb -0.09 -2.79 -0.02 0.00 -0.44 0.00 0.00 34.13 30.79 2win s GLU 955 CO -0.12 0.64 -0.08 0.99 0.95 0.00 0.00 175.26 177.64 2win s THR 956 N -1.15 3.40 -0.17 1.83 2.01 0.12 -2.51 115.64 119.17 2win s THR 956 Ca 0.21 -0.52 -0.02 0.00 0.31 0.00 0.00 61.69 61.67 2win s THR 956 Cb -0.12 -2.48 -0.01 0.00 0.01 0.00 0.00 72.50 69.90 2win s THR 956 CO 0.12 0.49 -0.09 -0.60 -0.69 0.00 0.00 174.62 173.85 2win s ARG 957 N 0.64 3.39 -0.17 4.92 3.52 -0.96 -1.06 118.95 129.24 2win s ARG 957 Ca -0.05 -0.65 -0.10 0.00 -0.13 0.00 0.00 55.73 54.80 2win s ARG 957 Cb -0.15 -2.80 -0.05 0.00 -1.56 0.00 0.00 34.95 30.40 2win s ARG 957 CO 0.03 0.04 0.16 0.42 -0.81 0.00 0.00 175.30 175.14 2win s ILE 958 N 0.81 5.41 -0.16 4.11 1.01 0.94 -2.41 121.20 130.92 2win s ILE 958 Ca -0.03 0.27 0.01 0.00 0.00 0.00 0.00 60.65 60.89 2win s ILE 958 Cb -0.15 -3.48 0.02 0.00 0.01 0.00 0.00 42.46 38.86 2win s ILE 958 CO 0.01 0.48 -0.17 -0.22 0.00 0.00 0.00 174.94 175.04 2win s LEU 959 N -0.01 1.90 -0.20 2.97 0.20 -0.90 -1.47 118.68 121.16 2win s LEU 959 Ca 0.11 -0.56 -0.06 0.00 0.69 0.00 0.00 54.13 54.32 2win s LEU 959 Cb -0.12 -1.32 -0.03 0.00 -0.43 0.00 0.00 46.19 44.30 2win s LEU 959 CO 0.01 -0.02 0.02 -0.76 -0.29 0.00 0.00 176.35 175.31 2win s LEU 960 N 1.34 3.38 -0.04 -0.68 1.43 0.05 -2.38 118.68 121.78 2win s LEU 960 Ca 0.04 -0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.00 2win s LEU 960 Cb -0.13 -1.86 0.02 0.00 0.03 0.00 0.00 46.19 44.25 2win s LEU 960 CO -0.11 0.07 -0.04 -1.58 0.23 0.00 0.00 176.35 174.93 2win s GLN 961 N 0.95 0.71 -0.01 1.70 0.74 -0.84 -2.39 119.66 120.53 2win s GLN 961 Ca 0.02 -0.09 -0.27 0.00 0.05 0.00 0.00 55.36 55.07 2win s GLN 961 Cb -0.14 -0.74 -0.04 0.00 1.10 0.00 0.00 33.01 33.19 2win s GLN 961 CO 0.02 -0.06 0.87 0.20 -0.55 0.00 0.00 175.29 175.76 2win s GLY 962 N 0.81 2.81 -0.91 2.59 0.00 -1.26 -0.50 107.32 110.86 2win s GLY 962 Ca -0.10 0.39 -0.01 0.00 0.00 0.00 0.00 44.72 44.99 2win s GLY 962 CO -0.00 1.44 0.98 2.41 0.00 0.00 0.00 173.10 177.93 2win n THR 963 N 3.63 3.59 -2.46 0.90 -1.04 -0.92 -4.57 114.28 113.40 2win n THR 963 Ca 0.02 -5.36 -0.39 0.00 -2.04 0.00 0.00 64.05 56.29 2win n THR 963 Cb 0.51 -2.27 -0.04 0.00 -1.82 0.00 0.00 70.33 66.72 2win n THR 963 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 2win s PRO 964 N -1.95 4.35 -0.35 -2.82 0.02 -1.26 -4.62 135.00 128.37 2win s PRO 964 Ca 0.31 1.71 -0.00 0.00 0.02 0.00 0.00 61.00 63.04 2win s PRO 964 Cb 0.00 -2.86 0.12 0.00 0.02 0.00 0.00 34.50 31.78 2win s PRO 964 CO -0.04 -0.02 0.15 0.14 -0.33 0.00 0.00 177.00 176.90 2win s VAL 965 N -1.39 0.89 0.00 3.83 -7.23 -1.26 -5.11 120.40 110.12 2win s VAL 965 Ca 0.52 -1.74 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2win s VAL 965 Cb -0.28 -1.66 0.00 0.00 0.56 0.00 0.00 36.38 35.00 2win s VAL 965 CO 0.36 -0.78 0.00 0.00 -0.31 0.00 0.00 175.10 174.37 2win n ALA 966 N 4.40 0.00 0.00 1.32 0.00 -1.26 -4.37 120.51 120.60 2win n ALA 966 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2win n ALA 966 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 2win n ALA 966 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2win n GLN 967 N 0.00 0.00 0.00 0.00 1.13 -1.26 -4.93 117.38 112.32 2win n GLN 967 Ca 0.00 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.06 2win n GLN 967 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.35 2win n GLN 967 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 2win n MET 968 N 1.39 0.00 -4.14 -1.09 2.81 -1.26 -4.98 117.12 109.84 2win n MET 968 Ca 0.00 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.75 2win n MET 968 Cb 0.00 0.00 -0.11 0.00 -0.71 0.00 0.00 33.22 32.40 2win n MET 968 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2win s THR 969 N 0.00 0.84 0.00 2.03 -4.23 -1.26 -4.62 115.64 108.40 2win s THR 969 Ca 0.00 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 2win s THR 969 Cb 0.00 -1.12 0.00 0.00 1.34 0.00 0.00 72.50 72.72 2win s THR 969 CO 0.00 -0.47 0.00 -0.62 -0.54 0.00 0.00 174.62 172.99 2win n GLU 970 N 0.90 0.00 -0.95 3.99 -0.58 -1.26 -5.14 120.64 117.59 2win n GLU 970 Ca -0.19 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.55 2win n GLU 970 Cb 0.56 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.43 2win n GLU 970 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2win n ASP 971 N 0.00 0.00 -2.67 1.62 8.00 -1.26 -5.19 116.55 117.05 2win n ASP 971 Ca 0.00 -0.67 -0.13 0.00 0.71 0.00 0.00 54.79 54.70 2win n ASP 971 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2win n ASP 971 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2win n ALA 972 N -3.00 0.31 -1.77 2.24 0.00 -1.26 -5.07 120.51 111.96 2win n ALA 972 Ca 0.00 -1.08 -0.39 0.00 0.00 0.00 0.00 53.44 51.97 2win n ALA 972 Cb 0.00 0.75 0.00 0.00 0.00 0.00 0.00 19.45 20.20 2win n ALA 972 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2win s VAL 973 N -2.39 2.51 0.27 0.00 1.01 -1.26 -4.92 120.40 115.63 2win s VAL 973 Ca 0.12 0.44 -0.03 0.00 0.00 0.00 0.00 61.98 62.51 2win s VAL 973 Cb 0.01 -3.25 0.27 0.00 0.00 0.00 0.00 36.38 33.40 2win s VAL 973 CO 0.08 0.05 1.92 -0.78 0.00 0.00 0.00 175.10 176.37 2win h ASP 974 N 2.39 1.04 0.00 3.32 3.58 -2.00 -3.45 116.42 121.30 2win h ASP 974 Ca -0.50 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.94 2win h ASP 974 Cb 1.26 -0.24 0.00 0.00 1.72 0.00 0.00 39.33 42.07 2win h ASP 974 CO 0.61 0.71 0.00 0.00 -2.88 0.00 0.00 179.24 177.68 2win n ALA 975 N -2.38 0.00 0.03 -0.78 0.00 -1.26 -4.67 120.51 111.44 2win n ALA 975 Ca 0.13 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.60 2win n ALA 975 Cb 0.10 0.00 0.41 0.00 0.00 0.00 0.00 19.45 19.96 2win n ALA 975 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2win h GLU 976 N 0.09 0.46 -0.83 0.00 9.09 -1.88 -2.49 114.58 119.03 2win h GLU 976 Ca 0.00 -0.05 -0.58 0.00 0.05 0.00 0.00 59.36 58.78 2win h GLU 976 Cb 0.00 -0.09 -0.36 0.00 -1.65 0.00 0.00 28.75 26.65 2win h GLU 976 CO 0.00 0.38 -0.13 0.54 0.05 0.00 0.00 179.01 179.85 2win n ARG 977 N -4.41 3.18 -3.17 1.06 1.74 -1.26 -4.72 116.66 109.07 2win n ARG 977 Ca 0.02 -3.79 -0.22 0.00 -0.77 0.00 0.00 57.85 53.10 2win n ARG 977 Cb 0.13 -2.26 -0.05 0.00 -1.02 0.00 0.00 32.46 29.25 2win n ARG 977 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2win n LEU 978 N -0.81 0.24 -3.41 0.55 0.00 -0.94 -5.01 117.00 107.63 2win n LEU 978 Ca 0.51 -4.73 -0.29 0.00 0.00 0.00 0.00 56.01 51.49 2win n LEU 978 Cb 0.86 0.67 -0.06 0.00 0.00 0.00 0.00 43.42 44.89 2win n LEU 978 CO 0.54 2.13 0.26 0.29 0.00 0.00 0.00 177.39 180.61 2win n LYS 979 N 1.07 2.98 0.00 1.96 5.02 -1.26 -4.61 118.16 123.32 2win n LYS 979 Ca 0.22 -4.70 0.00 0.00 -2.02 0.00 0.00 58.31 51.81 2win n LYS 979 Cb 0.57 -2.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.29 2win n LYS 979 CO 0.00 0.00 0.00 -2.39 -0.52 0.00 0.00 177.40 174.49 2win n HIS 980 N 0.67 0.00 0.31 2.13 1.44 -1.26 -4.87 115.22 113.63 2win n HIS 980 Ca 0.30 0.00 0.16 0.00 -2.01 0.00 0.00 57.72 56.17 2win n HIS 980 Cb 0.39 0.00 0.74 0.00 0.12 0.00 0.00 29.99 31.24 2win n HIS 980 CO 0.00 0.00 0.00 -0.07 -2.81 0.00 0.00 176.34 173.46 2win h LEU 981 N 0.00 0.00 -5.28 2.39 3.38 -1.87 -3.30 115.31 110.62 2win h LEU 981 Ca 0.00 0.00 -0.67 0.00 0.09 0.00 0.00 57.88 57.30 2win h LEU 981 Cb 0.00 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.76 2win h LEU 981 CO 0.00 0.00 3.61 -0.38 0.09 0.00 0.00 178.44 181.76 2win n ILE 982 N -2.74 3.99 -3.06 1.22 2.08 -1.26 -1.14 119.36 118.45 2win n ILE 982 Ca -0.00 -2.61 -0.40 0.00 0.56 0.00 0.00 62.75 60.30 2win n ILE 982 Cb 0.20 -2.59 -0.05 0.00 -0.75 0.00 0.00 39.64 36.45 2win n ILE 982 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 2win s VAL 983 N 2.52 4.86 -0.33 1.39 1.01 -1.25 -5.00 120.40 123.61 2win s VAL 983 Ca 0.63 1.48 -0.29 0.00 0.00 0.00 0.00 61.98 63.80 2win s VAL 983 Cb 0.17 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 2win s VAL 983 CO -0.06 0.35 1.54 -0.89 0.00 0.00 0.00 175.10 176.03 2win s THR 984 N 0.14 3.78 0.20 3.92 2.01 -1.26 -4.64 115.64 119.79 2win s THR 984 Ca 0.36 0.84 -0.32 0.00 0.31 0.00 0.00 61.69 62.88 2win s THR 984 Cb -0.19 -3.94 -0.12 0.00 0.01 0.00 0.00 72.50 68.25 2win s THR 984 CO 0.20 -0.52 1.71 -2.65 -0.69 0.00 0.00 174.62 172.67 2win n PRO 985 N 7.95 2.69 -3.85 4.92 -0.02 -1.26 -4.91 135.00 140.53 2win n PRO 985 Ca 0.18 0.97 -0.07 0.00 -2.02 0.00 0.00 63.50 62.56 2win n PRO 985 Cb 0.47 -2.81 -0.01 0.00 -0.02 0.00 0.00 33.50 31.13 2win n PRO 985 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2win s SER 986 N 1.22 -0.20 0.00 2.55 1.04 -1.26 -4.84 113.70 112.20 2win s SER 986 Ca 0.76 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2win s SER 986 Cb -0.53 0.75 0.00 0.00 0.10 0.00 0.00 66.02 66.34 2win s SER 986 CO 0.33 -1.41 0.00 0.61 0.98 0.00 0.00 173.24 173.75 2win n GLY 987 N -0.48 0.14 0.00 7.32 0.00 -1.26 -2.91 105.19 108.01 2win n GLY 987 Ca -0.05 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2win n GLY 987 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2win n GLY 989 N 4.69 -0.94 0.12 0.00 0.00 -0.06 -3.89 105.19 105.11 2win n GLY 989 Ca 0.00 -0.60 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 2win n GLY 989 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2win h GLU 990 N 0.16 0.30 -0.13 1.61 4.11 -1.98 -3.22 114.58 115.43 2win h GLU 990 Ca 0.00 -0.52 -0.02 0.00 0.07 0.00 0.00 59.36 58.89 2win h GLU 990 Cb 0.52 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2win h GLU 990 CO 0.00 1.19 -0.03 1.96 0.07 0.00 0.00 179.01 182.19 2win h GLN 991 N 0.08 0.19 -0.01 1.06 4.20 -1.85 -1.59 115.11 117.19 2win h GLN 991 Ca -0.27 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.26 2win h GLN 991 Cb 2.05 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 29.77 2win h GLN 991 CO 0.17 0.24 -0.74 -0.97 -0.67 0.00 0.00 178.83 176.87 2win h ASN 992 N 0.19 0.12 -0.01 1.46 -1.24 -1.62 -3.10 115.58 111.38 2win h ASN 992 Ca 0.04 -0.08 -0.23 0.00 0.71 0.00 0.00 56.30 56.74 2win h ASN 992 Cb 0.19 -0.04 0.01 0.00 0.73 0.00 0.00 38.32 39.21 2win h ASN 992 CO 0.01 0.81 -0.88 0.24 -1.29 0.00 0.00 177.43 176.32 2win h MET 993 N 0.06 0.69 0.00 6.67 2.86 -1.40 -2.24 114.93 121.56 2win h MET 993 Ca -0.02 -0.63 -0.03 0.00 -2.06 0.00 0.00 59.70 56.97 2win h MET 993 Cb 1.30 0.15 -0.00 0.00 0.06 0.00 0.00 31.60 33.11 2win h MET 993 CO 0.10 1.23 -0.13 0.82 1.06 0.00 0.00 176.91 179.99 2win h ILE 994 N 0.44 1.09 0.00 -1.22 2.04 -1.33 0.96 117.51 119.49 2win h ILE 994 Ca -0.08 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.33 2win h ILE 994 Cb 1.51 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 38.83 2win h ILE 994 CO 0.17 0.13 -0.91 1.23 0.00 0.00 0.00 178.15 178.77 2win h GLY 995 N 0.40 0.00 0.59 5.37 0.00 -1.52 -3.34 103.07 104.56 2win h GLY 995 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2win h GLY 995 CO 0.02 0.00 -1.33 1.15 0.00 0.00 0.00 176.54 176.37 2win n MET 996 N -2.58 0.56 0.16 4.80 0.00 -0.85 -3.98 117.12 115.24 2win n MET 996 Ca 0.01 -0.01 -0.14 0.00 0.00 0.00 0.00 57.70 57.56 2win n MET 996 Cb 0.53 -1.68 -0.08 0.00 0.00 0.00 0.00 33.22 31.99 2win n MET 996 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 175.97 177.12 2win h THR 997 N 0.00 0.76 -0.85 3.17 2.02 -0.95 -2.16 112.91 114.90 2win h THR 997 Ca 0.00 -0.15 0.03 0.00 0.77 0.00 0.00 66.41 67.06 2win h THR 997 Cb 0.94 0.84 -0.05 0.00 -1.74 0.00 0.00 68.15 68.15 2win h THR 997 CO 0.00 0.03 0.56 1.55 0.37 0.00 0.00 175.52 178.03 2win h PRO 998 N -0.44 1.05 -0.16 6.66 0.13 -1.77 -2.32 132.00 135.16 2win h PRO 998 Ca -0.04 -0.06 -0.09 0.00 -0.87 0.00 0.00 66.00 64.94 2win h PRO 998 Cb 0.33 -0.24 -0.00 0.00 0.13 0.00 0.00 31.00 31.22 2win h PRO 998 CO 0.06 0.70 -0.26 1.15 -0.23 0.00 0.00 178.00 179.42 2win h THR 999 N 1.08 1.35 -0.31 1.56 2.02 -1.07 -2.07 112.91 115.47 2win h THR 999 Ca 0.33 -1.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.00 2win h THR 999 Cb -0.02 1.93 -0.01 0.00 -1.74 0.00 0.00 68.15 68.30 2win h THR 999 CO -0.09 0.45 0.12 0.58 0.37 0.00 0.00 175.52 176.95 2win h VAL 1000N 0.08 1.18 0.00 3.16 2.07 -1.24 -2.64 116.25 118.87 2win h VAL 1000Ca 0.01 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.97 2win h VAL 1000Cb 0.83 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.57 2win h VAL 1000CO 0.06 0.19 0.00 -0.29 0.02 0.00 0.00 177.57 177.55 2win h ILE 1001N 0.36 0.00 -0.04 4.57 6.09 -1.48 -2.86 117.51 124.14 2win h ILE 1001Ca 0.10 -0.56 -0.09 0.00 -1.37 0.00 0.00 64.86 62.95 2win h ILE 1001Cb 0.19 1.49 0.01 0.00 0.47 0.00 0.00 36.82 38.97 2win h ILE 1001CO -0.01 0.00 -0.32 0.00 -3.07 0.00 0.00 178.15 174.75 2win h ALA 1002N 2.17 0.10 -0.41 0.18 0.00 -1.03 -2.84 119.26 117.43 2win h ALA 1002Ca 0.00 -0.46 -0.12 0.00 0.00 0.00 0.00 54.91 54.33 2win h ALA 1002Cb 0.64 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2win h ALA 1002CO 0.00 0.17 -0.24 0.28 0.00 0.00 0.00 179.25 179.46 2win h VAL 1003N -0.25 1.27 0.00 0.00 2.07 -1.46 -1.81 116.25 116.07 2win h VAL 1003Ca -0.03 -1.37 -0.04 0.00 0.82 0.00 0.00 66.70 66.08 2win h VAL 1003Cb 1.00 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 2win h VAL 1003CO 0.07 0.46 -0.21 -0.74 0.02 0.00 0.00 177.57 177.17 2win h HIS 1004N 0.72 0.00 0.20 1.57 6.17 -1.58 -1.45 115.15 120.79 2win h HIS 1004Ca 0.09 0.00 -0.34 0.00 0.71 0.00 0.00 60.37 60.84 2win h HIS 1004Cb 0.77 0.00 0.02 0.00 2.52 0.00 0.00 27.41 30.72 2win h HIS 1004CO 0.04 0.21 -1.61 -0.92 0.71 0.00 0.00 177.93 176.36 2win h TYR 1005N 0.00 0.77 0.00 5.26 3.20 -1.27 -3.24 116.97 121.69 2win h TYR 1005Ca -0.00 -0.56 -0.05 0.00 3.14 0.00 0.00 58.73 61.26 2win h TYR 1005Cb 0.37 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 2win h TYR 1005CO 0.00 1.58 -0.23 -0.07 -1.64 0.00 0.00 178.16 177.81 2win h LEU 1006N 0.12 0.00 -0.09 2.82 3.38 -1.16 -2.48 115.31 117.90 2win h LEU 1006Ca -0.29 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.43 2win h LEU 1006Cb 2.11 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.88 2win h LEU 1006CO 0.21 0.23 -0.93 0.44 0.09 0.00 0.00 178.44 178.47 2win h ASP 1007N 0.00 0.88 1.25 -0.43 3.32 -1.37 -1.21 116.42 118.86 2win h ASP 1007Ca -0.00 -0.66 0.00 0.00 0.02 0.00 0.00 57.03 56.39 2win h ASP 1007Cb 0.77 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.06 2win h ASP 1007CO 0.03 1.46 -0.18 -0.62 -1.72 0.00 0.00 179.24 178.20 2win n GLU 1008N -3.87 0.24 -0.03 3.56 -0.58 -1.17 -3.36 120.64 115.42 2win n GLU 1008Ca -0.09 0.16 0.06 0.00 -0.42 0.00 0.00 57.16 56.86 2win n GLU 1008Cb 0.83 -1.74 0.07 0.00 -0.57 0.00 0.00 31.44 30.02 2win n GLU 1008CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2win n THR 1009N -2.14 0.18 -4.04 2.62 -2.24 -0.94 -3.72 114.28 104.00 2win n THR 1009Ca 0.05 -0.59 -0.33 0.00 -2.27 0.00 0.00 64.05 60.91 2win n THR 1009Cb 0.42 1.11 -0.07 0.00 -2.10 0.00 0.00 70.33 69.69 2win n THR 1009CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2win n GLU 1010N 0.63 -0.81 -0.52 -0.78 0.00 -0.47 -4.78 120.64 113.91 2win n GLU 1010Ca 0.08 0.11 0.08 0.00 0.00 0.00 0.00 57.16 57.42 2win n GLU 1010Cb 0.31 -3.69 0.30 0.00 0.00 0.00 0.00 31.44 28.37 2win n GLU 1010CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2win n GLN 1011N -3.61 3.28 0.11 3.44 6.02 -1.14 -4.33 117.38 121.15 2win n GLN 1011Ca 0.00 -2.41 0.04 0.00 -0.01 0.00 0.00 57.00 54.62 2win n GLN 1011Cb 0.43 -1.79 0.47 0.00 1.02 0.00 0.00 30.24 30.37 2win n GLN 1011CO 0.00 0.00 0.00 -1.49 -1.01 0.00 0.00 177.06 174.56 2win h TRP 1012N 3.48 0.28 -0.97 1.08 4.06 -1.87 -2.26 115.95 119.75 2win h TRP 1012Ca 0.00 -0.01 0.06 0.00 2.06 0.00 0.00 58.89 61.00 2win h TRP 1012Cb 1.25 -0.09 -0.06 0.00 -1.00 0.00 0.00 29.16 29.26 2win h TRP 1012CO 0.65 0.26 0.63 0.93 -3.56 0.00 0.00 178.44 177.34 2win h GLU 1013N 0.28 1.12 0.00 0.49 5.08 -1.91 0.30 114.58 119.93 2win h GLU 1013Ca 0.07 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2win h GLU 1013Cb 0.12 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2win h GLU 1013CO -0.00 0.74 -0.65 1.63 -1.00 0.00 0.00 179.01 179.73 2win n LYS 1014N -4.48 0.13 -0.10 2.33 4.76 -0.99 -4.40 118.16 115.41 2win n LYS 1014Ca 0.14 0.02 -0.16 0.00 -2.87 0.00 0.00 58.31 55.44 2win n LYS 1014Cb 0.17 -1.56 -0.06 0.00 -1.84 0.00 0.00 35.03 31.73 2win n LYS 1014CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2win n PHE 1015N -1.74 0.45 0.00 2.13 7.35 -0.69 -4.73 117.46 120.23 2win n PHE 1015Ca 0.04 0.19 0.00 0.00 -0.76 0.00 0.00 57.45 56.93 2win n PHE 1015Cb 0.38 -0.83 0.00 0.00 0.35 0.00 0.00 39.48 39.38 2win n PHE 1015CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2win n GLY 1016N 1.44 1.44 0.14 7.13 0.00 0.97 -5.00 105.19 111.31 2win n GLY 1016Ca -0.27 0.31 -0.12 0.00 0.00 0.00 0.00 46.02 45.93 2win n GLY 1016CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2win h LEU 1017N 0.00 0.40 0.00 0.99 3.38 -1.85 -2.45 115.31 115.78 2win h LEU 1017Ca 0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2win h LEU 1017Cb 0.00 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.64 2win h LEU 1017CO 0.00 0.70 0.00 -1.84 0.09 0.00 0.00 178.44 177.39 2win n GLU 1018N -4.60 0.81 0.01 1.13 -0.00 -1.26 -2.79 120.64 113.94 2win n GLU 1018Ca -0.05 0.00 0.11 0.00 -0.00 0.00 0.00 57.16 57.22 2win n GLU 1018Cb 0.30 -1.12 -0.14 0.00 -0.00 0.00 0.00 31.44 30.48 2win n GLU 1018CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2win n LYS 1019N -0.62 0.61 -0.18 3.44 5.02 -0.92 -4.37 118.16 121.13 2win n LYS 1019Ca 0.05 -0.14 -0.10 0.00 -2.02 0.00 0.00 58.31 56.10 2win n LYS 1019Cb 0.02 -1.57 0.01 0.00 -0.02 0.00 0.00 35.03 33.47 2win n LYS 1019CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2win h ARG 1020N 0.00 1.01 -0.28 1.97 2.43 -1.55 -2.74 114.38 115.22 2win h ARG 1020Ca 0.00 -0.38 0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2win h ARG 1020Cb 0.97 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.45 2win h ARG 1020CO 0.00 1.07 0.19 0.37 -1.51 0.00 0.00 179.97 180.08 2win h GLN 1021N 0.89 0.35 0.00 0.20 5.75 -1.77 0.10 115.11 120.63 2win h GLN 1021Ca 0.14 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.61 2win h GLN 1021Cb 0.69 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.16 2win h GLN 1021CO 0.05 0.23 0.00 0.78 -2.65 0.00 0.00 178.83 177.24 2win h GLY 1022N 0.36 0.00 0.72 2.39 0.00 -1.71 -3.11 103.07 101.71 2win h GLY 1022Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 47.33 47.08 2win h GLY 1022CO -0.02 0.00 -1.88 0.00 0.00 0.00 0.00 176.54 174.63 2win h ALA 1023N 2.34 0.32 -0.15 3.60 0.00 -0.63 -3.28 119.26 121.46 2win h ALA 1023Ca 0.00 -1.29 -0.03 0.00 0.00 0.00 0.00 54.91 53.59 2win h ALA 1023Cb 0.67 0.61 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2win h ALA 1023CO 0.00 1.18 -0.03 -0.07 0.00 0.00 0.00 179.25 180.33 2win h LEU 1024N 0.06 0.20 -0.56 0.00 -0.00 -1.23 -1.51 115.31 112.27 2win h LEU 1024Ca -0.39 -0.03 -0.16 0.00 -0.00 0.00 0.00 57.88 57.30 2win h LEU 1024Cb 2.04 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 42.64 2win h LEU 1024CO 0.12 0.27 -0.62 -0.33 -0.00 0.00 0.00 178.44 177.88 2win h GLU 1025N 0.22 0.35 0.00 1.13 5.08 -1.68 -1.76 114.58 117.92 2win h GLU 1025Ca 0.05 -0.25 -0.16 0.00 -1.00 0.00 0.00 59.36 58.00 2win h GLU 1025Cb 0.21 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2win h GLU 1025CO 0.01 0.86 -0.78 -0.07 -1.00 0.00 0.00 179.01 178.03 2win h LEU 1026N 0.26 0.00 -0.12 1.33 3.38 -1.47 -0.81 115.31 117.88 2win h LEU 1026Ca -0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 2win h LEU 1026Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2win h LEU 1026CO 0.10 0.78 -0.32 0.40 0.09 0.00 0.00 178.44 179.50 2win h ILE 1027N 0.00 1.38 -0.09 1.22 2.04 -1.22 -1.74 117.51 119.10 2win h ILE 1027Ca -0.01 -1.62 -0.08 0.00 1.00 0.00 0.00 64.86 64.15 2win h ILE 1027Cb 1.40 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 39.57 2win h ILE 1027CO 0.10 0.48 -0.32 0.50 0.00 0.00 0.00 178.15 178.91 2win h LYS 1028N 0.02 0.16 -0.04 2.37 3.64 -1.33 -1.94 116.57 119.44 2win h LYS 1028Ca -0.01 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.17 2win h LYS 1028Cb 0.93 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 2win h LYS 1028CO 0.07 0.47 -0.62 -0.22 -2.27 0.00 0.00 179.45 176.89 2win h LYS 1029N 0.14 0.15 0.00 1.90 3.64 -1.11 -2.20 116.57 119.10 2win h LYS 1029Ca 0.02 -0.11 -0.12 0.00 -1.27 0.00 0.00 60.65 59.18 2win h LYS 1029Cb 0.65 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 2win h LYS 1029CO 0.05 0.72 -0.56 0.78 -2.27 0.00 0.00 179.45 178.17 2win h GLY 1030N 1.62 0.00 1.02 5.01 0.00 -0.92 -2.62 103.07 107.18 2win h GLY 1030Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.14 2win h GLY 1030CO 0.09 0.00 -0.63 -1.82 0.00 0.00 0.00 176.54 174.18 2win h TYR 1031N 0.00 0.88 -0.51 5.60 3.20 -1.14 -2.83 116.97 122.16 2win h TYR 1031Ca -0.01 -0.39 -0.10 0.00 3.14 0.00 0.00 58.73 61.37 2win h TYR 1031Cb 1.17 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2win h TYR 1031CO 0.00 1.20 -0.08 1.15 -1.64 0.00 0.00 178.16 178.79 2win h THR 1032N 0.32 1.27 0.00 1.81 2.02 -1.40 -2.71 112.91 114.21 2win h THR 1032Ca -0.04 -1.21 -0.02 0.00 0.77 0.00 0.00 66.41 65.90 2win h THR 1032Cb 1.27 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 68.68 2win h THR 1032CO 0.13 0.42 -0.11 1.56 0.37 0.00 0.00 175.52 177.89 2win h GLN 1033N 0.83 0.00 0.00 6.66 4.20 -1.53 -2.42 115.11 122.84 2win h GLN 1033Ca 0.14 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.85 2win h GLN 1033Cb 0.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.41 2win h GLN 1033CO 0.04 0.11 -0.02 0.37 -0.67 0.00 0.00 178.83 178.66 2win h GLN 1034N 0.00 0.00 0.00 1.46 5.75 -1.22 -3.13 115.11 117.97 2win h GLN 1034Ca -0.00 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.47 2win h GLN 1034Cb 0.56 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.10 2win h GLN 1034CO 0.01 0.00 -0.14 -0.07 -2.65 0.00 0.00 178.83 175.99 2win h LEU 1035N 0.00 0.00 0.00 -2.39 3.38 -1.26 -3.00 115.31 112.04 2win h LEU 1035Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2win h LEU 1035Cb 0.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2win h LEU 1035CO 0.00 0.14 0.00 0.00 0.09 0.00 0.00 178.44 178.67 2win n ALA 1036N -2.14 2.47 -1.58 1.53 0.00 -1.18 -2.73 120.51 116.88 2win n ALA 1036Ca 0.02 -0.10 0.05 0.00 0.00 0.00 0.00 53.44 53.41 2win n ALA 1036Cb 0.51 -1.26 0.07 0.00 0.00 0.00 0.00 19.45 18.76 2win n ALA 1036CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2win n PHE 1037N -0.79 0.00 -2.90 0.00 3.72 -1.13 -4.97 117.46 111.39 2win n PHE 1037Ca 0.12 -0.48 -0.43 0.00 -0.05 0.00 0.00 57.45 56.61 2win n PHE 1037Cb 0.06 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.46 2win n PHE 1037CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 176.76 177.21 2win s ARG 1038N -1.34 3.28 1.11 -1.08 3.52 -1.10 -4.87 118.95 118.46 2win s ARG 1038Ca 0.15 -1.21 -0.12 0.00 -0.13 0.00 0.00 55.73 54.42 2win s ARG 1038Cb 0.14 -4.49 0.26 0.00 -1.56 0.00 0.00 34.95 29.30 2win s ARG 1038CO 0.01 -1.78 1.05 -0.65 -0.81 0.00 0.00 175.30 173.12 2win s GLN 1039N 3.45 -0.53 0.63 5.12 -0.21 -1.26 -4.83 119.66 122.03 2win s GLN 1039Ca 0.25 0.82 0.26 0.00 0.02 0.00 0.00 55.36 56.71 2win s GLN 1039Cb -0.13 -1.60 1.28 0.00 1.00 0.00 0.00 33.01 33.56 2win s GLN 1039CO 0.03 -3.46 1.72 -1.00 -2.12 0.00 0.00 175.29 170.46 2win h PRO 1040N -2.43 0.00 0.00 2.91 0.13 -2.00 -3.52 132.00 127.09 2win h PRO 1040Ca -0.59 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 2win h PRO 1040Cb 1.33 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2win h PRO 1040CO 0.51 0.00 0.00 0.45 -0.23 0.00 0.00 178.00 178.73 2win n SER 1041N -3.24 0.00 0.00 1.44 2.88 -1.26 -5.12 113.62 108.32 2win n SER 1041Ca 0.06 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 2win n SER 1041Cb 0.73 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.19 2win n SER 1041CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2win n ALA 1046N -1.59 0.00 -1.84 -1.46 0.00 -1.26 -4.43 120.51 109.93 2win n ALA 1046Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 2win n ALA 1046Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 2win n ALA 1046CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2win s PHE 1047N 0.00 3.96 0.50 0.00 0.08 -1.26 -0.88 117.98 120.38 2win s PHE 1047Ca 0.00 1.89 0.24 0.00 0.12 0.00 0.00 56.93 59.18 2win s PHE 1047Cb 0.00 -2.98 1.47 0.00 -0.57 0.00 0.00 43.02 40.93 2win s PHE 1047CO 0.00 0.42 2.13 -0.39 -0.10 0.00 0.00 175.22 177.28 2win h VAL 1048N 3.30 0.73 0.00 -0.44 -1.51 -1.93 0.16 116.25 116.56 2win h VAL 1048Ca -0.45 -0.29 0.00 0.00 -1.23 0.00 0.00 66.70 64.73 2win h VAL 1048Cb 1.20 1.17 0.00 0.00 -2.13 0.00 0.00 31.29 31.54 2win h VAL 1048CO 0.69 0.07 0.00 0.29 -1.23 0.00 0.00 177.57 177.39 2win n LYS 1049N -3.98 0.22 -3.81 5.19 5.02 -1.26 -4.80 118.16 114.74 2win n LYS 1049Ca -0.03 0.34 -0.25 0.00 -2.02 0.00 0.00 58.31 56.36 2win n LYS 1049Cb 0.16 -1.85 -0.03 0.00 -0.02 0.00 0.00 35.03 33.30 2win n LYS 1049CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2win s ARG 1050N -3.24 3.47 0.40 1.97 3.52 0.04 -5.08 118.95 120.04 2win s ARG 1050Ca 0.07 -0.53 -0.26 0.00 -0.13 0.00 0.00 55.73 54.88 2win s ARG 1050Cb 0.10 -2.87 -0.09 0.00 -1.56 0.00 0.00 34.95 30.54 2win s ARG 1050CO 0.47 0.42 1.26 0.00 -0.81 0.00 0.00 175.30 176.64 2win s ALA 1051N -1.90 3.23 0.29 6.12 0.00 -1.26 -4.86 121.76 123.38 2win s ALA 1051Ca 0.36 1.15 -0.30 0.00 0.00 0.00 0.00 51.96 53.17 2win s ALA 1051Cb -0.10 -3.45 -0.13 0.00 0.00 0.00 0.00 23.12 19.44 2win s ALA 1051CO 0.30 -0.72 1.34 -0.35 0.00 0.00 0.00 175.76 176.33 2win n PRO 1052N 0.14 2.08 -3.72 0.00 -0.04 -1.26 -4.83 135.00 127.36 2win n PRO 1052Ca 0.04 0.73 -0.37 0.00 -0.04 0.00 0.00 63.50 63.86 2win n PRO 1052Cb 0.44 -2.35 -0.06 0.00 -0.04 0.00 0.00 33.50 31.50 2win n PRO 1052CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2win s SER 1053N -0.02 6.56 0.06 3.54 0.15 -1.26 -4.27 113.70 118.45 2win s SER 1053Ca 0.62 0.66 -0.15 0.00 0.70 0.00 0.00 55.95 57.78 2win s SER 1053Cb -0.61 -2.14 -0.26 0.00 -1.71 0.00 0.00 66.02 61.31 2win s SER 1053CO 0.56 0.35 1.14 0.74 1.20 0.00 0.00 173.24 177.23 2win h THR 1054N 3.69 1.29 -0.03 6.45 2.02 -1.88 -2.99 112.91 121.47 2win h THR 1054Ca -0.53 -2.31 -0.02 0.00 0.77 0.00 0.00 66.41 64.32 2win h THR 1054Cb 1.22 2.53 0.00 0.00 -1.74 0.00 0.00 68.15 70.16 2win h THR 1054CO 0.61 0.71 -0.07 -0.25 0.37 0.00 0.00 175.52 176.88 2win h TRP 1055N 0.30 0.13 -0.59 3.16 7.01 -1.94 -2.41 115.95 121.62 2win h TRP 1055Ca -0.15 -0.05 0.03 0.00 2.11 0.00 0.00 58.89 60.83 2win h TRP 1055Cb 1.75 -0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 28.74 2win h TRP 1055CO 0.11 0.66 0.36 1.25 -2.79 0.00 0.00 178.44 178.03 2win h LEU 1056N -0.43 0.57 -1.14 0.65 5.85 -1.93 0.15 115.31 119.03 2win h LEU 1056Ca 0.00 0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.67 2win h LEU 1056Cb 0.66 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2win h LEU 1056CO 0.02 0.40 0.03 0.74 -0.34 0.00 0.00 178.44 179.28 2win h THR 1057N 0.70 1.21 0.00 1.05 2.02 -1.59 -1.25 112.91 115.05 2win h THR 1057Ca 0.24 -0.82 -0.12 0.00 0.77 0.00 0.00 66.41 66.48 2win h THR 1057Cb 0.04 0.87 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2win h THR 1057CO -0.11 0.29 -0.59 0.00 0.37 0.00 0.00 175.52 175.48 2win h ALA 1058N 1.43 0.93 0.07 6.16 0.00 -0.73 -3.15 119.26 123.97 2win h ALA 1058Ca 0.13 -0.53 -0.25 0.00 0.00 0.00 0.00 54.91 54.26 2win h ALA 1058Cb 0.34 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2win h ALA 1058CO 0.01 0.73 -1.12 -0.92 0.00 0.00 0.00 179.25 177.95 2win h TYR 1059N 0.00 0.35 -0.97 0.00 3.20 -0.25 -3.12 116.97 116.18 2win h TYR 1059Ca -0.01 -0.24 0.03 0.00 3.14 0.00 0.00 58.73 61.65 2win h TYR 1059Cb 1.11 -0.02 -0.06 0.00 1.54 0.00 0.00 36.73 39.30 2win h TYR 1059CO 0.00 1.16 0.64 0.28 -1.64 0.00 0.00 178.16 178.60 2win h VAL 1060N 0.07 1.18 -0.24 1.81 2.07 -1.21 -1.44 116.25 118.48 2win h VAL 1060Ca -0.09 -0.43 -0.07 0.00 0.82 0.00 0.00 66.70 66.93 2win h VAL 1060Cb 1.84 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 2win h VAL 1060CO 0.17 0.23 -0.17 0.58 0.02 0.00 0.00 177.57 178.40 2win h VAL 1061N 1.24 1.23 -0.38 2.57 2.07 -1.57 -0.88 116.25 120.54 2win h VAL 1061Ca 0.38 -1.06 -0.05 0.00 0.82 0.00 0.00 66.70 66.79 2win h VAL 1061Cb -0.02 1.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 2win h VAL 1061CO -0.12 0.34 0.02 0.50 0.02 0.00 0.00 177.57 178.33 2win h LYS 1062N 0.39 0.65 0.07 1.57 3.64 -1.22 -1.43 116.57 120.23 2win h LYS 1062Ca 0.07 -0.20 -0.23 0.00 -1.27 0.00 0.00 60.65 59.02 2win h LYS 1062Cb 0.53 -0.07 0.02 0.00 -0.41 0.00 0.00 32.23 32.30 2win h LYS 1062CO 0.03 0.74 -0.94 0.28 -2.27 0.00 0.00 179.45 177.29 2win h VAL 1063N 0.48 1.37 -0.49 2.00 2.07 -1.32 -3.17 116.25 117.19 2win h VAL 1063Ca 0.11 -2.32 -0.03 0.00 0.82 0.00 0.00 66.70 65.29 2win h VAL 1063Cb 0.43 2.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.88 2win h VAL 1063CO 0.01 0.69 0.19 -0.26 0.02 0.00 0.00 177.57 178.23 2win h PHE 1064N 0.06 0.74 0.00 1.57 -1.00 -1.19 -1.28 116.94 115.83 2win h PHE 1064Ca -0.14 -0.06 -0.03 0.00 2.81 0.00 0.00 57.97 60.56 2win h PHE 1064Cb 1.64 -0.22 -0.00 0.00 3.61 0.00 0.00 35.95 40.98 2win h PHE 1064CO 0.14 0.62 -0.15 0.77 -1.61 0.00 0.00 178.31 178.08 2win h SER 1065N 0.64 0.00 0.93 2.17 0.02 -1.37 -2.23 113.55 113.72 2win h SER 1065Ca 0.16 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.92 2win h SER 1065Cb 0.19 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 2win h SER 1065CO -0.01 0.15 -1.14 0.25 -1.14 0.00 0.00 176.83 174.93 2win h LEU 1066N 0.00 0.00 -3.95 5.07 6.46 -1.43 -3.33 115.31 118.13 2win h LEU 1066Ca -0.00 0.00 -0.59 0.00 -0.12 0.00 0.00 57.88 57.17 2win h LEU 1066Cb 0.37 0.00 -0.29 0.00 -0.73 0.00 0.00 40.66 40.01 2win h LEU 1066CO 0.02 0.77 0.66 0.00 -0.62 0.00 0.00 178.44 179.28 2win n ALA 1067N -2.38 5.89 0.05 1.25 0.00 -0.52 -4.46 120.51 120.35 2win n ALA 1067Ca -0.06 -3.25 -0.07 0.00 0.00 0.00 0.00 53.44 50.06 2win n ALA 1067Cb 0.89 -1.53 -0.12 0.00 0.00 0.00 0.00 19.45 18.69 2win n ALA 1067CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2win h VAL 1068N 1.05 1.60 0.00 0.00 -1.51 -1.62 -3.12 116.25 112.65 2win h VAL 1068Ca 0.59 -3.33 0.00 0.00 -1.23 0.00 0.00 66.70 62.73 2win h VAL 1068Cb 1.69 2.80 0.00 0.00 -2.13 0.00 0.00 31.29 33.65 2win h VAL 1068CO 1.31 0.92 -0.61 0.59 -1.23 0.00 0.00 177.57 178.54 2win n ASN 1069N -3.32 0.63 -0.08 4.19 5.03 -1.26 -4.23 115.26 116.22 2win n ASN 1069Ca -0.02 0.02 -0.14 0.00 0.87 0.00 0.00 54.58 55.31 2win n ASN 1069Cb 0.96 0.21 -0.10 0.00 -1.02 0.00 0.00 39.78 39.83 2win n ASN 1069CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.26 175.36 2win h LEU 1070N 0.00 0.00 0.00 3.41 3.38 -1.86 -3.49 115.31 116.75 2win h LEU 1070Ca 0.00 -0.65 -0.28 0.00 0.09 0.00 0.00 57.88 57.05 2win h LEU 1070Cb 0.68 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.37 2win h LEU 1070CO 0.00 1.05 -0.22 2.30 0.09 0.00 0.00 178.44 181.66 2win n ILE 1071N -4.59 0.00 -3.03 1.22 -5.35 -1.18 -5.08 119.36 101.36 2win n ILE 1071Ca -0.15 -1.11 -0.45 0.00 -0.27 0.00 0.00 62.75 60.78 2win n ILE 1071Cb 0.45 0.34 -0.02 0.00 -1.74 0.00 0.00 39.64 38.66 2win n ILE 1071CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2win s ALA 1072N -2.48 3.54 -0.09 -1.28 0.00 -1.26 -4.64 121.76 115.55 2win s ALA 1072Ca 0.06 -2.90 -0.29 0.00 0.00 0.00 0.00 51.96 48.84 2win s ALA 1072Cb 0.00 -3.91 -0.02 0.00 0.00 0.00 0.00 23.12 19.19 2win s ALA 1072CO 0.04 -2.80 0.97 0.42 0.00 0.00 0.00 175.76 174.39 2win s ILE 1073N 2.07 4.82 0.19 0.00 -1.09 -1.26 -5.02 121.20 120.92 2win s ILE 1073Ca 0.29 1.97 -0.30 0.00 -2.23 0.00 0.00 60.65 60.38 2win s ILE 1073Cb -0.06 -4.28 -0.08 0.00 -1.58 0.00 0.00 42.46 36.45 2win s ILE 1073CO -0.09 0.04 1.19 -0.62 -1.23 0.00 0.00 174.94 174.24 2win s ASP 1074N 1.07 7.09 0.38 3.58 2.15 -1.26 -4.93 116.67 124.76 2win s ASP 1074Ca 0.47 2.25 0.21 0.00 0.43 0.00 0.00 52.55 55.91 2win s ASP 1074Cb -0.18 -2.61 0.55 0.00 -0.30 0.00 0.00 42.92 40.38 2win s ASP 1074CO 0.19 -0.36 1.67 0.28 -0.17 0.00 0.00 175.17 176.77 2win h SER 1075N 5.10 0.00 0.35 -0.34 0.02 -1.98 -2.52 113.55 114.18 2win h SER 1075Ca -0.45 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.32 2win h SER 1075Cb 1.21 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.75 2win h SER 1075CO 0.74 0.29 -0.76 1.56 -1.14 0.00 0.00 176.83 177.52 2win h GLN 1076N 0.00 0.34 0.17 3.45 1.08 -1.98 -2.20 115.11 115.97 2win h GLN 1076Ca -0.00 -0.29 -0.26 0.00 -1.45 0.00 0.00 58.65 56.64 2win h GLN 1076Cb 1.00 0.07 0.02 0.00 -0.05 0.00 0.00 27.48 28.52 2win h GLN 1076CO 0.04 0.95 -1.21 0.28 -0.95 0.00 0.00 178.83 177.94 2win h VAL 1077N 0.22 1.29 -0.07 -0.54 2.07 -1.96 -2.65 116.25 114.61 2win h VAL 1077Ca -0.03 -2.54 -0.02 0.00 0.82 0.00 0.00 66.70 64.93 2win h VAL 1077Cb 1.34 3.01 -0.00 0.00 -1.52 0.00 0.00 31.29 34.12 2win h VAL 1077CO 0.13 0.75 -0.02 0.25 0.02 0.00 0.00 177.57 178.70 2win h LEU 1078N -0.18 0.14 -0.83 2.57 5.85 -1.54 -3.00 115.31 118.32 2win h LEU 1078Ca -0.23 -0.38 -0.04 0.00 0.84 0.00 0.00 57.88 58.07 2win h LEU 1078Cb 1.84 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.83 2win h LEU 1078CO 0.16 0.49 -0.20 0.00 -0.34 0.00 0.00 178.44 178.55 2win h GLY 1080N 2.58 0.82 1.52 0.00 0.00 -1.37 -0.86 103.07 105.76 2win h GLY 1080Ca -0.00 -0.54 -0.23 0.00 0.00 0.00 0.00 47.33 46.55 2win h GLY 1080CO 0.03 0.50 -0.98 0.00 0.00 0.00 0.00 176.54 176.09 2win h ALA 1081N 1.29 0.32 -0.40 3.60 0.00 -1.45 -3.04 119.26 119.58 2win h ALA 1081Ca 0.14 -0.72 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 2win h ALA 1081Cb 0.44 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2win h ALA 1081CO 0.02 0.81 0.07 0.28 0.00 0.00 0.00 179.25 180.44 2win h VAL 1082N 0.23 1.24 0.00 0.00 2.07 -1.38 -2.06 116.25 116.34 2win h VAL 1082Ca -0.09 -0.84 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 2win h VAL 1082Cb 1.62 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 32.41 2win h VAL 1082CO 0.17 0.29 -0.17 0.50 0.02 0.00 0.00 177.57 178.38 2win h LYS 1083N 0.51 0.00 -0.03 1.57 3.64 -1.24 -2.98 116.57 118.04 2win h LYS 1083Ca 0.12 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 2win h LYS 1083Cb 0.35 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.18 2win h LYS 1083CO 0.01 0.17 -0.36 2.35 -2.27 0.00 0.00 179.45 179.34 2win h TRP 1084N 0.00 0.42 0.00 1.91 7.01 -1.34 -2.91 115.95 121.03 2win h TRP 1084Ca -0.00 -0.21 -0.01 0.00 2.11 0.00 0.00 58.89 60.78 2win h TRP 1084Cb 0.33 -0.06 -0.00 0.00 -2.10 0.00 0.00 29.16 27.33 2win h TRP 1084CO 0.00 0.99 -0.06 -0.07 -2.79 0.00 0.00 178.44 176.51 2win h LEU 1085N -0.27 0.00 0.07 0.65 3.38 -1.26 -0.68 115.31 117.20 2win h LEU 1085Ca -0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.80 2win h LEU 1085Cb 1.07 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.82 2win h LEU 1085CO 0.07 0.06 -0.65 0.40 0.09 0.00 0.00 178.44 178.41 2win h ILE 1086N 0.00 1.49 0.00 1.22 2.04 -1.56 -3.21 117.51 117.49 2win h ILE 1086Ca -0.00 -2.42 0.00 0.00 1.00 0.00 0.00 64.86 63.44 2win h ILE 1086Cb 0.11 3.11 0.00 0.00 -0.74 0.00 0.00 36.82 39.31 2win h ILE 1086CO 0.01 0.64 -0.57 -0.07 0.00 0.00 0.00 178.15 178.15 2win h LEU 1087N -0.65 0.00 0.00 1.44 3.38 -1.42 -3.39 115.31 114.67 2win h LEU 1087Ca -0.13 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2win h LEU 1087Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2win h LEU 1087CO 0.05 0.09 0.00 -0.62 0.09 0.00 0.00 178.44 178.05 2win n GLU 1088N -2.18 0.00 -1.65 1.13 -0.58 -0.27 -4.82 120.64 112.27 2win n GLU 1088Ca 0.03 0.00 -0.31 0.00 -0.42 0.00 0.00 57.16 56.46 2win n GLU 1088Cb 0.45 -0.21 -0.04 0.00 -0.57 0.00 0.00 31.44 31.07 2win n GLU 1088CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2win n LYS 1089N -2.35 3.17 -3.64 3.49 4.76 -1.21 -4.82 118.16 117.56 2win n LYS 1089Ca 0.00 -2.69 -0.17 0.00 -2.87 0.00 0.00 58.31 52.57 2win n LYS 1089Cb 0.00 -2.31 -0.15 0.00 -1.84 0.00 0.00 35.03 30.73 2win n LYS 1089CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2win s GLN 1090N -1.42 0.07 0.72 1.97 0.74 -1.24 -3.84 119.66 116.66 2win s GLN 1090Ca 0.58 0.50 -0.11 0.00 0.05 0.00 0.00 55.36 56.37 2win s GLN 1090Cb 0.31 -0.46 0.03 0.00 1.10 0.00 0.00 33.01 33.99 2win s GLN 1090CO -0.17 -0.37 1.08 0.15 -0.55 0.00 0.00 175.29 175.43 2win s LYS 1091N 2.30 2.61 0.55 1.67 1.02 0.36 -4.89 119.74 123.37 2win s LYS 1091Ca 0.03 1.12 0.27 0.00 0.02 0.00 0.00 55.97 57.41 2win s LYS 1091Cb -0.13 -1.94 1.47 0.00 -0.52 0.00 0.00 37.83 36.71 2win s LYS 1091CO -0.07 -1.36 2.00 -1.35 -0.92 0.00 0.00 175.35 173.65 2win h PRO 1092N -0.77 0.00 0.00 -1.68 0.11 -2.00 0.15 132.00 127.81 2win h PRO 1092Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2win h PRO 1092Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 2win h PRO 1092CO 0.54 0.00 -0.16 -0.40 -0.21 0.00 0.00 178.00 177.77 2win n ASP 1093N -4.12 0.27 0.00 -2.05 5.68 -1.26 -4.91 116.55 110.16 2win n ASP 1093Ca 0.07 0.31 0.00 0.00 -0.50 0.00 0.00 54.79 54.68 2win n ASP 1093Cb 0.55 -0.32 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 2win n ASP 1093CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2win n GLY 1094N 1.46 0.73 3.73 6.12 0.00 0.54 -4.41 105.19 113.36 2win n GLY 1094Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2win n GLY 1094CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2win s VAL 1095N -2.00 4.69 -0.18 1.61 1.01 -1.25 -4.29 120.40 119.99 2win s VAL 1095Ca 0.00 1.92 -0.17 0.00 0.00 0.00 0.00 61.98 63.73 2win s VAL 1095Cb 0.00 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2win s VAL 1095CO 0.00 0.28 0.42 -0.36 0.00 0.00 0.00 175.10 175.44 2win s PHE 1096N 0.31 3.42 -0.09 5.22 0.08 -1.26 -0.49 117.98 125.17 2win s PHE 1096Ca 0.46 0.70 -0.02 0.00 0.12 0.00 0.00 56.93 58.19 2win s PHE 1096Cb -0.22 -2.53 -0.03 0.00 -0.57 0.00 0.00 43.02 39.67 2win s PHE 1096CO 0.27 0.05 -0.01 -1.14 -0.10 0.00 0.00 175.22 174.29 2win s GLN 1097N 1.09 2.99 -0.20 0.44 0.74 -1.25 -4.50 119.66 118.97 2win s GLN 1097Ca 0.21 -0.43 -0.22 0.00 0.05 0.00 0.00 55.36 54.97 2win s GLN 1097Cb -0.15 -2.77 -0.02 0.00 1.10 0.00 0.00 33.01 31.17 2win s GLN 1097CO 0.08 0.67 0.67 -2.00 -0.55 0.00 0.00 175.29 174.16 2win s GLU 1098N -0.79 4.21 0.00 1.67 2.56 -1.26 -4.83 118.70 120.26 2win s GLU 1098Ca 0.12 0.68 0.07 0.00 0.00 0.00 0.00 54.97 55.84 2win s GLU 1098Cb -0.11 -3.59 -0.05 0.00 2.00 0.00 0.00 34.13 32.38 2win s GLU 1098CO 0.02 -0.28 0.35 -0.25 -0.56 0.00 0.00 175.26 174.55 2win n ASP 1099N 5.17 0.54 -2.92 -1.70 8.00 -1.26 -4.84 116.55 119.53 2win n ASP 1099Ca -0.00 -0.77 -0.11 0.00 0.71 0.00 0.00 54.79 54.63 2win n ASP 1099Cb 0.49 0.82 -0.01 0.00 -0.02 0.00 0.00 41.12 42.40 2win n ASP 1099CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2win n ALA 1100N -0.87 -0.58 -1.66 2.24 0.00 -1.26 -5.03 120.51 113.34 2win n ALA 1100Ca 0.02 -1.63 -0.44 0.00 0.00 0.00 0.00 53.44 51.39 2win n ALA 1100Cb 0.11 -1.28 -0.02 0.00 0.00 0.00 0.00 19.45 18.27 2win n ALA 1100CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2win n PRO 1101N 2.71 1.90 -1.87 0.00 -0.02 -1.26 -4.30 135.00 132.16 2win n PRO 1101Ca 0.20 0.67 -0.37 0.00 -2.02 0.00 0.00 63.50 61.98 2win n PRO 1101Cb 0.55 -2.23 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 2win n PRO 1101CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2win s VAL 1102N -0.72 2.31 0.06 -1.45 -7.23 -1.26 -4.95 120.40 107.16 2win s VAL 1102Ca 0.61 0.20 -0.26 0.00 -1.81 0.00 0.00 61.98 60.72 2win s VAL 1102Cb -0.63 -3.08 -0.17 0.00 0.56 0.00 0.00 36.38 33.06 2win s VAL 1102CO 0.57 -0.03 1.57 0.40 -0.31 0.00 0.00 175.10 177.30 2win h ILE 1103N 0.85 0.89 -1.02 -0.62 2.04 -2.03 -3.35 117.51 114.26 2win h ILE 1103Ca -0.51 -0.26 -0.47 0.00 1.00 0.00 0.00 64.86 64.62 2win h ILE 1103Cb 1.31 1.05 -0.08 0.00 -0.74 0.00 0.00 36.82 38.36 2win h ILE 1103CO 0.55 0.06 1.18 -1.00 0.00 0.00 0.00 178.15 178.93 2win s HIS 1104N -5.65 2.21 -0.85 1.37 3.76 -1.26 -4.82 115.29 110.05 2win s HIS 1104Ca -0.14 -0.19 0.00 0.00 -0.15 0.00 0.00 55.06 54.58 2win s HIS 1104Cb 0.04 -4.42 0.02 0.00 1.11 0.00 0.00 32.58 29.33 2win s HIS 1104CO 0.64 -1.88 0.59 1.04 -0.85 0.00 0.00 174.74 174.28 2win n GLN 1105N 8.90 1.07 0.00 1.40 1.13 -1.26 -2.99 117.38 125.64 2win n GLN 1105Ca 0.34 -0.06 0.02 0.00 -1.94 0.00 0.00 57.00 55.37 2win n GLN 1105Cb 0.49 -1.45 -0.02 0.00 0.11 0.00 0.00 30.24 29.37 2win n GLN 1105CO 0.00 0.00 0.00 -0.85 -1.44 0.00 0.00 177.06 174.77 2win n GLU 1106N 0.07 4.85 0.05 -1.09 0.00 -1.26 -4.51 120.64 118.75 2win n GLU 1106Ca 0.01 -0.07 0.12 0.00 0.00 0.00 0.00 57.16 57.21 2win n GLU 1106Cb 0.30 -0.77 0.11 0.00 0.00 0.00 0.00 31.44 31.08 2win n GLU 1106CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2win n MET 1107N -1.00 0.31 0.19 3.44 0.00 -1.16 -3.94 117.12 114.96 2win n MET 1107Ca 0.01 0.06 0.13 0.00 0.00 0.00 0.00 57.70 57.90 2win n MET 1107Cb 0.09 -1.66 0.31 0.00 0.00 0.00 0.00 33.22 31.95 2win n MET 1107CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 175.97 175.13 2win h ILE 1108N 0.00 0.00 0.00 3.17 3.07 -1.79 -3.35 117.51 118.61 2win h ILE 1108Ca 0.00 -0.76 0.00 0.00 1.55 0.00 0.00 64.86 65.65 2win h ILE 1108Cb 0.76 1.74 0.00 0.00 -0.27 0.00 0.00 36.82 39.05 2win h ILE 1108CO 0.00 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.71 2win n GLY 1109N 0.99 0.96 0.00 0.16 0.00 -1.25 -3.53 105.19 102.52 2win n GLY 1109Ca 0.04 -0.58 0.05 0.00 0.00 0.00 0.00 46.02 45.53 2win n GLY 1109CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2win n GLY 1110N 0.00 -0.68 0.00 -0.02 0.00 -1.26 -2.18 105.19 101.05 2win n GLY 1110Ca 0.00 -0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.11 2win n GLY 1110CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2win n LEU 1111N -1.32 0.00 0.18 0.99 4.32 -1.23 -3.20 117.00 116.75 2win n LEU 1111Ca 0.05 0.26 0.05 0.00 -0.02 0.00 0.00 56.01 56.35 2win n LEU 1111Cb 0.09 -0.26 0.31 0.00 -1.62 0.00 0.00 43.42 41.94 2win n LEU 1111CO 0.09 -0.01 0.66 -0.09 -1.22 0.00 0.00 177.39 176.81 2win h ARG 1112N 0.00 0.00 -6.25 3.23 2.43 -1.72 -3.43 114.38 108.65 2win h ARG 1112Ca 0.00 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.61 2win h ARG 1112Cb 0.25 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 2win h ARG 1112CO 0.00 0.40 1.06 1.21 -1.51 0.00 0.00 179.97 181.14 2win s ASN 1113N -6.49 6.60 0.52 -3.80 3.84 -1.19 -4.88 114.94 109.54 2win s ASN 1113Ca -0.00 1.82 0.35 0.00 0.21 0.00 0.00 52.86 55.24 2win s ASN 1113Cb 0.11 -2.53 1.85 0.00 -0.55 0.00 0.00 41.25 40.13 2win s ASN 1113CO 0.70 -1.04 2.07 0.78 -2.79 0.00 0.00 177.10 176.82 2win h ASN 1114N 9.77 0.00 -2.49 -4.21 -0.26 -1.92 -3.43 115.58 113.05 2win h ASN 1114Ca -0.34 0.00 -0.56 0.00 -0.56 0.00 0.00 56.30 54.85 2win h ASN 1114Cb 1.15 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.40 2win h ASN 1114CO 0.98 0.00 1.22 0.20 -1.06 0.00 0.00 177.43 178.77 2win s ASN 1115N -4.79 6.28 -0.80 5.81 0.01 -1.26 -3.68 114.94 116.51 2win s ASN 1115Ca -0.03 2.07 -0.02 0.00 -0.71 0.00 0.00 52.86 54.18 2win s ASN 1115Cb 0.10 -2.53 -0.00 0.00 0.41 0.00 0.00 41.25 39.23 2win s ASN 1115CO 0.35 -1.27 0.70 -0.62 -1.51 0.00 0.00 177.10 174.75 2win n GLU 1116N 7.73 -1.42 0.00 -0.60 1.02 -1.26 -4.91 120.64 121.19 2win n GLU 1116Ca 0.21 1.23 0.13 0.00 -0.02 0.00 0.00 57.16 58.71 2win n GLU 1116Cb 0.44 -4.87 0.30 0.00 -0.02 0.00 0.00 31.44 27.29 2win n GLU 1116CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2win n LYS 1117N -2.19 1.21 0.04 3.49 2.85 -1.24 -3.20 118.16 119.12 2win n LYS 1117Ca -0.08 -0.82 0.13 0.00 -1.05 0.00 0.00 58.31 56.48 2win n LYS 1117Cb 0.56 -1.48 0.33 0.00 -0.65 0.00 0.00 35.03 33.78 2win n LYS 1117CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2win n ASP 1118N -0.18 0.53 -0.10 -5.58 8.00 -1.26 -3.23 116.55 114.73 2win n ASP 1118Ca 0.13 0.19 -0.17 0.00 0.71 0.00 0.00 54.79 55.65 2win n ASP 1118Cb 0.40 -0.13 -0.08 0.00 -0.02 0.00 0.00 41.12 41.29 2win n ASP 1118CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2win n MET 1119N -1.85 0.45 -0.05 -1.24 2.81 -1.24 -4.20 117.12 111.79 2win n MET 1119Ca 0.05 0.14 -0.11 0.00 -1.81 0.00 0.00 57.70 55.98 2win n MET 1119Cb 0.39 -1.30 -0.04 0.00 -0.71 0.00 0.00 33.22 31.55 2win n MET 1119CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2win h ALA 1120N -0.32 0.25 -0.24 3.04 0.00 -1.70 -0.31 119.26 119.97 2win h ALA 1120Ca -0.46 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 2win h ALA 1120Cb 1.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 2win h ALA 1120CO -0.17 -0.16 0.04 1.25 0.00 0.00 0.00 179.25 180.20 2win h LEU 1121N 0.16 0.39 -1.47 0.00 5.85 -1.82 -0.25 115.31 118.16 2win h LEU 1121Ca 0.06 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.49 2win h LEU 1121Cb 0.17 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2win h LEU 1121CO -0.01 0.55 0.03 0.74 -0.34 0.00 0.00 178.44 179.41 2win h THR 1122N 0.21 1.14 0.00 1.05 2.02 -1.71 -1.25 112.91 114.37 2win h THR 1122Ca 0.07 -0.53 -0.15 0.00 0.77 0.00 0.00 66.41 66.57 2win h THR 1122Cb 0.33 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 2win h THR 1122CO 0.00 0.18 -0.69 0.00 0.37 0.00 0.00 175.52 175.39 2win h ALA 1123N 1.67 0.65 0.00 6.16 0.00 -0.75 -2.58 119.26 124.42 2win h ALA 1123Ca 0.09 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.37 2win h ALA 1123Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2win h ALA 1123CO 0.00 0.87 -0.00 0.35 0.00 0.00 0.00 179.25 180.47 2win h PHE 1124N 0.00 -0.00 -0.33 0.00 3.57 -0.31 -3.03 116.94 116.84 2win h PHE 1124Ca -0.01 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.45 2win h PHE 1124Cb 1.40 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 40.13 2win h PHE 1124CO 0.00 0.74 0.01 0.28 -2.23 0.00 0.00 178.31 177.11 2win h VAL 1125N -0.75 1.19 -0.65 1.41 2.07 -1.35 -2.85 116.25 115.31 2win h VAL 1125Ca -0.00 -0.74 -0.03 0.00 0.82 0.00 0.00 66.70 66.74 2win h VAL 1125Cb 0.75 0.93 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 2win h VAL 1125CO 0.00 0.25 0.27 0.25 0.02 0.00 0.00 177.57 178.37 2win h LEU 1126N 0.49 0.89 -1.07 2.57 5.85 -1.52 -2.38 115.31 120.14 2win h LEU 1126Ca 0.11 -0.16 -0.03 0.00 0.84 0.00 0.00 57.88 58.63 2win h LEU 1126Cb 0.30 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 2win h LEU 1126CO 0.01 0.81 0.28 0.40 -0.34 0.00 0.00 178.44 179.59 2win h ILE 1127N 0.92 1.22 0.00 4.05 2.04 -1.37 -2.23 117.51 122.13 2win h ILE 1127Ca 0.22 -0.66 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 2win h ILE 1127Cb 0.19 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 36.69 2win h ILE 1127CO -0.02 0.27 -0.17 0.28 0.00 0.00 0.00 178.15 178.51 2win h SER 1128N 0.92 0.00 1.20 1.72 0.02 -1.39 -2.63 113.55 113.40 2win h SER 1128Ca 0.22 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.08 2win h SER 1128Cb 0.15 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 2win h SER 1128CO -0.02 0.17 -0.83 -0.07 -1.14 0.00 0.00 176.83 174.94 2win h LEU 1129N 0.00 0.00 0.00 5.07 3.38 -0.91 -3.21 115.31 119.63 2win h LEU 1129Ca -0.00 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.72 2win h LEU 1129Cb 0.79 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.50 2win h LEU 1129CO 0.02 0.34 -1.51 1.56 0.09 0.00 0.00 178.44 178.95 2win h GLN 1130N 0.00 0.00 0.00 1.13 4.20 -1.34 -3.26 115.11 115.85 2win h GLN 1130Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2win h GLN 1130Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 2win h GLN 1130CO 0.04 0.52 0.00 0.93 -0.67 0.00 0.00 178.83 179.64 2win h GLU 1131N 0.00 0.00 -0.52 1.46 5.08 -1.59 -2.84 114.58 116.17 2win h GLU 1131Ca -0.21 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.97 2win h GLU 1131Cb 1.87 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 31.01 2win h GLU 1131CO 0.08 0.00 0.13 0.00 -1.00 0.00 0.00 179.01 178.22 2win n ALA 1132N -1.94 4.16 0.14 3.43 0.00 -1.21 -4.72 120.51 120.37 2win n ALA 1132Ca 0.04 -2.61 -0.06 0.00 0.00 0.00 0.00 53.44 50.81 2win n ALA 1132Cb 0.43 -0.98 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 2win n ALA 1132CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.50 177.28 2win h LYS 1133N 1.82 -0.36 -0.51 0.00 3.64 -1.54 -1.86 116.57 117.76 2win h LYS 1133Ca 0.21 0.02 0.14 0.00 -1.27 0.00 0.00 60.65 59.76 2win h LYS 1133Cb 1.95 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.83 2win h LYS 1133CO 0.53 -0.24 0.36 -0.44 -2.27 0.00 0.00 179.45 177.40 2win h ASP 1134N -0.57 0.06 0.56 4.20 5.19 -1.84 -0.17 116.42 123.84 2win h ASP 1134Ca -0.04 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.17 2win h ASP 1134Cb 0.29 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 2win h ASP 1134CO 0.06 0.03 -0.91 0.40 -3.12 0.00 0.00 179.24 175.70 2win h ILE 1135N 0.07 1.49 -2.14 0.35 2.04 -1.88 -3.38 117.51 114.05 2win h ILE 1135Ca 0.24 -2.64 -0.57 0.00 1.00 0.00 0.00 64.86 62.89 2win h ILE 1135Cb 0.89 2.50 -0.41 0.00 -0.74 0.00 0.00 36.82 39.05 2win h ILE 1135CO -0.02 0.77 -0.81 0.00 0.00 0.00 0.00 178.15 178.10 2win n GLU 1137N 0.68 2.39 0.02 0.00 1.02 -1.02 -4.27 120.64 119.45 2win n GLU 1137Ca 0.27 -0.01 0.02 0.00 -0.02 0.00 0.00 57.16 57.42 2win n GLU 1137Cb 0.47 -1.19 -0.09 0.00 -0.02 0.00 0.00 31.44 30.60 2win n GLU 1137CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2win n GLU 1138N -2.20 0.63 0.04 3.49 4.07 -1.26 -4.17 120.64 121.23 2win n GLU 1138Ca -0.11 0.12 0.04 0.00 -0.06 0.00 0.00 57.16 57.15 2win n GLU 1138Cb 0.66 -1.73 -0.08 0.00 -0.06 0.00 0.00 31.44 30.24 2win n GLU 1138CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 2win n GLN 1139N -2.75 0.63 -3.90 5.31 6.02 -1.26 -4.78 117.38 116.65 2win n GLN 1139Ca -0.11 0.13 -0.29 0.00 -0.01 0.00 0.00 57.00 56.72 2win n GLN 1139Cb 0.80 -1.76 -0.16 0.00 1.02 0.00 0.00 30.24 30.14 2win n GLN 1139CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2win s VAL 1140N -3.08 1.27 -0.68 5.09 1.01 -1.26 -4.99 120.40 117.75 2win s VAL 1140Ca -0.03 -0.91 0.24 0.00 0.00 0.00 0.00 61.98 61.28 2win s VAL 1140Cb 0.09 -1.51 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2win s VAL 1140CO 0.82 -0.01 1.23 0.59 0.00 0.00 0.00 175.10 177.73 2win n ASN 1141N 4.79 0.64 -0.72 3.32 5.03 -1.26 -3.88 115.26 123.18 2win n ASN 1141Ca -0.12 -0.06 0.05 0.00 0.87 0.00 0.00 54.58 55.33 2win n ASN 1141Cb 0.46 0.40 0.16 0.00 -1.02 0.00 0.00 39.78 39.78 2win n ASN 1141CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 2win n SER 1142N -1.97 2.07 -0.05 6.41 3.41 -1.26 -4.21 113.62 118.03 2win n SER 1142Ca 0.03 -2.08 -0.11 0.00 -0.26 0.00 0.00 58.87 56.45 2win n SER 1142Cb 0.42 -0.29 -0.10 0.00 -0.26 0.00 0.00 64.21 63.98 2win n SER 1142CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2win h LEU 1143N 1.98 -0.02 -0.93 1.04 5.85 -1.91 -3.00 115.31 118.31 2win h LEU 1143Ca 0.00 -0.72 0.10 0.00 0.84 0.00 0.00 57.88 58.10 2win h LEU 1143Cb 0.59 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 2win h LEU 1143CO 0.04 0.80 0.57 -0.65 -0.34 0.00 0.00 178.44 178.87 2win h PRO 1144N -0.94 0.92 -0.19 5.25 0.11 -1.86 0.12 132.00 135.41 2win h PRO 1144Ca -0.00 -0.06 -0.12 0.00 0.11 0.00 0.00 66.00 65.93 2win h PRO 1144Cb 0.74 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2win h PRO 1144CO 0.00 0.61 -0.40 0.78 -0.21 0.00 0.00 178.00 178.78 2win h GLY 1145N 0.95 0.48 1.29 -0.55 0.00 -1.81 -2.98 103.07 100.45 2win h GLY 1145Ca 0.45 -0.47 -0.25 0.00 0.00 0.00 0.00 47.33 47.06 2win h GLY 1145CO -0.24 0.43 -0.96 0.23 0.00 0.00 0.00 176.54 176.00 2win h SER 1146N 0.37 0.83 -0.64 0.19 0.87 -1.15 -2.97 113.55 111.05 2win h SER 1146Ca 0.03 -0.63 0.03 0.00 -1.23 0.00 0.00 61.79 59.99 2win h SER 1146Cb 0.87 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 62.53 2win h SER 1146CO 0.07 1.43 0.39 0.40 -0.53 0.00 0.00 176.83 178.60 2win h ILE 1147N 0.39 1.08 -0.34 2.23 2.04 -0.77 -1.81 117.51 120.32 2win h ILE 1147Ca -0.10 -0.26 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 2win h ILE 1147Cb 1.60 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 2win h ILE 1147CO 0.18 0.14 -0.08 0.74 0.00 0.00 0.00 178.15 179.14 2win h THR 1148N 0.77 1.28 -0.06 -0.27 2.02 -1.59 -2.75 112.91 112.30 2win h THR 1148Ca 0.26 -1.13 0.02 0.00 0.77 0.00 0.00 66.41 66.33 2win h THR 1148Cb 0.03 1.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2win h THR 1148CO -0.11 0.37 -0.05 0.11 0.37 0.00 0.00 175.52 176.22 2win h LYS 1149N 0.44 -0.05 0.00 6.66 1.79 -1.33 -1.22 116.57 122.87 2win h LYS 1149Ca 0.09 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.55 2win h LYS 1149Cb 0.58 0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 31.24 2win h LYS 1149CO 0.03 -0.04 -0.05 0.00 -1.08 0.00 0.00 179.45 178.32 2win h ALA 1150N 1.00 1.82 0.00 3.86 0.00 -1.35 -1.49 119.26 123.10 2win h ALA 1150Ca 0.04 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 2win h ALA 1150Cb 0.12 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 2win h ALA 1150CO -0.10 0.06 -0.68 0.78 0.00 0.00 0.00 179.25 179.31 2win h GLY 1151N 0.16 0.00 0.82 0.00 0.00 -1.06 -3.14 103.07 99.84 2win h GLY 1151Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 2win h GLY 1151CO 0.01 0.00 -0.12 -0.55 0.00 0.00 0.00 176.54 175.87 2win h ASP 1152N 0.00 0.47 -0.39 0.19 3.32 -0.16 -2.08 116.42 117.77 2win h ASP 1152Ca -0.01 -0.43 -0.04 0.00 0.02 0.00 0.00 57.03 56.57 2win h ASP 1152Cb 1.38 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 2win h ASP 1152CO 0.09 0.80 0.07 0.15 -1.72 0.00 0.00 179.24 178.62 2win h PHE 1153N 0.14 0.67 -0.14 4.55 3.57 -1.59 -2.16 116.94 121.99 2win h PHE 1153Ca 0.04 -0.09 -0.10 0.00 3.53 0.00 0.00 57.97 61.35 2win h PHE 1153Cb 0.63 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.17 2win h PHE 1153CO 0.07 0.67 -0.34 -0.07 -2.23 0.00 0.00 178.31 176.40 2win h LEU 1154N 0.48 0.29 -0.42 0.59 3.38 -1.59 -2.44 115.31 115.60 2win h LEU 1154Ca 0.12 -0.11 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 2win h LEU 1154Cb 0.36 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 2win h LEU 1154CO 0.01 0.62 -0.55 -0.08 0.09 0.00 0.00 178.44 178.53 2win h GLU 1155N 0.24 0.70 -0.03 1.13 4.81 -1.20 -2.37 114.58 117.86 2win h GLU 1155Ca 0.03 -0.44 -0.16 0.00 -0.13 0.00 0.00 59.36 58.65 2win h GLU 1155Cb 0.73 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.15 2win h GLU 1155CO 0.06 1.06 -0.72 0.00 -0.73 0.00 0.00 179.01 178.68 2win h ALA 1156N 0.84 0.73 -0.71 2.92 0.00 -1.28 -3.27 119.26 118.50 2win h ALA 1156Ca 0.01 -0.62 -0.47 0.00 0.00 0.00 0.00 54.91 53.83 2win h ALA 1156Cb 1.12 -0.09 -0.28 0.00 0.00 0.00 0.00 17.79 18.54 2win h ALA 1156CO 0.11 0.82 0.01 0.09 0.00 0.00 0.00 179.25 180.28 2win n ASN 1157N -3.77 4.87 -0.05 0.00 3.02 -0.93 -4.54 115.26 113.86 2win n ASN 1157Ca -0.03 -3.77 -0.09 0.00 -0.03 0.00 0.00 54.58 50.67 2win n ASN 1157Cb 0.70 -0.65 -0.15 0.00 -0.61 0.00 0.00 39.78 39.06 2win n ASN 1157CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2win n TYR 1158N -0.93 0.57 1.14 3.10 9.36 -0.90 -3.94 117.16 125.56 2win n TYR 1158Ca 0.47 0.21 0.13 0.00 3.32 0.00 0.00 57.90 62.03 2win n TYR 1158Cb 0.95 -1.10 0.64 0.00 -0.63 0.00 0.00 39.34 39.21 2win n TYR 1158CO 0.00 0.00 0.00 -1.33 0.22 0.00 0.00 176.86 175.75 2win n MET 1159N -2.90 0.22 -1.87 2.98 2.81 -1.26 -3.69 117.12 113.40 2win n MET 1159Ca -0.23 0.03 -0.34 0.00 -1.81 0.00 0.00 57.70 55.35 2win n MET 1159Cb 1.08 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 32.13 2win n MET 1159CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2win n ASN 1160N -1.38 6.66 -4.30 7.83 5.03 -1.25 -4.99 115.26 122.86 2win n ASN 1160Ca 0.10 -3.79 -0.30 0.00 0.87 0.00 0.00 54.58 51.46 2win n ASN 1160Cb 0.26 -0.82 -0.16 0.00 -1.02 0.00 0.00 39.78 38.05 2win n ASN 1160CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2win s LEU 1161N -3.83 2.05 -0.12 3.41 1.43 -1.24 -5.03 118.68 115.35 2win s LEU 1161Ca 0.55 -0.46 -0.00 0.00 -1.03 0.00 0.00 54.13 53.19 2win s LEU 1161Cb 0.45 -1.30 -0.08 0.00 0.03 0.00 0.00 46.19 45.30 2win s LEU 1161CO -0.19 0.31 -0.12 0.00 0.23 0.00 0.00 176.35 176.59 2win n GLN 1162N 2.45 0.30 -2.10 1.70 1.13 -1.26 -5.00 117.38 114.60 2win n GLN 1162Ca -0.16 0.08 -0.41 0.00 -1.94 0.00 0.00 57.00 54.56 2win n GLN 1162Cb 0.51 -1.20 -0.03 0.00 0.11 0.00 0.00 30.24 29.63 2win n GLN 1162CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 2win s ARG 1163N -2.24 4.32 0.45 -1.09 0.52 -1.26 -4.91 118.95 114.73 2win s ARG 1163Ca -0.17 2.19 0.23 0.00 -0.52 0.00 0.00 55.73 57.46 2win s ARG 1163Cb 0.05 -3.15 1.01 0.00 0.52 0.00 0.00 34.95 33.38 2win s ARG 1163CO 0.28 -0.36 1.88 0.77 0.02 0.00 0.00 175.30 177.88 2win h SER 1164N 5.36 0.00 -0.19 0.23 0.02 -1.92 -2.66 113.55 114.39 2win h SER 1164Ca -0.45 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.38 2win h SER 1164Cb 1.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 2win h SER 1164CO 0.79 0.24 -0.35 0.22 -1.14 0.00 0.00 176.83 176.59 2win h TYR 1165N 0.00 0.72 -0.65 3.45 3.20 -1.88 -2.37 116.97 119.43 2win h TYR 1165Ca -0.00 -0.25 -0.07 0.00 3.14 0.00 0.00 58.73 61.54 2win h TYR 1165Cb 0.65 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.76 2win h TYR 1165CO 0.00 0.99 0.13 1.15 -1.64 0.00 0.00 178.16 178.79 2win h THR 1166N 0.24 1.26 -0.39 1.81 2.02 -1.92 -0.68 112.91 115.25 2win h THR 1166Ca 0.01 -0.99 -0.07 0.00 0.77 0.00 0.00 66.41 66.13 2win h THR 1166Cb 0.94 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 2win h THR 1166CO 0.08 0.37 -0.05 0.58 0.37 0.00 0.00 175.52 176.87 2win h VAL 1167N 0.99 1.23 -0.01 3.16 2.07 -1.50 -1.86 116.25 120.34 2win h VAL 1167Ca 0.20 -0.98 -0.04 0.00 0.82 0.00 0.00 66.70 66.70 2win h VAL 1167Cb 0.41 0.99 0.00 0.00 -1.52 0.00 0.00 31.29 31.17 2win h VAL 1167CO 0.01 0.33 -0.14 0.00 0.02 0.00 0.00 177.57 177.79 2win h ALA 1168N 1.35 0.03 0.00 1.67 0.00 -1.13 -1.31 119.26 119.86 2win h ALA 1168Ca 0.12 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 2win h ALA 1168Cb 0.45 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2win h ALA 1168CO 0.02 -0.00 -0.20 0.97 0.00 0.00 0.00 179.25 180.04 2win h ILE 1169N -0.59 0.72 0.00 0.00 2.10 -1.13 -2.45 117.51 116.16 2win h ILE 1169Ca -0.02 -0.82 -0.14 0.00 1.08 0.00 0.00 64.86 64.96 2win h ILE 1169Cb 0.89 1.51 -0.02 0.00 -1.09 0.00 0.00 36.82 38.10 2win h ILE 1169CO 0.03 0.19 -1.30 0.00 -1.08 0.00 0.00 178.15 176.00 2win h ALA 1170N 1.80 0.64 -0.27 0.18 0.00 -1.39 -3.30 119.26 116.92 2win h ALA 1170Ca -0.00 -0.71 -0.15 0.00 0.00 0.00 0.00 54.91 54.05 2win h ALA 1170Cb 0.50 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2win h ALA 1170CO 0.03 0.78 -0.44 0.78 0.00 0.00 0.00 179.25 180.40 2win h GLY 1171N 3.73 0.73 2.00 0.00 0.00 -0.77 -2.84 103.07 105.93 2win h GLY 1171Ca -0.13 -0.76 -0.09 0.00 0.00 0.00 0.00 47.33 46.35 2win h GLY 1171CO 0.04 0.69 -0.40 -1.82 0.00 0.00 0.00 176.54 175.05 2win h TYR 1172N 0.54 0.00 0.00 5.60 3.20 -1.63 -0.55 116.97 124.13 2win h TYR 1172Ca 0.04 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2win h TYR 1172Cb 0.98 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.25 2win h TYR 1172CO 0.05 0.40 0.00 0.00 -1.64 0.00 0.00 178.16 176.97 2win h ALA 1173N 1.60 1.00 0.00 1.82 0.00 -1.60 -3.16 119.26 118.92 2win h ALA 1173Ca -0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2win h ALA 1173Cb 1.12 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.91 2win h ALA 1173CO 0.05 0.00 -1.72 1.28 0.00 0.00 0.00 179.25 178.86 2win n LEU 1174N -2.66 0.00 0.16 0.00 4.77 -1.08 -4.42 117.00 113.77 2win n LEU 1174Ca 0.04 0.00 0.02 0.00 -0.03 0.00 0.00 56.01 56.04 2win n LEU 1174Cb 0.42 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.72 2win n LEU 1174CO 0.30 0.00 0.56 0.00 -1.33 0.00 0.00 177.39 176.92 2win h ALA 1175N 1.43 0.88 -0.07 -1.18 0.00 -1.10 -0.09 119.26 119.13 2win h ALA 1175Ca -0.00 -0.46 -0.10 0.00 0.00 0.00 0.00 54.91 54.35 2win h ALA 1175Cb 0.73 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 2win h ALA 1175CO 0.00 0.63 -0.39 1.96 0.00 0.00 0.00 179.25 181.45 2win h GLN 1176N 0.00 0.15 0.00 0.00 4.20 -1.76 -2.58 115.11 115.12 2win h GLN 1176Ca -0.01 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.63 2win h GLN 1176Cb 1.10 -0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.88 2win h GLN 1176CO 0.07 0.53 -0.80 0.52 -0.67 0.00 0.00 178.83 178.47 2win h MET 1177N 0.13 0.00 0.00 1.46 2.86 -1.78 -3.48 114.93 114.13 2win h MET 1177Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2win h MET 1177Cb 0.75 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.41 2win h MET 1177CO 0.06 0.02 0.00 0.41 1.06 0.00 0.00 176.91 178.46 2win n GLY 1178N 1.17 0.78 1.84 8.32 0.00 -0.94 -4.98 105.19 111.38 2win n GLY 1178Ca 0.00 -0.67 -0.20 0.00 0.00 0.00 0.00 46.02 45.16 2win n GLY 1178CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2win n ARG 1179N -1.44 2.52 -3.19 1.61 1.74 -0.09 -4.72 116.66 113.09 2win n ARG 1179Ca 0.00 -3.41 -0.28 0.00 -0.77 0.00 0.00 57.85 53.39 2win n ARG 1179Cb 0.26 -2.10 -0.06 0.00 -1.02 0.00 0.00 32.46 29.54 2win n ARG 1179CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2win n LEU 1180N -0.98 4.29 0.00 0.55 7.94 -1.24 -4.86 117.00 122.70 2win n LEU 1180Ca 0.48 -5.53 -0.17 0.00 -1.11 0.00 0.00 56.01 49.67 2win n LEU 1180Cb 1.02 -0.67 -0.03 0.00 0.53 0.00 0.00 43.42 44.27 2win n LEU 1180CO 0.47 2.16 -0.12 0.29 -1.11 0.00 0.00 177.39 179.07 2win n LYS 1181N 0.40 1.33 0.00 1.96 5.02 -1.26 -4.12 118.16 121.48 2win n LYS 1181Ca 0.31 -1.99 0.00 0.00 -2.02 0.00 0.00 58.31 54.60 2win n LYS 1181Cb 0.39 0.52 0.00 0.00 -0.02 0.00 0.00 35.03 35.92 2win n LYS 1181CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2win n GLY 1182N 1.71 2.29 0.36 0.72 0.00 -1.26 -2.42 105.19 106.59 2win n GLY 1182Ca -0.11 -0.40 0.10 0.00 0.00 0.00 0.00 46.02 45.61 2win n GLY 1182CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2win h PRO 1183N 0.00 0.58 -0.49 1.61 0.13 -2.00 -1.59 132.00 130.24 2win h PRO 1183Ca 0.00 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 65.05 2win h PRO 1183Cb 0.00 -0.13 -0.02 0.00 0.13 0.00 0.00 31.00 30.98 2win h PRO 1183CO 0.00 0.38 0.13 -0.07 -0.23 0.00 0.00 178.00 178.22 2win h LEU 1184N 0.60 0.68 -0.42 1.56 4.07 -1.84 -1.35 115.31 118.61 2win h LEU 1184Ca 0.33 -0.11 -0.17 0.00 0.08 0.00 0.00 57.88 58.02 2win h LEU 1184Cb 0.50 -0.18 -0.00 0.00 1.08 0.00 0.00 40.66 42.06 2win h LEU 1184CO -0.12 0.67 -0.53 0.25 -1.08 0.00 0.00 178.44 177.63 2win h LEU 1185N 0.72 0.80 -0.50 1.67 5.85 -1.02 -3.00 115.31 119.83 2win h LEU 1185Ca 0.16 -0.42 -0.12 0.00 0.84 0.00 0.00 57.88 58.34 2win h LEU 1185Cb 0.24 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2win h LEU 1185CO -0.01 1.17 -0.16 -1.13 -0.34 0.00 0.00 178.44 177.98 2win h ASN 1186N 0.56 1.01 -0.03 1.25 -1.24 -1.16 -3.06 115.58 112.91 2win h ASN 1186Ca 0.02 -0.38 -0.00 0.00 0.71 0.00 0.00 56.30 56.65 2win h ASN 1186Cb 1.11 -0.28 -0.00 0.00 0.73 0.00 0.00 38.32 39.88 2win h ASN 1186CO 0.11 1.16 0.02 0.50 -1.29 0.00 0.00 177.43 177.93 2win h LYS 1187N 0.86 0.05 -0.83 6.67 3.64 -1.27 -1.28 116.57 124.42 2win h LYS 1187Ca 0.12 -0.01 0.10 0.00 -1.27 0.00 0.00 60.65 59.60 2win h LYS 1187Cb 0.74 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.49 2win h LYS 1187CO 0.06 0.11 0.54 0.35 -2.27 0.00 0.00 179.45 178.24 2win h PHE 1188N -0.02 0.83 0.02 1.91 3.57 -1.54 -0.10 116.94 121.61 2win h PHE 1188Ca 0.01 0.02 -0.25 0.00 3.53 0.00 0.00 57.97 61.29 2win h PHE 1188Cb 0.07 -0.27 0.02 0.00 2.79 0.00 0.00 35.95 38.57 2win h PHE 1188CO -0.05 0.38 -0.97 -0.07 -2.23 0.00 0.00 178.31 175.37 2win h LEU 1189N 0.77 0.81 -0.19 0.59 3.38 -1.40 -3.24 115.31 116.03 2win h LEU 1189Ca 0.39 -0.76 0.00 0.00 0.09 0.00 0.00 57.88 57.59 2win h LEU 1189Cb 0.46 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 40.96 2win h LEU 1189CO -0.16 1.48 0.00 0.35 0.09 0.00 0.00 178.44 180.20 2win n THR 1190N -3.94 0.60 -0.08 0.22 -2.24 -0.50 -3.20 114.28 105.14 2win n THR 1190Ca -0.11 -0.06 -0.08 0.00 -2.27 0.00 0.00 64.05 61.52 2win n THR 1190Cb 0.85 -0.76 0.08 0.00 -2.10 0.00 0.00 70.33 68.40 2win n THR 1190CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2win h THR 1191N 0.00 1.27 -2.70 4.28 2.02 -1.05 -3.44 112.91 113.29 2win h THR 1191Ca 0.00 -1.37 -0.52 0.00 0.77 0.00 0.00 66.41 65.29 2win h THR 1191Cb 0.56 1.25 0.05 0.00 -1.74 0.00 0.00 68.15 68.28 2win h THR 1191CO 0.00 0.46 0.98 0.00 0.37 0.00 0.00 175.52 177.33 2win s ALA 1192N -4.56 3.88 -0.09 6.16 0.00 -1.19 -4.86 121.76 121.09 2win s ALA 1192Ca -0.09 1.51 -0.25 0.00 0.00 0.00 0.00 51.96 53.13 2win s ALA 1192Cb 0.13 -3.68 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 2win s ALA 1192CO 0.84 -0.90 0.76 0.21 0.00 0.00 0.00 175.76 176.66 2win s LYS 1193N 1.31 4.41 -0.47 0.00 2.20 -0.12 -3.40 119.74 123.67 2win s LYS 1193Ca 0.74 0.96 0.00 0.00 -0.36 0.00 0.00 55.97 57.31 2win s LYS 1193Cb -0.47 -3.48 0.00 0.00 -1.51 0.00 0.00 37.83 32.36 2win s LYS 1193CO 0.32 -0.05 0.00 -0.25 -0.36 0.00 0.00 175.35 175.01 2win n ASP 1194N 4.18 -5.11 -3.72 1.43 9.92 -1.26 -3.26 116.55 118.73 2win n ASP 1194Ca 0.01 0.11 -0.23 0.00 -0.53 0.00 0.00 54.79 54.15 2win n ASP 1194Cb 0.51 -3.00 0.04 0.00 -0.64 0.00 0.00 41.12 38.02 2win n ASP 1194CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2win n LYS 1195N -0.76 -5.41 0.00 -1.24 5.02 -1.22 -4.81 118.16 109.74 2win n LYS 1195Ca -0.04 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 2win n LYS 1195Cb 0.41 -5.36 0.00 0.00 -0.02 0.00 0.00 35.03 30.06 2win n LYS 1195CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2win n ASN 1196N -3.01 0.00 -3.64 4.39 2.04 -1.20 -4.51 115.26 109.33 2win n ASN 1196Ca -0.20 -0.84 -0.10 0.00 -0.44 0.00 0.00 54.58 52.99 2win n ASN 1196Cb 0.64 0.00 -0.07 0.00 -2.53 0.00 0.00 39.78 37.82 2win n ASN 1196CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2win s ARG 1197N 0.00 0.61 -0.90 -3.83 1.70 -1.23 -4.52 118.95 110.78 2win s ARG 1197Ca 0.00 0.77 -0.08 0.00 -0.47 0.00 0.00 55.73 55.95 2win s ARG 1197Cb 0.00 0.28 0.23 0.00 -0.57 0.00 0.00 34.95 34.89 2win s ARG 1197CO 0.00 -0.08 0.83 -1.58 -1.08 0.00 0.00 175.30 173.39 2win s TRP 1198N 0.44 3.90 0.23 5.89 0.51 -1.26 -0.94 118.94 127.70 2win s TRP 1198Ca 0.01 -2.57 0.07 0.00 -2.12 0.00 0.00 56.10 51.48 2win s TRP 1198Cb -0.05 -3.59 -0.04 0.00 -0.81 0.00 0.00 33.47 28.98 2win s TRP 1198CO -0.05 -0.90 0.15 -1.83 -0.51 0.00 0.00 176.95 173.81 2win s GLU 1199N -0.68 2.82 0.01 4.98 -1.05 -1.26 -4.32 118.70 119.19 2win s GLU 1199Ca 0.24 -1.06 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 2win s GLU 1199Cb -0.11 -2.52 -0.01 0.00 -0.44 0.00 0.00 34.13 31.05 2win s GLU 1199CO -0.09 0.42 -0.02 -0.51 0.95 0.00 0.00 175.26 176.01 2win s ASP 1200N -3.60 0.19 -0.76 0.83 1.01 -1.26 -4.60 116.67 108.49 2win s ASP 1200Ca 0.32 -0.21 -0.24 0.00 0.71 0.00 0.00 52.55 53.13 2win s ASP 1200Cb -0.08 0.03 -0.16 0.00 1.01 0.00 0.00 42.92 43.72 2win s ASP 1200CO 0.24 -0.10 2.41 -0.81 0.21 0.00 0.00 175.17 177.11 2win n PRO 1201N 2.48 0.55 0.00 8.23 -0.04 -1.26 -4.57 135.00 140.40 2win n PRO 1201Ca -0.17 -0.39 0.00 0.00 -0.04 0.00 0.00 63.50 62.90 2win n PRO 1201Cb 0.58 -2.99 0.00 0.00 -0.04 0.00 0.00 33.50 31.05 2win n PRO 1201CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2win n GLY 1202N 6.35 -0.90 3.78 0.55 0.00 -1.26 -5.15 105.19 108.55 2win n GLY 1202Ca 0.49 -0.09 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 2win n GLY 1202CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2win s LYS 1203N -0.55 2.69 0.20 1.61 1.02 -1.26 -4.97 119.74 118.48 2win s LYS 1203Ca 0.00 1.27 0.18 0.00 0.02 0.00 0.00 55.97 57.44 2win s LYS 1203Cb 0.00 -1.95 0.01 0.00 -0.52 0.00 0.00 37.83 35.37 2win s LYS 1203CO 0.00 -1.32 1.15 1.96 -0.92 0.00 0.00 175.35 176.22 2win h GLN 1204N -0.34 0.00 0.00 1.68 4.20 -2.01 -3.31 115.11 115.33 2win h GLN 1204Ca -0.46 0.00 -0.05 0.00 0.06 0.00 0.00 58.65 58.20 2win h GLN 1204Cb 1.24 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.01 2win h GLN 1204CO 0.54 0.26 -0.25 -0.07 -0.67 0.00 0.00 178.83 178.64 2win h LEU 1205N 0.00 0.00 -0.11 1.46 3.38 -1.98 -1.50 115.31 116.55 2win h LEU 1205Ca -0.06 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.73 2win h LEU 1205Cb 1.34 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.06 2win h LEU 1205CO 0.04 0.25 -0.85 1.88 0.09 0.00 0.00 178.44 179.85 2win h TYR 1206N 0.00 0.00 -0.07 1.13 0.05 -1.97 -2.91 116.97 113.20 2win h TYR 1206Ca -0.00 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.56 2win h TYR 1206Cb 0.70 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.46 2win h TYR 1206CO 0.00 0.85 -0.79 -0.91 -1.05 0.00 0.00 178.16 176.25 2win h ASN 1207N 0.00 0.82 -0.71 3.88 2.35 -1.55 -1.36 115.58 119.01 2win h ASN 1207Ca -0.01 -0.69 -0.02 0.00 -0.55 0.00 0.00 56.30 55.03 2win h ASN 1207Cb 1.60 -0.25 -0.03 0.00 0.05 0.00 0.00 38.32 39.69 2win h ASN 1207CO 0.11 1.39 0.37 0.58 -1.65 0.00 0.00 177.43 178.22 2win h VAL 1208N 0.32 1.23 -0.28 2.81 2.07 -1.36 -0.32 116.25 120.71 2win h VAL 1208Ca -0.08 -0.62 -0.12 0.00 0.82 0.00 0.00 66.70 66.70 2win h VAL 1208Cb 1.45 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2win h VAL 1208CO 0.16 0.27 -0.31 -0.08 0.02 0.00 0.00 177.57 177.62 2win h GLU 1209N 1.03 0.71 -0.52 1.57 4.81 -1.51 -2.16 114.58 118.50 2win h GLU 1209Ca 0.25 -0.38 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 2win h GLU 1209Cb 0.08 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 2win h GLU 1209CO -0.04 1.00 0.19 0.00 -0.73 0.00 0.00 179.01 179.43 2win h ALA 1210N 0.69 1.34 0.00 2.92 0.00 -0.88 -1.96 119.26 121.38 2win h ALA 1210Ca 0.04 -0.16 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 2win h ALA 1210Cb 0.89 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2win h ALA 1210CO 0.08 0.48 -0.65 1.15 0.00 0.00 0.00 179.25 180.31 2win h THR 1211N 0.75 1.46 -0.27 0.00 2.02 -1.01 -2.41 112.91 113.46 2win h THR 1211Ca 0.18 -2.22 -0.06 0.00 0.77 0.00 0.00 66.41 65.08 2win h THR 1211Cb 0.19 2.20 -0.01 0.00 -1.74 0.00 0.00 68.15 68.79 2win h THR 1211CO -0.01 0.64 -0.04 0.28 0.37 0.00 0.00 175.52 176.75 2win h SER 1212N 0.00 0.51 -0.04 4.18 0.02 -0.70 -0.75 113.55 116.78 2win h SER 1212Ca -0.01 -0.35 -0.07 0.00 -0.84 0.00 0.00 61.79 60.52 2win h SER 1212Cb 1.15 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.53 2win h SER 1212CO 0.08 0.74 -0.17 1.88 -1.14 0.00 0.00 176.83 178.22 2win h TYR 1213N 0.28 0.42 -0.22 3.45 0.05 -1.38 -2.48 116.97 117.08 2win h TYR 1213Ca 0.07 -0.07 -0.14 0.00 0.05 0.00 0.00 58.73 58.64 2win h TYR 1213Cb 0.50 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 2win h TYR 1213CO 0.05 0.55 -0.45 0.00 -1.05 0.00 0.00 178.16 177.25 2win h ALA 1214N 1.46 0.80 -0.40 3.88 0.00 -1.22 -2.40 119.26 121.38 2win h ALA 1214Ca 0.06 -0.46 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 2win h ALA 1214Cb 0.52 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 2win h ALA 1214CO 0.03 0.66 -0.04 1.25 0.00 0.00 0.00 179.25 181.16 2win h LEU 1215N 0.45 0.73 -1.33 0.00 5.85 -0.86 -2.35 115.31 117.80 2win h LEU 1215Ca 0.03 -0.33 -0.05 0.00 0.84 0.00 0.00 57.88 58.37 2win h LEU 1215Cb 0.97 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 2win h LEU 1215CO 0.09 0.89 -0.12 -0.07 -0.34 0.00 0.00 178.44 178.88 2win h LEU 1216N 0.56 0.29 -0.45 2.25 3.38 -1.40 -1.89 115.31 118.04 2win h LEU 1216Ca 0.11 -0.06 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 2win h LEU 1216Cb 0.53 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 2win h LEU 1216CO 0.03 0.44 -0.05 0.00 0.09 0.00 0.00 178.44 178.95 2win h ALA 1217N 1.59 0.61 -0.32 1.53 0.00 -1.19 -1.39 119.26 120.09 2win h ALA 1217Ca 0.06 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 2win h ALA 1217Cb 0.39 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2win h ALA 1217CO 0.02 0.45 -0.18 -0.07 0.00 0.00 0.00 179.25 179.47 2win h LEU 1218N 0.66 0.58 -0.83 0.00 3.38 -1.10 -1.99 115.31 116.01 2win h LEU 1218Ca 0.12 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 2win h LEU 1218Cb 0.57 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 2win h LEU 1218CO 0.03 0.78 -0.57 -0.07 0.09 0.00 0.00 178.44 178.70 2win h LEU 1219N 0.53 0.03 -0.37 1.67 3.38 -1.19 -0.36 115.31 119.00 2win h LEU 1219Ca 0.09 -0.02 -0.18 0.00 0.09 0.00 0.00 57.88 57.86 2win h LEU 1219Cb 0.62 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 2win h LEU 1219CO 0.04 0.60 -0.82 -0.61 0.09 0.00 0.00 178.44 177.74 2win h GLN 1220N 0.02 0.06 -0.01 1.13 5.75 -0.93 -3.02 115.11 118.11 2win h GLN 1220Ca -0.01 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.43 2win h GLN 1220Cb 1.02 0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.59 2win h GLN 1220CO 0.08 0.85 -0.21 1.28 -2.65 0.00 0.00 178.83 178.17 2win n LEU 1221N -3.61 1.26 -3.26 -2.39 4.77 -0.78 -4.93 117.00 108.05 2win n LEU 1221Ca -0.02 -0.37 -0.15 0.00 -0.03 0.00 0.00 56.01 55.44 2win n LEU 1221Cb 0.78 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.86 2win n LEU 1221CO 0.45 0.23 0.08 0.29 -1.33 0.00 0.00 177.39 177.11 2win n LYS 1222N -0.37 -4.70 -3.37 3.23 5.02 -0.38 -4.96 118.16 112.61 2win n LYS 1222Ca 0.13 0.82 -0.35 0.00 -2.02 0.00 0.00 58.31 56.89 2win n LYS 1222Cb 0.37 -5.68 -0.05 0.00 -0.02 0.00 0.00 35.03 29.65 2win n LYS 1222CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2win n ASP 1223N -3.07 4.76 0.00 4.39 2.03 -0.29 -4.88 116.55 119.50 2win n ASP 1223Ca -0.20 -3.32 0.02 0.00 0.52 0.00 0.00 54.79 51.81 2win n ASP 1223Cb 0.64 -1.00 0.10 0.00 -0.72 0.00 0.00 41.12 40.15 2win n ASP 1223CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2win n PHE 1224N 1.54 0.00 0.46 -0.67 3.72 -1.26 -2.51 117.46 118.73 2win n PHE 1224Ca 0.26 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.77 2win n PHE 1224Cb 0.37 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.86 2win n PHE 1224CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2win n ASP 1225N -0.57 0.54 -0.16 4.37 8.00 -1.26 -4.19 116.55 123.28 2win n ASP 1225Ca 0.03 -0.24 0.02 0.00 0.71 0.00 0.00 54.79 55.31 2win n ASP 1225Cb 0.01 1.09 0.02 0.00 -0.02 0.00 0.00 41.12 42.23 2win n ASP 1225CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2win n PHE 1226N -2.02 0.02 -0.07 1.24 -0.00 -1.05 -4.73 117.46 110.86 2win n PHE 1226Ca 0.01 -0.07 -0.15 0.00 -0.00 0.00 0.00 57.45 57.24 2win n PHE 1226Cb 0.46 -0.01 -0.13 0.00 -0.00 0.00 0.00 39.48 39.81 2win n PHE 1226CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 2win h VAL 1227N 0.73 1.68 -0.66 -2.13 2.07 -1.72 -3.34 116.25 112.88 2win h VAL 1227Ca 0.00 -2.34 0.14 0.00 0.82 0.00 0.00 66.70 65.32 2win h VAL 1227Cb 0.21 3.26 -0.11 0.00 -1.52 0.00 0.00 31.29 33.13 2win h VAL 1227CO 0.00 0.59 -0.01 -0.65 0.02 0.00 0.00 177.57 177.52 2win h PRO 1228N -0.95 0.10 -0.49 1.57 0.11 -1.85 0.15 132.00 130.65 2win h PRO 1228Ca -0.05 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.03 2win h PRO 1228Cb 1.08 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2win h PRO 1228CO -0.01 0.07 0.20 -1.35 -0.21 0.00 0.00 178.00 176.70 2win h PRO 1229N 0.11 0.70 -0.04 1.05 0.11 -1.88 -2.05 132.00 130.00 2win h PRO 1229Ca 0.35 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 66.34 2win h PRO 1229Cb 0.57 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.55 2win h PRO 1229CO -0.58 0.58 -0.04 0.28 -0.21 0.00 0.00 178.00 178.03 2win h VAL 1230N 0.70 1.37 -0.94 3.15 2.07 -1.16 -3.03 116.25 118.41 2win h VAL 1230Ca 0.17 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.52 2win h VAL 1230Cb 0.14 2.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.92 2win h VAL 1230CO -0.02 0.31 0.56 0.58 0.02 0.00 0.00 177.57 179.02 2win h VAL 1231N -0.34 1.26 -0.80 2.57 2.07 -1.04 -2.24 116.25 117.72 2win h VAL 1231Ca 0.01 -0.58 0.04 0.00 0.82 0.00 0.00 66.70 66.98 2win h VAL 1231Cb 0.52 -0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.19 2win h VAL 1231CO 0.01 0.28 0.53 -0.09 0.02 0.00 0.00 177.57 178.31 2win h ARG 1232N 1.31 0.95 -0.09 1.57 2.43 -1.39 -1.41 114.38 117.75 2win h ARG 1232Ca 0.34 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.37 2win h ARG 1232Cb -0.04 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.28 2win h ARG 1232CO -0.06 0.63 -0.31 2.35 -1.51 0.00 0.00 179.97 181.07 2win h TRP 1233N 0.98 0.19 -0.03 2.20 7.01 -1.28 -2.65 115.95 122.37 2win h TRP 1233Ca 0.32 -0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.26 2win h TRP 1233Cb 0.05 -0.05 -0.00 0.00 -2.10 0.00 0.00 29.16 27.06 2win h TRP 1233CO -0.00 0.46 -0.05 -0.07 -2.79 0.00 0.00 178.44 175.99 2win h LEU 1234N 0.15 0.10 -1.41 0.65 3.38 -1.07 -3.09 115.31 114.02 2win h LEU 1234Ca 0.02 -0.55 -0.05 0.00 0.09 0.00 0.00 57.88 57.39 2win h LEU 1234Cb 0.63 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 2win h LEU 1234CO 0.05 0.63 -0.12 0.78 0.09 0.00 0.00 178.44 179.86 2win h ASN 1235N -0.43 0.22 1.10 -0.43 2.35 -1.40 -2.26 115.58 114.73 2win h ASN 1235Ca 0.00 -0.04 -0.04 0.00 -0.55 0.00 0.00 56.30 55.67 2win h ASN 1235Cb 0.61 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 2win h ASN 1235CO 0.01 0.37 -0.18 -0.33 -1.65 0.00 0.00 177.43 175.66 2win h GLU 1236N 0.22 0.00 0.00 0.81 5.08 -1.52 -2.57 114.58 116.61 2win h GLU 1236Ca 0.05 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2win h GLU 1236Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2win h GLU 1236CO 0.02 0.18 -0.22 1.96 -1.00 0.00 0.00 179.01 179.94 2win h GLN 1237N 0.00 0.00 -6.22 2.33 1.08 -1.31 -3.47 115.11 107.51 2win h GLN 1237Ca -0.00 0.00 -0.45 0.00 -1.45 0.00 0.00 58.65 56.75 2win h GLN 1237Cb 0.77 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.21 2win h GLN 1237CO 0.02 0.22 -0.83 0.54 -0.95 0.00 0.00 178.83 177.84 2win n ARG 1238N -3.55 -4.68 -3.28 1.46 1.74 -0.97 -4.94 116.66 102.44 2win n ARG 1238Ca -0.01 0.57 -0.43 0.00 -0.77 0.00 0.00 57.85 57.21 2win n ARG 1238Cb 0.37 -5.11 -0.08 0.00 -1.02 0.00 0.00 32.46 26.62 2win n ARG 1238CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2win s TYR 1239N -3.64 3.15 -1.61 -1.55 5.04 -1.26 -4.92 117.35 112.55 2win s TYR 1239Ca 0.15 -0.40 0.14 0.00 -2.44 0.00 0.00 57.07 54.52 2win s TYR 1239Cb -0.08 -3.05 0.49 0.00 0.35 0.00 0.00 41.96 39.67 2win s TYR 1239CO 0.83 -0.77 1.38 0.66 -1.34 0.00 0.00 175.55 176.31 2win n TYR 1240N 5.73 0.90 -3.47 4.97 4.01 -1.26 -5.05 117.16 122.99 2win n TYR 1240Ca -0.07 -0.39 0.03 0.00 -0.16 0.00 0.00 57.90 57.31 2win n TYR 1240Cb 0.47 -0.10 -0.01 0.00 -0.31 0.00 0.00 39.34 39.39 2win n TYR 1240CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2win n GLY 1241N 1.10 -1.68 0.00 2.72 0.00 -1.26 -4.95 105.19 101.12 2win n GLY 1241Ca 0.18 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2win n GLY 1241CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2win n GLY 1242N -0.70 -2.68 0.00 -0.02 0.00 -1.26 -5.07 105.19 95.46 2win n GLY 1242Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 2win n GLY 1242CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2win n GLY 1243N -1.82 0.18 3.70 -0.02 0.00 -1.26 -4.84 105.19 101.13 2win n GLY 1243Ca 0.00 -2.24 -0.38 0.00 0.00 0.00 0.00 46.02 43.40 2win n GLY 1243CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2win s TYR 1244N 0.00 3.46 -1.17 1.61 5.04 -1.26 -4.22 117.35 120.81 2win s TYR 1244Ca 0.00 0.80 -0.07 0.00 -2.44 0.00 0.00 57.07 55.36 2win s TYR 1244Cb 0.00 -2.55 0.01 0.00 0.35 0.00 0.00 41.96 39.77 2win s TYR 1244CO 0.00 0.10 1.02 0.41 -1.34 0.00 0.00 175.55 175.74 2win n GLY 1245N 3.48 -0.34 0.65 8.97 0.00 -1.26 -4.92 105.19 111.77 2win n GLY 1245Ca -0.07 0.13 0.05 0.00 0.00 0.00 0.00 46.02 46.12 2win n GLY 1245CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2win n SER 1246N -2.44 2.11 -0.10 1.61 3.41 -1.26 -4.74 113.62 112.21 2win n SER 1246Ca -0.01 -3.68 -0.11 0.00 -0.26 0.00 0.00 58.87 54.81 2win n SER 1246Cb 0.56 -0.54 -0.03 0.00 -0.26 0.00 0.00 64.21 63.94 2win n SER 1246CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2win h THR 1247N 0.86 1.27 0.10 6.66 2.02 -1.81 -2.48 112.91 119.53 2win h THR 1247Ca 0.05 -1.01 -0.30 0.00 0.77 0.00 0.00 66.41 65.92 2win h THR 1247Cb 1.17 1.34 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 2win h THR 1247CO 0.10 0.33 -1.49 1.56 0.37 0.00 0.00 175.52 176.38 2win h GLN 1248N 0.32 0.22 0.00 6.66 1.08 -1.85 -2.92 115.11 118.62 2win h GLN 1248Ca 0.08 -0.38 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 2win h GLN 1248Cb 0.49 0.14 0.00 0.00 -0.05 0.00 0.00 27.48 28.06 2win h GLN 1248CO 0.02 1.08 0.00 0.00 -0.95 0.00 0.00 178.83 178.98 2win h ALA 1249N 0.55 1.00 0.00 3.87 0.00 -1.83 -2.53 119.26 120.32 2win h ALA 1249Ca -0.23 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.33 2win h ALA 1249Cb 2.00 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.72 2win h ALA 1249CO 0.16 0.00 -2.34 2.41 0.00 0.00 0.00 179.25 179.47 2win n THR 1250N -2.66 1.35 0.16 0.00 -1.04 -0.94 -3.79 114.28 107.37 2win n THR 1250Ca 0.01 -0.50 0.02 0.00 -2.04 0.00 0.00 64.05 61.54 2win n THR 1250Cb 0.24 -1.37 0.27 0.00 -1.82 0.00 0.00 70.33 67.65 2win n THR 1250CO 0.00 0.00 0.00 0.15 -0.64 0.00 0.00 175.07 174.58 2win h PHE 1251N -0.06 0.00 0.03 -1.42 3.04 -1.52 -2.98 116.94 114.02 2win h PHE 1251Ca -0.53 0.00 -0.31 0.00 3.98 0.00 0.00 57.97 61.10 2win h PHE 1251Cb 1.80 0.00 -0.04 0.00 2.56 0.00 0.00 35.95 40.26 2win h PHE 1251CO 0.02 0.49 -1.81 -1.33 -2.02 0.00 0.00 178.31 173.66 2win n MET 1252N -3.74 0.66 0.19 1.11 2.81 -0.96 -3.14 117.12 114.06 2win n MET 1252Ca -0.01 0.28 0.07 0.00 -1.81 0.00 0.00 57.70 56.22 2win n MET 1252Cb 0.54 -1.76 0.35 0.00 -0.71 0.00 0.00 33.22 31.64 2win n MET 1252CO 0.00 0.00 0.00 -0.24 1.51 0.00 0.00 175.97 177.24 2win h VAL 1253N 0.02 0.77 -0.01 2.03 3.04 -1.65 -2.37 116.25 118.08 2win h VAL 1253Ca -0.33 -1.45 0.00 0.00 -1.01 0.00 0.00 66.70 63.91 2win h VAL 1253Cb 2.03 1.92 0.00 0.00 -2.01 0.00 0.00 31.29 33.23 2win h VAL 1253CO 0.08 0.33 -0.61 0.49 -1.01 0.00 0.00 177.57 176.85 2win n PHE 1254N -3.46 0.00 -0.00 3.17 3.72 -1.13 -3.42 117.46 116.34 2win n PHE 1254Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 2win n PHE 1254Cb 0.50 -0.01 -0.14 0.00 -0.94 0.00 0.00 39.48 38.89 2win n PHE 1254CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 2win h GLN 1255N 1.69 0.08 0.13 -1.08 4.15 -1.46 -2.96 115.11 115.66 2win h GLN 1255Ca 0.00 -0.13 -0.29 0.00 0.77 0.00 0.00 58.65 59.00 2win h GLN 1255Cb 0.67 0.05 0.02 0.00 0.21 0.00 0.00 27.48 28.43 2win h GLN 1255CO 0.00 0.73 -1.25 0.00 -1.93 0.00 0.00 178.83 176.39 2win h ALA 1256N 0.78 0.05 0.00 3.38 0.00 -1.58 -2.10 119.26 119.79 2win h ALA 1256Ca -0.28 -0.82 -0.11 0.00 0.00 0.00 0.00 54.91 53.70 2win h ALA 1256Cb 2.00 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.84 2win h ALA 1256CO 0.09 0.80 -0.52 -0.07 0.00 0.00 0.00 179.25 179.56 2win h LEU 1257N 0.18 0.00 0.06 0.00 3.38 -1.72 -1.30 115.31 115.91 2win h LEU 1257Ca -0.17 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.60 2win h LEU 1257Cb 1.94 0.00 0.02 0.00 0.09 0.00 0.00 40.66 42.70 2win h LEU 1257CO 0.22 0.52 -0.83 0.00 0.09 0.00 0.00 178.44 178.45 2win h ALA 1258N 1.48 0.02 0.00 1.53 0.00 -1.57 -3.01 119.26 117.71 2win h ALA 1258Ca -0.01 -0.65 -0.06 0.00 0.00 0.00 0.00 54.91 54.19 2win h ALA 1258Cb 1.17 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 2win h ALA 1258CO 0.07 0.46 -0.28 0.37 0.00 0.00 0.00 179.25 179.87 2win h GLN 1259N -0.04 0.00 0.00 0.00 5.75 -1.38 -1.88 115.11 117.56 2win h GLN 1259Ca -0.12 0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.33 2win h GLN 1259Cb 1.55 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 30.09 2win h GLN 1259CO 0.16 0.28 -0.25 -0.92 -2.65 0.00 0.00 178.83 175.45 2win h TYR 1260N 0.00 0.00 0.00 3.99 3.20 -1.22 -3.43 116.97 119.50 2win h TYR 1260Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2win h TYR 1260Cb 0.53 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.80 2win h TYR 1260CO 0.00 0.25 0.00 1.04 -1.64 0.00 0.00 178.16 177.81 2win n GLN 1261N -3.73 1.91 0.00 1.82 1.13 -0.71 -4.33 117.38 113.49 2win n GLN 1261Ca -0.01 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.05 2win n GLN 1261Cb 0.36 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.71 2win n GLN 1261CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 2win n LYS 1262N 0.00 0.00 -1.85 -1.09 4.01 -1.24 -2.39 118.16 115.59 2win n LYS 1262Ca 0.00 0.00 -0.41 0.00 -0.51 0.00 0.00 58.31 57.39 2win n LYS 1262Cb 0.00 0.00 -0.02 0.00 -0.51 0.00 0.00 35.03 34.50 2win n LYS 1262CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2win n ASP 1263N 5.51 3.73 -3.10 4.39 4.64 -1.26 -4.96 116.55 125.50 2win n ASP 1263Ca 0.00 -2.81 -0.12 0.00 -1.38 0.00 0.00 54.79 50.49 2win n ASP 1263Cb 0.00 -1.57 0.11 0.00 -1.04 0.00 0.00 41.12 38.62 2win n ASP 1263CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2win n ALA 1264N 8.03 -2.01 -0.96 -1.67 0.00 -1.01 -4.90 120.51 118.00 2win n ALA 1264Ca 0.50 -0.58 -0.35 0.00 0.00 0.00 0.00 53.44 53.00 2win n ALA 1264Cb 0.42 -0.05 0.07 0.00 0.00 0.00 0.00 19.45 19.89 2win n ALA 1264CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2win n PRO 1265N -3.24 -0.08 0.00 0.00 -0.02 -1.26 -4.99 135.00 125.41 2win n PRO 1265Ca 0.05 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.53 2win n PRO 1265Cb 0.23 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.29 2win n PRO 1265CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2win n ASP 1266N 1.18 0.00 -2.78 2.55 5.68 -1.26 -5.05 116.55 116.87 2win n ASP 1266Ca 0.03 0.00 0.03 0.00 -0.50 0.00 0.00 54.79 54.35 2win n ASP 1266Cb 0.54 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.53 2win n ASP 1266CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 2win s HIS 1267N 0.00 -0.19 0.00 2.11 -0.00 -1.26 -4.94 115.29 111.01 2win s HIS 1267Ca 0.00 0.04 0.00 0.00 -0.00 0.00 0.00 55.06 55.10 2win s HIS 1267Cb 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 32.58 32.61 2win s HIS 1267CO 0.00 -0.13 0.00 0.94 -0.00 0.00 0.00 174.74 175.55 2win n GLN 1268N 3.84 0.00 0.00 -0.38 -0.06 -1.26 -4.80 117.38 114.71 2win n GLN 1268Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.06 2win n GLN 1268Cb 0.63 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.81 2win n GLN 1268CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 2win n GLU 1269N 0.82 0.00 -3.02 3.69 0.28 -1.26 -5.09 120.64 116.06 2win n GLU 1269Ca 0.00 0.00 -0.44 0.00 -0.16 0.00 0.00 57.16 56.56 2win n GLU 1269Cb 0.00 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 32.86 2win n GLU 1269CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2win s LEU 1270N 0.00 5.34 -0.58 -1.84 1.43 -1.26 -1.83 118.68 119.94 2win s LEU 1270Ca 0.00 -2.91 0.05 0.00 -1.03 0.00 0.00 54.13 50.24 2win s LEU 1270Cb 0.00 -2.36 0.34 0.00 0.03 0.00 0.00 46.19 44.20 2win s LEU 1270CO 0.00 -0.72 0.97 -3.20 0.23 0.00 0.00 176.35 173.63 2win n ASN 1271N 5.26 4.55 -4.76 2.29 5.15 -0.89 -2.59 115.26 124.27 2win n ASN 1271Ca 0.31 -3.69 -0.38 0.00 -0.60 0.00 0.00 54.58 50.22 2win n ASN 1271Cb 0.44 -0.56 -0.06 0.00 -0.53 0.00 0.00 39.78 39.06 2win n ASN 1271CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2win s LEU 1272N -3.49 4.37 -0.59 1.20 1.43 -1.21 -3.06 118.68 117.33 2win s LEU 1272Ca 0.49 0.97 0.04 0.00 -1.03 0.00 0.00 54.13 54.60 2win s LEU 1272Cb 0.28 -2.75 0.15 0.00 0.03 0.00 0.00 46.19 43.90 2win s LEU 1272CO -0.14 0.11 0.38 -0.62 0.23 0.00 0.00 176.35 176.31 2win s ASP 1273N -0.05 4.27 0.06 2.29 3.68 0.11 -1.46 116.67 125.57 2win s ASP 1273Ca 0.27 -3.39 -0.24 0.00 2.13 0.00 0.00 52.55 51.33 2win s ASP 1273Cb -0.17 -1.48 -0.06 0.00 -1.45 0.00 0.00 42.92 39.77 2win s ASP 1273CO 0.13 -0.16 0.73 -0.69 0.13 0.00 0.00 175.17 175.32 2win s VAL 1274N -0.76 4.70 0.09 1.11 1.01 -1.00 -3.25 120.40 122.30 2win s VAL 1274Ca 0.22 1.56 0.10 0.00 0.00 0.00 0.00 61.98 63.86 2win s VAL 1274Cb -0.13 -4.08 -0.04 0.00 0.00 0.00 0.00 36.38 32.14 2win s VAL 1274CO -0.10 0.41 -0.26 -0.94 0.00 0.00 0.00 175.10 174.21 2win s SER 1275N -0.31 3.22 -0.10 3.32 1.04 0.22 -1.88 113.70 119.20 2win s SER 1275Ca 0.36 -0.68 0.02 0.00 0.48 0.00 0.00 55.95 56.13 2win s SER 1275Cb -0.20 -0.24 0.02 0.00 0.10 0.00 0.00 66.02 65.69 2win s SER 1275CO 0.22 0.21 -0.14 -0.76 0.98 0.00 0.00 173.24 173.75 2win s LEU 1276N -1.71 1.67 -0.50 2.42 1.43 -1.10 -1.95 118.68 118.93 2win s LEU 1276Ca 0.13 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.87 2win s LEU 1276Cb -0.10 -1.03 0.13 0.00 0.03 0.00 0.00 46.19 45.22 2win s LEU 1276CO 0.04 0.01 0.25 -1.58 0.23 0.00 0.00 176.35 175.30 2win s GLN 1277N 0.98 1.89 0.25 1.70 0.74 -1.15 -3.84 119.66 120.23 2win s GLN 1277Ca -0.07 -2.54 -0.00 0.00 0.05 0.00 0.00 55.36 52.80 2win s GLN 1277Cb -0.15 -3.22 -0.04 0.00 1.10 0.00 0.00 33.01 30.70 2win s GLN 1277CO -0.01 -1.11 0.45 -0.51 -0.55 0.00 0.00 175.29 173.56 2win s LEU 1278N -0.18 4.16 0.65 3.68 1.02 -1.26 -3.51 118.68 123.25 2win s LEU 1278Ca 0.17 0.42 0.25 0.00 0.02 0.00 0.00 54.13 54.99 2win s LEU 1278Cb -0.26 -3.22 1.32 0.00 0.02 0.00 0.00 46.19 44.05 2win s LEU 1278CO -0.00 -0.13 1.75 -0.65 0.02 0.00 0.00 176.35 177.34 2win h PRO 1279N 1.57 0.00 0.00 1.29 0.11 -1.98 0.52 132.00 133.52 2win h PRO 1279Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2win h PRO 1279Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2win h PRO 1279CO 0.65 0.00 0.14 0.66 -0.21 0.00 0.00 178.00 179.24 2win h SER 1280N 0.00 0.00 0.00 -2.05 4.64 -2.01 -3.44 113.55 110.70 2win h SER 1280Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2win h SER 1280Cb 1.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.09 2win h SER 1280CO -0.00 0.00 0.00 -1.14 -0.87 0.00 0.00 176.83 174.82 2win n ARG 1281N -2.61 0.00 0.00 4.77 0.63 0.18 -4.55 116.66 115.09 2win n ARG 1281Ca -0.02 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.91 2win n ARG 1281Cb 0.18 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.09 2win n ARG 1281CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2win n SER 1282N 0.00 2.65 0.00 6.15 3.41 -1.26 -5.05 113.62 119.52 2win n SER 1282Ca 0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.60 2win n SER 1282Cb 0.00 0.55 0.00 0.00 -0.26 0.00 0.00 64.21 64.50 2win n SER 1282CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2win n SER 1283N -0.81 0.00 -3.65 4.04 3.41 -1.26 -5.19 113.62 110.15 2win n SER 1283Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2win n SER 1283Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2win n SER 1283CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2win s LYS 1284N 1.74 0.62 -0.09 4.33 -0.14 -1.26 -5.16 119.74 119.77 2win s LYS 1284Ca 0.00 -0.36 -0.06 0.00 -1.36 0.00 0.00 55.97 54.20 2win s LYS 1284Cb 0.00 0.20 0.04 0.00 -1.68 0.00 0.00 37.83 36.39 2win s LYS 1284CO 0.00 -0.28 0.23 0.42 -0.76 0.00 0.00 175.35 174.95 2win s ILE 1285N -2.51 -0.03 -0.27 2.17 1.01 -1.25 -5.06 121.20 115.26 2win s ILE 1285Ca 0.16 0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.87 2win s ILE 1285Cb 0.02 -0.35 0.14 0.00 0.01 0.00 0.00 42.46 42.29 2win s ILE 1285CO -0.02 0.05 0.55 -0.89 0.00 0.00 0.00 174.94 174.63 2win s THR 1286N 0.94 -0.88 -0.07 2.92 2.01 -1.26 -2.72 115.64 116.59 2win s THR 1286Ca -0.07 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.01 2win s THR 1286Cb -0.08 -0.91 -0.01 0.00 0.01 0.00 0.00 72.50 71.51 2win s THR 1286CO -0.06 -0.00 -0.24 -1.00 -0.69 0.00 0.00 174.62 172.63 2win s HIS 1287N 2.78 2.43 -0.17 4.92 3.76 -0.79 -5.04 115.29 123.18 2win s HIS 1287Ca 0.06 -0.83 -0.04 0.00 -0.15 0.00 0.00 55.06 54.10 2win s HIS 1287Cb -0.13 -1.61 -0.03 0.00 1.11 0.00 0.00 32.58 31.92 2win s HIS 1287CO -0.18 -0.29 -0.03 -0.98 -0.85 0.00 0.00 174.74 172.41 2win s ARG 1288N 0.05 3.64 -0.91 1.40 1.70 -1.26 -2.37 118.95 121.19 2win s ARG 1288Ca -0.10 -0.53 -0.07 0.00 -0.47 0.00 0.00 55.73 54.57 2win s ARG 1288Cb -0.15 -2.96 0.23 0.00 -0.57 0.00 0.00 34.95 31.50 2win s ARG 1288CO 0.06 0.16 0.83 0.42 -1.08 0.00 0.00 175.30 175.68 2win s ILE 1289N 0.59 5.04 0.80 4.99 -1.09 -0.54 -4.97 121.20 126.02 2win s ILE 1289Ca -0.02 -3.31 -0.09 0.00 -2.23 0.00 0.00 60.65 54.99 2win s ILE 1289Cb -0.14 -4.10 0.12 0.00 -1.58 0.00 0.00 42.46 36.75 2win s ILE 1289CO 0.02 -1.08 1.12 -1.00 -1.23 0.00 0.00 174.94 172.78 2win s HIS 1290N -0.83 2.27 0.00 3.97 3.76 -1.24 -3.29 115.29 119.92 2win s HIS 1290Ca 0.25 0.30 0.00 0.00 -0.15 0.00 0.00 55.06 55.46 2win s HIS 1290Cb -0.11 -3.47 0.00 0.00 1.11 0.00 0.00 32.58 30.11 2win s HIS 1290CO -0.09 -1.89 0.00 1.87 -0.85 0.00 0.00 174.74 173.79 2win n TRP 1291N -3.21 0.00 0.00 1.40 -0.00 -1.07 0.15 117.44 114.71 2win n TRP 1291Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.61 2win n TRP 1291Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.91 2win n TRP 1291CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 177.69 176.84 2win n GLU 1292N 0.00 0.00 0.25 5.87 0.00 -1.26 0.20 120.64 125.70 2win n GLU 1292Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 57.16 57.04 2win n GLU 1292Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.38 2win n GLU 1292CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2win h SER 1293N 0.00 -0.78 0.00 -1.84 4.64 -2.00 -3.42 113.55 110.15 2win h SER 1293Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2win h SER 1293Cb 0.00 0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 2win h SER 1293CO 0.00 -0.46 0.00 0.00 -0.87 0.00 0.00 176.83 175.50 2win n ALA 1294N -2.51 0.00 -0.66 5.18 0.00 0.53 -1.63 120.51 121.42 2win n ALA 1294Ca -0.09 0.00 0.51 0.00 0.00 0.00 0.00 53.44 53.86 2win n ALA 1294Cb 0.31 0.00 0.78 0.00 0.00 0.00 0.00 19.45 20.54 2win n ALA 1294CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2win n SER 1295N 0.70 0.00 -4.34 0.00 3.41 -1.26 -4.20 113.62 107.93 2win n SER 1295Ca 0.00 0.97 -0.62 0.00 -0.26 0.00 0.00 58.87 58.96 2win n SER 1295Cb 0.00 -0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 63.37 2win n SER 1295CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2win n LEU 1296N -3.84 0.95 -4.50 1.04 7.94 -0.65 -4.51 117.00 113.44 2win n LEU 1296Ca 0.42 0.91 -0.42 0.00 -1.11 0.00 0.00 56.01 55.81 2win n LEU 1296Cb 1.97 -0.86 -0.03 0.00 0.53 0.00 0.00 43.42 45.03 2win n LEU 1296CO 0.42 -0.78 0.96 -0.76 -1.11 0.00 0.00 177.39 176.13 2win s LEU 1297N 4.26 3.89 -0.02 -1.96 1.02 -1.26 -4.68 118.68 119.92 2win s LEU 1297Ca 1.08 -0.85 -0.25 0.00 0.02 0.00 0.00 54.13 54.13 2win s LEU 1297Cb -1.44 -2.48 -0.04 0.00 0.02 0.00 0.00 46.19 42.25 2win s LEU 1297CO 0.72 -1.59 0.78 -0.13 0.02 0.00 0.00 176.35 176.15 2win s ARG 1298N 4.70 4.48 0.11 1.70 0.52 -1.01 -4.90 118.95 124.56 2win s ARG 1298Ca 0.29 1.05 0.05 0.00 -0.52 0.00 0.00 55.73 56.60 2win s ARG 1298Cb -0.12 -3.43 -0.04 0.00 0.52 0.00 0.00 34.95 31.88 2win s ARG 1298CO 0.10 0.09 -0.13 -1.54 0.02 0.00 0.00 175.30 173.84 2win s SER 1299N 0.65 1.81 0.01 0.23 1.04 -1.26 -0.77 113.70 115.40 2win s SER 1299Ca 0.41 -0.79 0.01 0.00 0.48 0.00 0.00 55.95 56.07 2win s SER 1299Cb -0.19 -0.05 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 2win s SER 1299CO 0.22 -0.17 -0.05 -1.61 0.98 0.00 0.00 173.24 172.61 2win s GLU 1300N -2.59 0.37 -0.02 4.02 0.41 -0.54 -4.97 118.70 115.38 2win s GLU 1300Ca 0.07 -0.28 0.06 0.00 -0.41 0.00 0.00 54.97 54.41 2win s GLU 1300Cb -0.05 -0.30 -0.01 0.00 -1.78 0.00 0.00 34.13 31.98 2win s GLU 1300CO 0.02 0.08 -0.20 -1.21 -0.49 0.00 0.00 175.26 173.46 2win s GLU 1301N -0.41 1.75 -0.06 1.61 8.01 -1.26 -0.04 118.70 128.29 2win s GLU 1301Ca -0.01 -0.72 -0.01 0.00 0.01 0.00 0.00 54.97 54.24 2win s GLU 1301Cb -0.03 -1.63 0.03 0.00 -4.31 0.00 0.00 34.13 28.18 2win s GLU 1301CO -0.00 0.40 -0.01 0.95 0.01 0.00 0.00 175.26 176.61 2win s THR 1302N -0.35 0.39 -2.00 3.63 -4.23 -0.22 -4.97 115.64 107.88 2win s THR 1302Ca 0.05 0.08 0.13 0.00 -1.18 0.00 0.00 61.69 60.76 2win s THR 1302Cb -0.09 -0.52 0.36 0.00 1.34 0.00 0.00 72.50 73.59 2win s THR 1302CO 0.00 0.25 1.20 0.29 -0.54 0.00 0.00 174.62 175.82 2win n LYS 1303N 4.89 0.58 -4.96 3.99 5.02 -1.26 0.10 118.16 126.53 2win n LYS 1303Ca -0.11 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 55.91 2win n LYS 1303Cb 0.50 -1.33 -0.15 0.00 -0.02 0.00 0.00 35.03 34.02 2win n LYS 1303CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 2win s GLU 1304N -2.00 1.60 -0.65 1.97 2.12 -1.25 -4.25 118.70 116.24 2win s GLU 1304Ca 0.19 -0.72 -0.26 0.00 0.36 0.00 0.00 54.97 54.54 2win s GLU 1304Cb 0.09 -1.56 0.04 0.00 0.26 0.00 0.00 34.13 32.96 2win s GLU 1304CO 0.14 0.43 1.13 1.21 -0.54 0.00 0.00 175.26 177.63 2win s ASN 1305N -0.49 6.26 0.33 -1.70 2.47 -1.26 -4.61 114.94 115.94 2win s ASN 1305Ca 0.08 -0.42 0.10 0.00 0.42 0.00 0.00 52.86 53.04 2win s ASN 1305Cb -0.08 -2.50 -0.06 0.00 -1.45 0.00 0.00 41.25 37.16 2win s ASN 1305CO -0.01 -1.56 -0.06 -1.61 -3.72 0.00 0.00 177.10 170.15 2win s GLU 1306N 4.86 1.92 -0.40 0.43 0.41 -1.26 -4.83 118.70 119.83 2win s GLU 1306Ca 0.33 -1.82 -0.07 0.00 -0.41 0.00 0.00 54.97 53.00 2win s GLU 1306Cb -0.11 -1.82 0.08 0.00 -1.78 0.00 0.00 34.13 30.51 2win s GLU 1306CO 0.17 0.17 0.22 0.20 -0.49 0.00 0.00 175.26 175.53 2win s GLY 1307N -3.64 1.95 0.48 -1.39 0.00 -1.26 -4.14 107.32 99.31 2win s GLY 1307Ca 0.33 -2.19 0.02 0.00 0.00 0.00 0.00 44.72 42.89 2win s GLY 1307CO 0.18 0.95 0.18 1.97 0.00 0.00 0.00 173.10 176.38 2win n PHE 1308N 4.82 0.19 -4.27 1.90 1.16 -1.10 -4.76 117.46 115.41 2win n PHE 1308Ca -0.09 -2.17 -0.18 0.00 -1.87 0.00 0.00 57.45 53.14 2win n PHE 1308Cb 0.43 -0.35 -0.15 0.00 -1.61 0.00 0.00 39.48 37.79 2win n PHE 1308CO 0.00 0.00 0.00 0.99 -1.87 0.00 0.00 176.76 175.88 2win s THR 1309N -2.55 0.59 -0.09 1.97 2.01 -1.23 -1.05 115.64 115.30 2win s THR 1309Ca 0.14 -0.28 -0.01 0.00 0.31 0.00 0.00 61.69 61.85 2win s THR 1309Cb -0.01 -0.53 -0.03 0.00 0.01 0.00 0.00 72.50 71.94 2win s THR 1309CO 0.09 0.19 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.48 2win s VAL 1310N 0.10 4.01 -0.19 3.82 1.01 -0.16 -2.95 120.40 126.05 2win s VAL 1310Ca -0.01 -0.35 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2win s VAL 1310Cb -0.06 -2.68 0.05 0.00 0.00 0.00 0.00 36.38 33.69 2win s VAL 1310CO -0.00 0.59 -0.05 -0.89 0.00 0.00 0.00 175.10 174.75 2win s THR 1311N -0.71 1.21 0.33 3.92 2.01 -0.82 -0.17 115.64 121.41 2win s THR 1311Ca 0.11 -0.80 0.05 0.00 0.31 0.00 0.00 61.69 61.36 2win s THR 1311Cb -0.11 -1.43 -0.01 0.00 0.01 0.00 0.00 72.50 70.95 2win s THR 1311CO 0.02 0.05 0.48 0.00 -0.69 0.00 0.00 174.62 174.48 2win s ALA 1312N 1.57 4.07 -0.24 7.40 0.00 -0.03 -0.61 121.76 133.92 2win s ALA 1312Ca -0.01 -1.32 -0.26 0.00 0.00 0.00 0.00 51.96 50.37 2win s ALA 1312Cb -0.16 -1.78 0.10 0.00 0.00 0.00 0.00 23.12 21.28 2win s ALA 1312CO -0.07 -0.02 0.89 -2.00 0.00 0.00 0.00 175.76 174.56 2win s GLU 1313N -4.19 0.68 0.00 0.00 2.12 -1.20 -2.69 118.70 113.41 2win s GLU 1313Ca 0.43 0.64 0.00 0.00 0.36 0.00 0.00 54.97 56.40 2win s GLU 1313Cb -0.09 0.33 0.00 0.00 0.26 0.00 0.00 34.13 34.62 2win s GLU 1313CO 0.32 -0.11 0.00 0.41 -0.54 0.00 0.00 175.26 175.34 2win n GLY 1314N 2.07 -1.90 3.92 -1.50 0.00 -1.26 0.09 105.19 106.61 2win n GLY 1314Ca -0.13 -2.17 -0.26 0.00 0.00 0.00 0.00 46.02 43.46 2win n GLY 1314CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2win s LYS 1315N -0.52 2.74 0.00 1.61 3.01 -1.17 -3.83 119.74 121.57 2win s LYS 1315Ca 0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 55.97 54.89 2win s LYS 1315Cb 0.00 -2.25 0.00 0.00 -1.01 0.00 0.00 37.83 34.57 2win s LYS 1315CO 0.00 -0.84 0.00 0.41 0.51 0.00 0.00 175.35 175.43 2win n GLY 1316N -2.67 2.13 3.03 -3.33 0.00 -0.76 -2.10 105.19 101.50 2win n GLY 1316Ca 0.05 -1.96 -0.25 0.00 0.00 0.00 0.00 46.02 43.86 2win n GLY 1316CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2win s GLN 1317N -2.63 1.78 0.25 1.61 0.74 -1.26 -4.67 119.66 115.48 2win s GLN 1317Ca 0.00 -0.44 0.04 0.00 0.05 0.00 0.00 55.36 55.01 2win s GLN 1317Cb 0.00 -1.46 -0.02 0.00 1.10 0.00 0.00 33.01 32.63 2win s GLN 1317CO 0.00 0.03 0.15 0.41 -0.55 0.00 0.00 175.29 175.33 2win n GLY 1318N 3.82 3.38 3.07 2.59 0.00 -0.98 -2.17 105.19 114.90 2win n GLY 1318Ca -0.22 -1.93 -0.20 0.00 0.00 0.00 0.00 46.02 43.66 2win n GLY 1318CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2win s THR 1319N -2.77 0.90 -0.21 2.61 2.01 0.34 -2.84 115.64 115.67 2win s THR 1319Ca 0.21 -0.53 0.01 0.00 0.31 0.00 0.00 61.69 61.70 2win s THR 1319Cb 0.01 -0.76 0.05 0.00 0.01 0.00 0.00 72.50 71.81 2win s THR 1319CO 0.15 0.22 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.97 2win s LEU 1320N -0.35 2.57 -0.16 4.42 2.96 -0.85 -1.98 118.68 125.28 2win s LEU 1320Ca 0.04 -1.01 0.01 0.00 -0.22 0.00 0.00 54.13 52.95 2win s LEU 1320Cb -0.05 -1.34 0.02 0.00 0.50 0.00 0.00 46.19 45.33 2win s LEU 1320CO -0.00 -0.15 -0.16 -0.94 -1.32 0.00 0.00 176.35 173.78 2win s SER 1321N 1.31 2.92 -0.15 3.68 1.04 -1.00 -2.68 113.70 118.82 2win s SER 1321Ca -0.03 -0.59 -0.01 0.00 0.48 0.00 0.00 55.95 55.80 2win s SER 1321Cb -0.17 -1.29 -0.01 0.00 0.10 0.00 0.00 66.02 64.64 2win s SER 1321CO -0.08 -0.05 -0.11 -0.69 0.98 0.00 0.00 173.24 173.30 2win s VAL 1322N 1.41 3.12 -0.02 5.02 1.01 -1.01 -2.13 120.40 127.80 2win s VAL 1322Ca 0.04 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.43 2win s VAL 1322Cb -0.13 -2.34 -0.00 0.00 0.00 0.00 0.00 36.38 33.91 2win s VAL 1322CO -0.11 0.50 -0.10 -0.69 0.00 0.00 0.00 175.10 174.70 2win s VAL 1323N 0.65 0.79 0.09 2.92 1.01 -1.01 -2.05 120.40 122.79 2win s VAL 1323Ca -0.06 -0.39 0.04 0.00 0.00 0.00 0.00 61.98 61.57 2win s VAL 1323Cb -0.15 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2win s VAL 1323CO 0.02 0.24 0.01 0.42 0.00 0.00 0.00 175.10 175.80 2win s THR 1324N 0.00 4.11 -0.09 3.92 -4.23 -0.95 -2.26 115.64 116.15 2win s THR 1324Ca -0.00 -0.94 0.01 0.00 -1.18 0.00 0.00 61.69 59.58 2win s THR 1324Cb -0.06 -2.96 0.02 0.00 1.34 0.00 0.00 72.50 70.83 2win s THR 1324CO 0.00 0.13 -0.11 -0.32 -0.54 0.00 0.00 174.62 173.78 2win s MET 1325N -2.30 1.75 0.38 3.99 0.00 -1.04 -2.89 119.30 119.18 2win s MET 1325Ca 0.26 -0.39 -0.06 0.00 0.00 0.00 0.00 55.69 55.50 2win s MET 1325Cb -0.12 -1.58 0.03 0.00 0.00 0.00 0.00 34.83 33.16 2win s MET 1325CO 0.19 -0.10 0.61 2.48 0.00 0.00 0.00 175.02 178.19 2win n TYR 1326N 4.31 -1.80 -3.34 4.11 0.18 -0.93 -2.97 117.16 116.72 2win n TYR 1326Ca -0.18 -2.25 -0.45 0.00 1.88 0.00 0.00 57.90 56.89 2win n TYR 1326Cb 0.51 0.70 -0.06 0.00 -0.38 0.00 0.00 39.34 40.11 2win n TYR 1326CO 0.00 0.00 0.00 -1.01 -2.08 0.00 0.00 176.86 173.77 2win s HIS 1327N -2.59 3.25 0.74 -3.48 3.76 -1.26 -2.15 115.29 113.55 2win s HIS 1327Ca 0.25 -1.18 -0.11 0.00 -0.15 0.00 0.00 55.06 53.87 2win s HIS 1327Cb -0.02 -3.60 0.03 0.00 1.11 0.00 0.00 32.58 30.09 2win s HIS 1327CO 0.18 -0.95 1.07 0.00 -0.85 0.00 0.00 174.74 174.20 2win s ALA 1328N 1.61 2.48 -0.58 -1.40 0.00 0.33 -3.45 121.76 120.75 2win s ALA 1328Ca 0.03 0.07 -0.24 0.00 0.00 0.00 0.00 51.96 51.83 2win s ALA 1328Cb -0.28 -3.19 0.04 0.00 0.00 0.00 0.00 23.12 19.70 2win s ALA 1328CO 0.04 -1.46 0.97 0.21 0.00 0.00 0.00 175.76 175.51 2win s LYS 1329N -5.03 3.30 0.32 0.00 2.20 -0.42 -0.47 119.74 119.65 2win s LYS 1329Ca 0.59 -0.34 -0.26 0.00 -0.36 0.00 0.00 55.97 55.60 2win s LYS 1329Cb -0.15 -4.08 -0.10 0.00 -1.51 0.00 0.00 37.83 31.99 2win s LYS 1329CO 0.55 -1.57 0.96 0.00 -0.36 0.00 0.00 175.35 174.94 2win s ALA 1330N 4.07 3.22 -0.89 3.13 0.00 -1.26 -4.95 121.76 125.08 2win s ALA 1330Ca 0.30 0.57 -0.06 0.00 0.00 0.00 0.00 51.96 52.77 2win s ALA 1330Cb -0.13 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.81 2win s ALA 1330CO 0.18 0.12 2.77 1.63 0.00 0.00 0.00 175.76 180.45 2win n LYS 1331N 0.60 3.39 -2.74 0.00 5.02 -1.26 -4.62 118.16 118.54 2win n LYS 1331Ca 0.02 -2.58 -0.18 0.00 -2.02 0.00 0.00 58.31 53.55 2win n LYS 1331Cb 0.49 -2.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.10 2win n LYS 1331CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2win n ASP 1332N 1.80 -4.56 -4.50 4.39 8.00 -1.26 -4.83 116.55 115.59 2win n ASP 1332Ca 0.58 -0.05 -0.44 0.00 0.71 0.00 0.00 54.79 55.59 2win n ASP 1332Cb 0.44 -3.80 -0.01 0.00 -0.02 0.00 0.00 41.12 37.73 2win n ASP 1332CO 0.00 0.00 0.00 1.67 -0.39 0.00 0.00 177.20 178.48 2win n GLN 1333N -3.25 0.76 -1.41 -1.24 7.27 -1.26 -4.62 117.38 113.62 2win n GLN 1333Ca -0.13 0.27 -0.59 0.00 0.07 0.00 0.00 57.00 56.62 2win n GLN 1333Cb 0.61 -1.53 -0.10 0.00 2.41 0.00 0.00 30.24 31.63 2win n GLN 1333CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 2win n LEU 1334N 1.41 1.31 0.08 1.69 -0.00 -1.26 -4.77 117.00 115.46 2win n LEU 1334Ca 0.12 0.73 0.12 0.00 -0.00 0.00 0.00 56.01 56.98 2win n LEU 1334Cb 0.33 -1.01 0.46 0.00 -0.00 0.00 0.00 43.42 43.20 2win n LEU 1334CO 0.57 -0.73 0.87 0.35 -0.00 0.00 0.00 177.39 178.45 2win n THR 1335N 6.12 0.61 -0.09 1.96 -2.24 -1.26 -3.86 114.28 115.52 2win n THR 1335Ca 0.45 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 62.12 2win n THR 1335Cb 0.04 -0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 67.43 2win n THR 1335CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2win n ASN 1337N -4.51 0.00 0.00 0.00 0.23 -1.25 -4.08 115.26 105.65 2win n ASN 1337Ca -0.17 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 53.88 2win n ASN 1337Cb 0.46 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.16 2win n ASN 1337CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 2win n LYS 1338N 1.10 0.00 -3.66 -3.83 5.02 -1.26 -4.96 118.16 110.57 2win n LYS 1338Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 58.31 56.22 2win n LYS 1338Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 35.03 34.93 2win n LYS 1338CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2win s PHE 1339N -2.00 -0.91 0.07 2.13 0.40 -1.26 -1.94 117.98 114.47 2win s PHE 1339Ca 0.00 1.76 0.03 0.00 -0.60 0.00 0.00 56.93 58.12 2win s PHE 1339Cb 0.00 0.47 -0.04 0.00 0.51 0.00 0.00 43.02 43.96 2win s PHE 1339CO 0.00 -0.49 0.04 -0.51 0.70 0.00 0.00 175.22 174.96 2win s ASP 1340N 2.08 5.31 -0.21 1.36 1.01 0.32 -4.82 116.67 121.73 2win s ASP 1340Ca -0.07 -0.06 -0.08 0.00 0.71 0.00 0.00 52.55 53.05 2win s ASP 1340Cb -0.09 -1.37 0.09 0.00 1.01 0.00 0.00 42.92 42.56 2win s ASP 1340CO -0.16 0.19 0.46 -0.22 0.21 0.00 0.00 175.17 175.65 2win s LEU 1341N -2.24 -0.67 -0.16 1.23 2.96 -1.26 -2.35 118.68 116.20 2win s LEU 1341Ca 0.27 1.08 0.00 0.00 -0.22 0.00 0.00 54.13 55.26 2win s LEU 1341Cb -0.12 1.51 0.02 0.00 0.50 0.00 0.00 46.19 48.11 2win s LEU 1341CO 0.19 -0.23 -0.15 -0.54 -1.32 0.00 0.00 176.35 174.31 2win s LYS 1342N 2.50 2.37 -0.15 1.98 3.01 -0.64 -4.88 119.74 123.92 2win s LYS 1342Ca -0.03 -0.62 -0.03 0.00 -1.01 0.00 0.00 55.97 54.27 2win s LYS 1342Cb -0.11 -2.20 -0.03 0.00 -1.01 0.00 0.00 37.83 34.48 2win s LYS 1342CO -0.14 -0.25 -0.04 0.08 0.51 0.00 0.00 175.35 175.51 2win s VAL 1343N 1.45 3.91 0.01 3.17 1.01 -1.26 -2.45 120.40 126.24 2win s VAL 1343Ca 0.04 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 61.73 2win s VAL 1343Cb -0.13 -2.71 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 2win s VAL 1343CO -0.11 0.50 -0.18 -0.89 0.00 0.00 0.00 175.10 174.43 2win s THR 1344N 0.26 1.40 -0.18 3.92 2.01 -0.85 -4.89 115.64 117.31 2win s THR 1344Ca -0.03 -0.87 -0.00 0.00 0.31 0.00 0.00 61.69 61.10 2win s THR 1344Cb -0.14 -1.19 0.04 0.00 0.01 0.00 0.00 72.50 71.23 2win s THR 1344CO 0.03 0.30 -0.06 -0.51 -0.69 0.00 0.00 174.62 173.69 2win s ILE 1345N -0.55 1.24 0.09 1.82 1.10 -1.26 -1.91 121.20 121.73 2win s ILE 1345Ca 0.06 -0.77 0.08 0.00 -0.51 0.00 0.00 60.65 59.50 2win s ILE 1345Cb -0.07 -1.42 -0.03 0.00 0.15 0.00 0.00 42.46 41.08 2win s ILE 1345CO 0.00 0.09 -0.20 -0.54 -2.11 0.00 0.00 174.94 172.18 2win s LYS 1346N 1.57 1.13 0.51 3.50 1.02 -0.91 -4.89 119.74 121.67 2win s LYS 1346Ca -0.01 -1.09 -0.22 0.00 0.02 0.00 0.00 55.97 54.67 2win s LYS 1346Cb -0.16 -1.34 -0.06 0.00 -0.52 0.00 0.00 37.83 35.75 2win s LYS 1346CO -0.08 0.32 1.30 -2.14 -0.92 0.00 0.00 175.35 173.83 2win s PRO 1347N -1.75 3.36 0.58 -1.68 0.02 -1.26 0.28 135.00 134.55 2win s PRO 1347Ca 0.06 2.10 -0.16 0.00 0.02 0.00 0.00 61.00 63.02 2win s PRO 1347Cb -0.10 -2.33 -0.05 0.00 0.02 0.00 0.00 34.50 32.05 2win s PRO 1347CO 0.04 -0.97 1.04 0.00 -0.33 0.00 0.00 177.00 176.77 2win s ALA 1348N -1.37 2.84 -1.23 -1.55 0.00 -0.85 -4.70 121.76 114.90 2win s ALA 1348Ca 0.68 0.31 0.00 0.00 0.00 0.00 0.00 51.96 52.95 2win s ALA 1348Cb -0.37 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2win s ALA 1348CO 0.44 -0.67 0.52 -2.30 0.00 0.00 0.00 175.76 173.76 2win n PRO 1349N -1.98 0.00 0.00 0.00 -0.02 -1.26 -5.02 135.00 126.72 2win n PRO 1349Ca 0.08 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2win n PRO 1349Cb 0.53 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 2win n PRO 1349CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2win n LYS 1359N -1.02 0.00 -0.28 -0.52 4.81 -1.25 -5.27 118.16 114.62 2win n LYS 1359Ca 0.00 0.10 -0.01 0.00 -0.87 0.00 0.00 58.31 57.53 2win n LYS 1359Cb 0.04 -0.56 0.18 0.00 0.02 0.00 0.00 35.03 34.71 2win n LYS 1359CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 2win h ASN 1360N 0.00 0.99 -3.50 3.14 2.35 -1.94 -3.48 115.58 113.13 2win h ASN 1360Ca 0.00 -0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 2win h ASN 1360Cb 0.00 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.12 2win h ASN 1360CO 0.00 0.74 0.00 1.07 -1.65 0.00 0.00 177.43 177.59 2win n THR 1361N -4.39 0.00 -4.62 2.81 5.66 -1.26 -4.47 114.28 108.02 2win n THR 1361Ca 0.09 0.00 -0.32 0.00 -3.05 0.00 0.00 64.05 60.77 2win n THR 1361Cb 0.05 -1.30 -0.06 0.00 -1.55 0.00 0.00 70.33 67.46 2win n THR 1361CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 2win s MET 1362N 0.00 2.21 -0.10 1.09 -1.94 -0.28 -2.01 119.30 118.27 2win s MET 1362Ca 0.00 -2.35 0.04 0.00 -1.71 0.00 0.00 55.69 51.67 2win s MET 1362Cb 0.00 -1.62 0.00 0.00 2.01 0.00 0.00 34.83 35.22 2win s MET 1362CO 0.00 -0.41 -0.23 0.42 -0.01 0.00 0.00 175.02 174.79 2win s ILE 1363N -2.86 2.01 -0.30 2.53 1.01 0.14 -1.32 121.20 122.41 2win s ILE 1363Ca 0.10 -0.99 -0.07 0.00 0.00 0.00 0.00 60.65 59.69 2win s ILE 1363Cb 0.01 -1.74 0.01 0.00 0.01 0.00 0.00 42.46 40.76 2win s ILE 1363CO 0.06 0.55 0.09 -0.22 0.00 0.00 0.00 174.94 175.41 2win s LEU 1364N 0.35 3.94 -0.14 2.97 2.96 -0.81 -2.14 118.68 125.81 2win s LEU 1364Ca -0.19 -0.78 -0.02 0.00 -0.22 0.00 0.00 54.13 52.92 2win s LEU 1364Cb -0.18 -1.88 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 2win s LEU 1364CO 0.09 -0.22 -0.07 -0.70 -1.32 0.00 0.00 176.35 174.13 2win s GLU 1365N 1.48 3.55 -0.13 1.98 2.12 -0.80 -2.22 118.70 124.69 2win s GLU 1365Ca 0.02 -0.58 0.02 0.00 0.36 0.00 0.00 54.97 54.79 2win s GLU 1365Cb -0.18 -2.80 0.01 0.00 0.26 0.00 0.00 34.13 31.43 2win s GLU 1365CO 0.03 0.24 -0.18 0.42 -0.54 0.00 0.00 175.26 175.22 2win s ILE 1366N 0.33 1.77 -0.06 -3.70 1.01 0.19 -2.00 121.20 118.74 2win s ILE 1366Ca -0.06 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 59.83 2win s ILE 1366Cb -0.15 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.74 2win s ILE 1366CO 0.04 0.49 -0.18 0.00 0.00 0.00 0.00 174.94 175.29 2win s THR 1368N 0.16 0.16 -0.15 0.00 -1.32 -1.17 -1.62 115.64 111.70 2win s THR 1368Ca -0.08 -1.31 -0.17 0.00 -1.21 0.00 0.00 61.69 58.92 2win s THR 1368Cb -0.13 -1.21 0.04 0.00 -1.51 0.00 0.00 72.50 69.69 2win s THR 1368CO 0.04 -0.72 0.46 -0.60 -2.21 0.00 0.00 174.62 171.59 2win s ARG 1369N -3.38 0.60 -0.12 7.08 3.52 -0.99 -1.73 118.95 123.94 2win s ARG 1369Ca 0.02 0.51 -0.22 0.00 -0.13 0.00 0.00 55.73 55.91 2win s ARG 1369Cb 0.03 0.29 -0.03 0.00 -1.56 0.00 0.00 34.95 33.68 2win s ARG 1369CO -0.08 -0.10 0.63 -0.47 -0.81 0.00 0.00 175.30 174.47 2win s TYR 1370N -0.06 3.50 -0.17 5.12 5.04 -0.63 -0.52 117.35 129.64 2win s TYR 1370Ca -0.03 1.08 -0.00 0.00 -2.44 0.00 0.00 57.07 55.68 2win s TYR 1370Cb -0.03 -2.75 0.12 0.00 0.35 0.00 0.00 41.96 39.64 2win s TYR 1370CO 0.02 0.02 1.95 0.54 -1.34 0.00 0.00 175.55 176.74 2win n ARG 1371N 4.16 1.43 -4.42 4.97 1.74 -0.82 -4.30 116.66 119.42 2win n ARG 1371Ca -0.02 -0.85 -0.30 0.00 -0.77 0.00 0.00 57.85 55.91 2win n ARG 1371Cb 0.51 -1.33 -0.05 0.00 -1.02 0.00 0.00 32.46 30.57 2win n ARG 1371CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2win s GLY 1372N 0.96 2.76 0.18 -0.13 0.00 -1.26 -4.52 107.32 105.30 2win s GLY 1372Ca 0.17 -0.79 0.17 0.00 0.00 0.00 0.00 44.72 44.27 2win s GLY 1372CO -0.00 -2.09 1.11 -0.55 0.00 0.00 0.00 173.10 171.57 2win h ASP 1373N 1.14 0.00 -3.12 1.64 3.32 -1.96 -3.46 116.42 113.98 2win h ASP 1373Ca -0.41 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.01 2win h ASP 1373Cb 1.31 0.00 -0.12 0.00 0.22 0.00 0.00 39.33 40.73 2win h ASP 1373CO 0.68 0.45 -0.68 -1.10 -1.72 0.00 0.00 179.24 176.87 2win s GLN 1374N -3.01 2.35 -0.30 3.56 -1.52 -1.26 -5.01 119.66 114.47 2win s GLN 1374Ca 0.00 -1.05 -0.28 0.00 -1.95 0.00 0.00 55.36 52.08 2win s GLN 1374Cb 0.08 -2.37 -0.03 0.00 -0.22 0.00 0.00 33.01 30.48 2win s GLN 1374CO 0.78 0.48 1.90 -0.51 -0.25 0.00 0.00 175.29 177.69 2win s ASP 1375N -2.65 5.78 0.29 5.90 1.11 -1.26 -4.75 116.67 121.08 2win s ASP 1375Ca 0.26 1.44 -0.27 0.00 0.18 0.00 0.00 52.55 54.15 2win s ASP 1375Cb -0.10 -2.52 -0.14 0.00 1.07 0.00 0.00 42.92 41.22 2win s ASP 1375CO 0.17 -1.78 0.89 0.00 1.18 0.00 0.00 175.17 175.63 2win n ALA 1376N 10.65 -0.78 -1.00 5.23 0.00 -1.18 -4.81 120.51 128.62 2win n ALA 1376Ca 0.25 0.38 0.00 0.00 0.00 0.00 0.00 53.44 54.06 2win n ALA 1376Cb 0.46 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.98 2win n ALA 1376CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2win n THR 1377N 0.07 0.00 -2.61 0.00 -2.24 -1.26 -2.77 114.28 105.47 2win n THR 1377Ca 0.11 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.46 2win n THR 1377Cb 0.32 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.53 2win n THR 1377CO 0.00 0.00 0.00 -0.32 -0.57 0.00 0.00 175.07 174.18 2win s MET 1378N 0.00 3.95 0.51 -0.78 1.75 -1.20 -3.29 119.30 120.24 2win s MET 1378Ca 0.00 0.95 0.04 0.00 -1.25 0.00 0.00 55.69 55.43 2win s MET 1378Cb 0.00 -3.80 0.04 0.00 2.84 0.00 0.00 34.83 33.91 2win s MET 1378CO 0.00 -1.06 0.31 0.43 -0.65 0.00 0.00 175.02 174.05 2win n SER 1379N 7.23 2.80 -4.05 1.11 7.64 -0.10 -2.87 113.62 125.37 2win n SER 1379Ca 0.12 -2.85 -0.19 0.00 1.01 0.00 0.00 58.87 56.96 2win n SER 1379Cb 0.48 0.04 -0.15 0.00 -1.01 0.00 0.00 64.21 63.57 2win n SER 1379CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2win s ILE 1380N -2.61 0.82 -0.40 0.44 1.09 -0.80 -1.46 121.20 118.28 2win s ILE 1380Ca 0.24 -0.51 -0.05 0.00 -1.10 0.00 0.00 60.65 59.23 2win s ILE 1380Cb -0.02 -0.70 0.09 0.00 -1.06 0.00 0.00 42.46 40.78 2win s ILE 1380CO 0.15 0.18 0.20 -0.76 -0.10 0.00 0.00 174.94 174.62 2win s LEU 1381N -0.37 5.08 -0.42 2.97 1.43 -0.26 -3.46 118.68 123.65 2win s LEU 1381Ca 0.03 -1.77 -0.19 0.00 -1.03 0.00 0.00 54.13 51.17 2win s LEU 1381Cb -0.04 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.32 2win s LEU 1381CO -0.00 -0.52 0.55 -0.62 0.23 0.00 0.00 176.35 175.99 2win s ASP 1382N 1.91 6.28 -0.07 2.29 2.15 -0.44 -1.02 116.67 127.77 2win s ASP 1382Ca 0.05 -0.39 0.02 0.00 0.43 0.00 0.00 52.55 52.65 2win s ASP 1382Cb -0.23 -2.28 -0.03 0.00 -0.30 0.00 0.00 42.92 40.09 2win s ASP 1382CO -0.02 -0.66 -0.11 -0.63 -0.17 0.00 0.00 175.17 173.59 2win s ILE 1383N 2.52 3.36 -0.20 4.11 1.01 0.33 -0.43 121.20 131.89 2win s ILE 1383Ca 0.18 -0.60 0.01 0.00 0.00 0.00 0.00 60.65 60.24 2win s ILE 1383Cb -0.15 -2.36 0.04 0.00 0.01 0.00 0.00 42.46 40.00 2win s ILE 1383CO 0.16 0.58 -0.12 -0.94 0.00 0.00 0.00 174.94 174.62 2win s SER 1384N -0.57 3.38 0.86 3.58 1.04 0.30 -0.81 113.70 121.49 2win s SER 1384Ca 0.08 -0.86 -0.11 0.00 0.48 0.00 0.00 55.95 55.54 2win s SER 1384Cb -0.12 -1.28 0.11 0.00 0.10 0.00 0.00 66.02 64.83 2win s SER 1384CO 0.02 -0.12 1.10 -0.04 0.98 0.00 0.00 173.24 175.17 2win s MET 1385N 1.37 1.54 -0.32 4.02 1.00 0.07 -2.33 119.30 124.64 2win s MET 1385Ca -0.01 1.09 -0.27 0.00 0.00 0.00 0.00 55.69 56.50 2win s MET 1385Cb -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 34.83 32.86 2win s MET 1385CO -0.09 -2.12 0.97 -1.64 0.00 0.00 0.00 175.02 172.14 2win s MET 1386N -4.85 4.01 -0.45 2.03 -1.94 -1.26 -4.61 119.30 112.22 2win s MET 1386Ca 0.63 0.87 -0.19 0.00 -1.71 0.00 0.00 55.69 55.29 2win s MET 1386Cb -0.19 -3.74 -0.11 0.00 2.01 0.00 0.00 34.83 32.80 2win s MET 1386CO 0.57 -0.84 1.35 -2.37 -0.01 0.00 0.00 175.02 173.72 2win n THR 1387N 5.79 0.00 0.00 2.05 5.66 -1.25 -1.07 114.28 125.46 2win n THR 1387Ca 0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.09 2win n THR 1387Cb 0.47 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 68.99 2win n THR 1387CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2win n GLY 1388N 3.64 1.60 2.94 1.09 0.00 -1.26 -4.71 105.19 108.49 2win n GLY 1388Ca 0.34 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.18 2win n GLY 1388CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2win s PHE 1389N -2.00 0.56 -0.03 1.61 0.08 -0.23 -2.30 117.98 115.66 2win s PHE 1389Ca 0.00 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 56.96 2win s PHE 1389Cb 0.00 -0.41 0.00 0.00 -0.57 0.00 0.00 43.02 42.04 2win s PHE 1389CO 0.00 -0.05 -0.10 0.00 -0.10 0.00 0.00 175.22 174.97 2win s ALA 1390N 0.15 0.92 0.46 5.36 0.00 -0.78 -4.61 121.76 123.25 2win s ALA 1390Ca -0.01 -0.36 -0.25 0.00 0.00 0.00 0.00 51.96 51.34 2win s ALA 1390Cb -0.06 -0.34 -0.08 0.00 0.00 0.00 0.00 23.12 22.64 2win s ALA 1390CO -0.00 0.15 1.37 -2.30 0.00 0.00 0.00 175.76 174.97 2win n PRO 1391N 3.31 2.06 -2.05 0.00 -0.02 -1.26 -2.07 135.00 134.97 2win n PRO 1391Ca -0.18 0.74 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 2win n PRO 1391Cb 0.54 -2.55 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 2win n PRO 1391CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2win s ASP 1392N -0.57 6.71 0.14 2.55 2.15 0.72 -4.82 116.67 123.55 2win s ASP 1392Ca 0.63 2.30 -0.19 0.00 0.43 0.00 0.00 52.55 55.72 2win s ASP 1392Cb -0.46 -2.56 0.01 0.00 -0.30 0.00 0.00 42.92 39.61 2win s ASP 1392CO 0.56 -0.83 1.70 0.71 -0.17 0.00 0.00 175.17 177.14 2win h THR 1393N 4.98 0.78 -0.79 1.71 1.35 -1.91 -2.29 112.91 116.73 2win h THR 1393Ca -0.40 -0.01 0.05 0.00 -0.55 0.00 0.00 66.41 65.49 2win h THR 1393Cb 1.19 0.73 -0.05 0.00 -1.73 0.00 0.00 68.15 68.29 2win h THR 1393CO 0.92 0.01 0.49 0.44 -0.25 0.00 0.00 175.52 177.14 2win h ASP 1394N 0.04 0.79 -0.10 5.36 3.32 -1.99 -1.74 116.42 122.11 2win h ASP 1394Ca 0.13 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 57.13 2win h ASP 1394Cb 0.18 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.55 2win h ASP 1394CO -0.24 0.53 -0.07 0.44 -1.72 0.00 0.00 179.24 178.18 2win h ASP 1395N 0.94 0.34 -0.47 6.45 5.19 -1.85 -2.65 116.42 124.38 2win h ASP 1395Ca 0.33 -0.07 -0.12 0.00 -0.62 0.00 0.00 57.03 56.56 2win h ASP 1395Cb 0.09 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 2win h ASP 1395CO -0.14 0.46 -0.15 -0.07 -3.12 0.00 0.00 179.24 176.22 2win h LEU 1396N 0.35 0.97 -1.00 1.55 3.38 -0.78 -2.50 115.31 117.27 2win h LEU 1396Ca 0.07 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.71 2win h LEU 1396Cb 0.35 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.79 2win h LEU 1396CO 0.02 1.11 0.59 0.11 0.09 0.00 0.00 178.44 180.35 2win h LYS 1397N 0.84 1.27 -0.02 1.13 6.56 -1.12 -0.55 116.57 124.69 2win h LYS 1397Ca 0.12 -0.10 -0.00 0.00 -1.06 0.00 0.00 60.65 59.61 2win h LYS 1397Cb 0.71 -0.27 -0.00 0.00 -0.57 0.00 0.00 32.23 32.09 2win h LYS 1397CO 0.05 0.87 0.01 0.37 -2.06 0.00 0.00 179.45 178.69 2win h GLN 1398N 1.30 0.03 0.00 3.15 5.75 -1.24 -0.62 115.11 123.47 2win h GLN 1398Ca 0.34 -0.00 -0.06 0.00 -0.15 0.00 0.00 58.65 58.78 2win h GLN 1398Cb -0.09 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.45 2win h GLN 1398CO -0.07 0.15 -0.27 -0.07 -2.65 0.00 0.00 178.83 175.93 2win h LEU 1399N -0.11 0.00 0.01 -2.39 3.38 -1.31 -2.87 115.31 112.02 2win h LEU 1399Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2win h LEU 1399Cb 0.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2win h LEU 1399CO -0.00 0.27 -0.00 0.00 0.09 0.00 0.00 178.44 178.80 2win h ALA 1400N 1.73 -0.01 0.00 1.53 0.00 -0.79 -3.26 119.26 118.47 2win h ALA 1400Ca -0.00 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2win h ALA 1400Cb 0.63 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 2win h ALA 1400CO 0.04 -0.15 -0.04 -0.91 0.00 0.00 0.00 179.25 178.19 2win h ASN 1401N -0.73 0.00 -3.93 0.00 -0.26 -1.10 -3.42 115.58 106.15 2win h ASN 1401Ca -0.00 0.00 -0.53 0.00 -0.56 0.00 0.00 56.30 55.21 2win h ASN 1401Cb 0.71 0.00 0.09 0.00 -1.06 0.00 0.00 38.32 38.06 2win h ASN 1401CO 0.00 0.04 0.66 -0.83 -1.06 0.00 0.00 177.43 176.25 2win s GLY 1402N -4.12 2.95 0.77 2.83 0.00 -1.09 -4.99 107.32 103.68 2win s GLY 1402Ca -0.05 1.34 -0.12 0.00 0.00 0.00 0.00 44.72 45.89 2win s GLY 1402CO 0.63 1.96 1.12 0.54 0.00 0.00 0.00 173.10 177.35 2win s VAL 1403N -1.19 2.98 0.00 1.40 0.11 -1.26 -3.07 120.40 119.37 2win s VAL 1403Ca 0.54 0.36 0.00 0.00 -2.93 0.00 0.00 61.98 59.95 2win s VAL 1403Cb -0.41 -2.78 0.00 0.00 -1.53 0.00 0.00 36.38 31.66 2win s VAL 1403CO 0.54 -0.37 0.00 0.47 -3.33 0.00 0.00 175.10 172.40 2win n ASP 1404N -3.34 -0.46 -4.16 3.54 8.00 -1.26 -4.96 116.55 113.91 2win n ASP 1404Ca 0.10 0.00 -0.18 0.00 0.71 0.00 0.00 54.79 55.43 2win n ASP 1404Cb 0.52 -1.25 -0.12 0.00 -0.02 0.00 0.00 41.12 40.25 2win n ASP 1404CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2win s ARG 1405N -0.52 0.79 -0.17 -1.24 0.52 -1.17 -1.04 118.95 116.11 2win s ARG 1405Ca 0.00 -0.94 -0.12 0.00 -0.52 0.00 0.00 55.73 54.15 2win s ARG 1405Cb 0.00 -0.75 0.05 0.00 0.52 0.00 0.00 34.95 34.77 2win s ARG 1405CO 0.00 0.16 0.43 -0.47 0.02 0.00 0.00 175.30 175.44 2win s TYR 1406N -1.33 -0.57 -0.18 -0.53 5.04 -0.24 -4.75 117.35 114.79 2win s TYR 1406Ca -0.03 1.26 -0.02 0.00 -2.44 0.00 0.00 57.07 55.85 2win s TYR 1406Cb -0.10 0.24 0.05 0.00 0.35 0.00 0.00 41.96 42.50 2win s TYR 1406CO 0.02 -0.30 0.01 0.42 -1.34 0.00 0.00 175.55 174.36 2win s ILE 1407N 0.96 0.68 0.41 3.14 1.01 -1.26 -1.45 121.20 124.69 2win s ILE 1407Ca -0.06 -0.55 -0.24 0.00 0.00 0.00 0.00 60.65 59.80 2win s ILE 1407Cb -0.06 -1.08 -0.11 0.00 0.01 0.00 0.00 42.46 41.22 2win s ILE 1407CO -0.08 -0.09 0.86 -1.54 0.00 0.00 0.00 174.94 174.09 2win n SER 1408N 5.00 0.58 -0.05 3.58 3.41 -1.26 -4.79 113.62 120.08 2win n SER 1408Ca -0.09 1.01 0.19 0.00 -0.26 0.00 0.00 58.87 59.71 2win n SER 1408Cb 0.47 -1.27 0.64 0.00 -0.26 0.00 0.00 64.21 63.79 2win n SER 1408CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2win h LYS 1409N 1.32 0.11 -0.54 4.33 3.64 -2.00 0.27 116.57 123.70 2win h LYS 1409Ca -0.43 -0.01 0.02 0.00 -1.27 0.00 0.00 60.65 58.97 2win h LYS 1409Cb 1.36 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 33.12 2win h LYS 1409CO 0.55 0.08 0.36 -0.92 -2.27 0.00 0.00 179.45 177.25 2win h TYR 1410N 0.12 0.63 0.00 1.91 3.20 -1.97 -1.99 116.97 118.86 2win h TYR 1410Ca 0.29 0.02 -0.10 0.00 3.14 0.00 0.00 58.73 62.08 2win h TYR 1410Cb 0.99 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 39.04 2win h TYR 1410CO -0.00 0.38 -0.60 1.49 -1.64 0.00 0.00 178.16 177.79 2win h GLU 1411N 0.66 0.00 0.00 1.82 4.57 -1.27 -3.39 114.58 116.96 2win h GLU 1411Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2win h GLU 1411Cb 0.03 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.62 2win h GLU 1411CO -0.05 0.41 0.00 1.28 -1.18 0.00 0.00 179.01 179.47 2win n LEU 1412N -3.15 0.16 -3.48 1.64 4.32 -0.75 -4.10 117.00 111.64 2win n LEU 1412Ca 0.01 0.77 -0.37 0.00 -0.02 0.00 0.00 56.01 56.39 2win n LEU 1412Cb 0.72 -0.37 -0.03 0.00 -1.62 0.00 0.00 43.42 42.13 2win n LEU 1412CO 0.40 -0.37 2.55 -0.90 -1.22 0.00 0.00 177.39 177.86 2win n ASP 1413N -1.60 4.55 -0.01 -1.43 3.85 -1.20 -4.03 116.55 116.69 2win n ASP 1413Ca 0.00 -2.61 0.01 0.00 -0.71 0.00 0.00 54.79 51.48 2win n ASP 1413Cb 0.00 -1.33 -0.03 0.00 -1.35 0.00 0.00 41.12 38.42 2win n ASP 1413CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 2win n LYS 1414N 5.47 1.19 -1.03 0.11 5.02 -1.26 -5.06 118.16 122.61 2win n LYS 1414Ca 0.54 -0.02 0.13 0.00 -2.02 0.00 0.00 58.31 56.93 2win n LYS 1414Cb 0.30 -1.08 -0.06 0.00 -0.02 0.00 0.00 35.03 34.16 2win n LYS 1414CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2win n ALA 1415N -1.78 -2.71 -0.35 7.82 0.00 -1.26 -4.05 120.51 118.18 2win n ALA 1415Ca -0.02 0.64 0.25 0.00 0.00 0.00 0.00 53.44 54.30 2win n ALA 1415Cb 0.26 -1.11 0.50 0.00 0.00 0.00 0.00 19.45 19.10 2win n ALA 1415CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 2win h PHE 1416N -1.01 0.83 0.00 0.00 0.04 -1.95 -3.30 116.94 111.55 2win h PHE 1416Ca -0.13 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.68 2win h PHE 1416Cb 0.98 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 38.91 2win h PHE 1416CO 0.03 -0.11 0.00 -1.13 -0.60 0.00 0.00 178.31 176.50 2win n SER 1417N -4.89 0.00 -4.46 2.17 3.41 -1.26 -4.15 113.62 104.43 2win n SER 1417Ca 0.31 0.00 -0.44 0.00 -0.26 0.00 0.00 58.87 58.48 2win n SER 1417Cb 1.01 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.94 2win n SER 1417CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2win s ASP 1418N -2.58 6.72 -0.08 4.04 1.47 -1.24 -4.51 116.67 120.49 2win s ASP 1418Ca 0.00 -2.24 0.04 0.00 1.18 0.00 0.00 52.55 51.53 2win s ASP 1418Cb 0.00 -2.41 0.11 0.00 -0.34 0.00 0.00 42.92 40.28 2win s ASP 1418CO 0.00 -1.01 1.13 -1.14 0.68 0.00 0.00 175.17 174.83 2win n ARG 1419N 6.46 0.33 0.28 2.11 0.63 -1.26 -4.75 116.66 120.46 2win n ARG 1419Ca 0.27 -1.10 0.14 0.00 -0.92 0.00 0.00 57.85 56.24 2win n ARG 1419Cb 0.48 0.45 0.86 0.00 0.45 0.00 0.00 32.46 34.69 2win n ARG 1419CO 0.00 0.00 0.00 -2.95 -2.51 0.00 0.00 177.63 172.17 2win h ASN 1420N 0.29 0.00 -3.35 6.15 -1.07 -1.86 -3.40 115.58 112.34 2win h ASN 1420Ca -0.53 0.00 -0.65 0.00 0.07 0.00 0.00 56.30 55.19 2win h ASN 1420Cb 1.40 0.00 -0.25 0.00 -2.07 0.00 0.00 38.32 37.39 2win h ASN 1420CO -0.25 0.00 -0.74 0.42 0.07 0.00 0.00 177.43 176.92 2win s THR 1421N -4.72 3.22 0.08 6.14 -4.23 -1.26 -0.75 115.64 114.12 2win s THR 1421Ca -0.05 -0.60 0.08 0.00 -1.18 0.00 0.00 61.69 59.94 2win s THR 1421Cb 0.16 -2.36 -0.03 0.00 1.34 0.00 0.00 72.50 71.60 2win s THR 1421CO 0.57 0.52 -0.23 -0.22 -0.54 0.00 0.00 174.62 174.73 2win s LEU 1422N 0.28 2.24 -0.20 4.79 2.96 0.01 -5.00 118.68 123.75 2win s LEU 1422Ca -0.08 -0.62 -0.02 0.00 -0.22 0.00 0.00 54.13 53.18 2win s LEU 1422Cb -0.15 -1.03 0.06 0.00 0.50 0.00 0.00 46.19 45.57 2win s LEU 1422CO 0.05 0.14 0.01 -0.63 -1.32 0.00 0.00 176.35 174.60 2win s ILE 1423N -0.96 0.78 -0.41 6.68 1.01 -1.26 -0.51 121.20 126.52 2win s ILE 1423Ca 0.09 -0.72 -0.08 0.00 0.00 0.00 0.00 60.65 59.94 2win s ILE 1423Cb -0.10 -1.22 0.08 0.00 0.01 0.00 0.00 42.46 41.24 2win s ILE 1423CO 0.03 -0.17 0.24 -0.63 0.00 0.00 0.00 174.94 174.41 2win s ILE 1424N 1.74 4.02 -0.01 2.92 1.01 -0.19 -4.73 121.20 125.96 2win s ILE 1424Ca -0.02 -1.52 -0.30 0.00 0.00 0.00 0.00 60.65 58.81 2win s ILE 1424Cb -0.17 -3.50 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2win s ILE 1424CO -0.07 -0.52 1.16 -0.31 0.00 0.00 0.00 174.94 175.19 2win s TYR 1425N 1.37 3.35 -0.08 3.97 1.51 -0.53 -1.10 117.35 125.83 2win s TYR 1425Ca 0.03 1.32 -0.02 0.00 -1.01 0.00 0.00 57.07 57.40 2win s TYR 1425Cb -0.23 -3.37 -0.03 0.00 -0.11 0.00 0.00 41.96 38.21 2win s TYR 1425CO 0.01 -1.09 -0.00 -0.51 -1.11 0.00 0.00 175.55 172.84 2win s LEU 1426N 1.67 3.55 0.33 -1.29 1.43 -0.53 -1.08 118.68 122.77 2win s LEU 1426Ca 0.56 0.13 0.19 0.00 -1.03 0.00 0.00 54.13 53.98 2win s LEU 1426Cb -0.26 -1.81 0.17 0.00 0.03 0.00 0.00 46.19 44.33 2win s LEU 1426CO 0.25 0.38 1.47 0.44 0.23 0.00 0.00 176.35 179.11 2win h ASP 1427N 5.17 0.00 -4.49 2.29 5.19 -1.37 -0.23 116.42 122.99 2win h ASP 1427Ca -0.51 0.00 0.16 0.00 -0.62 0.00 0.00 57.03 56.06 2win h ASP 1427Cb 1.19 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 40.53 2win h ASP 1427CO 0.54 0.26 0.61 -1.59 -3.12 0.00 0.00 179.24 175.94 2win s LYS 1428N -3.09 0.64 -0.04 3.56 -2.85 -1.21 -3.24 119.74 113.52 2win s LYS 1428Ca 0.05 -0.23 -0.01 0.00 -1.00 0.00 0.00 55.97 54.78 2win s LYS 1428Cb 0.07 0.29 0.03 0.00 -2.06 0.00 0.00 37.83 36.16 2win s LYS 1428CO 0.72 -0.28 0.03 0.14 0.10 0.00 0.00 175.35 176.07 2win s VAL 1429N -2.84 0.02 0.74 1.79 -7.23 -1.11 -4.94 120.40 106.83 2win s VAL 1429Ca 0.06 0.28 -0.15 0.00 -1.81 0.00 0.00 61.98 60.36 2win s VAL 1429Cb -0.01 -0.21 0.04 0.00 0.56 0.00 0.00 36.38 36.75 2win s VAL 1429CO -0.07 0.17 1.18 -0.24 -0.31 0.00 0.00 175.10 175.82 2win n SER 1430N 4.84 1.24 -0.00 4.85 2.88 -1.26 -3.09 113.62 123.07 2win n SER 1430Ca -0.13 0.68 0.05 0.00 -1.33 0.00 0.00 58.87 58.14 2win n SER 1430Cb 0.50 -1.50 -0.07 0.00 -0.75 0.00 0.00 64.21 62.39 2win n SER 1430CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2win n HIS 1431N -2.70 0.00 -0.02 0.66 1.44 -1.26 -1.60 115.22 111.73 2win n HIS 1431Ca 0.14 0.00 -0.01 0.00 -2.01 0.00 0.00 57.72 55.84 2win n HIS 1431Cb 0.49 -0.05 -0.00 0.00 0.12 0.00 0.00 29.99 30.55 2win n HIS 1431CO 0.00 0.00 0.00 0.77 -2.81 0.00 0.00 176.34 174.30 2win h SER 1432N 0.00 0.00 -3.99 4.39 0.02 -1.90 -3.44 113.55 108.62 2win h SER 1432Ca 0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 2win h SER 1432Cb 0.31 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2win h SER 1432CO 0.00 0.25 -0.05 -1.84 -1.14 0.00 0.00 176.83 174.05 2win n GLU 1433N -3.15 1.32 -3.84 3.45 -0.00 -1.26 -5.07 120.64 112.08 2win n GLU 1433Ca -0.02 -0.70 -0.35 0.00 -0.00 0.00 0.00 57.16 56.10 2win n GLU 1433Cb 0.06 0.07 -0.09 0.00 -0.00 0.00 0.00 31.44 31.48 2win n GLU 1433CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2win s ASP 1434N -1.66 5.95 -0.50 -1.84 1.01 -1.26 -4.62 116.67 113.76 2win s ASP 1434Ca 0.06 0.15 -0.23 0.00 0.71 0.00 0.00 52.55 53.25 2win s ASP 1434Cb -0.01 -2.04 0.04 0.00 1.01 0.00 0.00 42.92 41.93 2win s ASP 1434CO 0.04 0.17 0.81 -1.81 0.21 0.00 0.00 175.17 174.59 2win s ASP 1435N 0.42 6.34 -0.06 0.27 1.01 -0.70 -4.88 116.67 119.08 2win s ASP 1435Ca 0.06 -0.37 0.02 0.00 0.71 0.00 0.00 52.55 52.97 2win s ASP 1435Cb -0.12 -2.38 -0.03 0.00 1.01 0.00 0.00 42.92 41.40 2win s ASP 1435CO -0.01 -1.02 -0.08 0.00 0.21 0.00 0.00 175.17 174.26 2win s LEU 1437N -0.81 2.50 -0.09 0.00 0.05 -0.44 -4.99 118.68 114.89 2win s LEU 1437Ca 0.12 -1.01 -0.17 0.00 0.05 0.00 0.00 54.13 53.12 2win s LEU 1437Cb -0.11 -0.08 0.04 0.00 -2.05 0.00 0.00 46.19 43.99 2win s LEU 1437CO 0.01 -0.47 0.41 0.00 -0.55 0.00 0.00 176.35 175.76 2win s ALA 1438N -3.62 -1.03 0.05 1.48 0.00 -1.26 -0.64 121.76 116.74 2win s ALA 1438Ca 0.12 0.87 -0.06 0.00 0.00 0.00 0.00 51.96 52.88 2win s ALA 1438Cb 0.05 -0.31 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 2win s ALA 1438CO -0.04 -0.24 0.12 -0.59 0.00 0.00 0.00 175.76 175.00 2win s PHE 1439N -0.56 0.19 0.32 0.00 -0.71 -0.94 -5.00 117.98 111.28 2win s PHE 1439Ca -0.07 -0.53 -0.18 0.00 -1.04 0.00 0.00 56.93 55.11 2win s PHE 1439Cb -0.04 -0.13 -0.09 0.00 -1.21 0.00 0.00 43.02 41.55 2win s PHE 1439CO 0.03 -0.41 0.79 0.15 -1.34 0.00 0.00 175.22 174.44 2win s LYS 1440N -2.98 4.15 0.01 1.99 1.02 -1.26 -1.93 119.74 120.74 2win s LYS 1440Ca -0.02 0.86 0.03 0.00 0.02 0.00 0.00 55.97 56.86 2win s LYS 1440Cb 0.01 -2.51 -0.01 0.00 -0.52 0.00 0.00 37.83 34.80 2win s LYS 1440CO -0.06 0.18 -0.10 0.14 -0.92 0.00 0.00 175.35 174.59 2win s VAL 1441N -1.89 0.81 0.10 3.17 -7.23 -0.43 -0.20 120.40 114.72 2win s VAL 1441Ca 0.53 -0.63 0.10 0.00 -1.81 0.00 0.00 61.98 60.17 2win s VAL 1441Cb -0.12 -0.71 -0.04 0.00 0.56 0.00 0.00 36.38 36.07 2win s VAL 1441CO 0.18 0.09 -0.25 -1.00 -0.31 0.00 0.00 175.10 173.80 2win s HIS 1442N -0.51 2.36 -0.14 2.82 3.76 -0.88 -1.13 115.29 121.57 2win s HIS 1442Ca 0.01 -0.37 -0.16 0.00 -0.15 0.00 0.00 55.06 54.40 2win s HIS 1442Cb -0.05 -1.32 -0.04 0.00 1.11 0.00 0.00 32.58 32.27 2win s HIS 1442CO 0.00 0.28 0.39 -1.14 -0.85 0.00 0.00 174.74 173.42 2win s GLN 1443N -1.78 4.30 0.00 1.40 0.74 -1.26 -1.87 119.66 121.18 2win s GLN 1443Ca 0.14 0.29 0.00 0.00 0.05 0.00 0.00 55.36 55.84 2win s GLN 1443Cb -0.10 -3.44 0.00 0.00 1.10 0.00 0.00 33.01 30.57 2win s GLN 1443CO 0.05 0.18 0.20 2.48 -0.55 0.00 0.00 175.29 177.66 2win n TYR 1444N 3.67 0.00 0.00 1.67 0.18 -0.97 -3.83 117.16 117.87 2win n TYR 1444Ca -0.09 -0.01 0.00 0.00 1.88 0.00 0.00 57.90 59.68 2win n TYR 1444Cb 0.52 -0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.48 2win n TYR 1444CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2win n PHE 1445N -0.01 0.00 -2.64 -3.48 7.35 -1.25 -5.08 117.46 112.34 2win n PHE 1445Ca 0.00 0.00 -0.00 0.00 -0.76 0.00 0.00 57.45 56.69 2win n PHE 1445Cb 0.18 0.00 -0.00 0.00 0.35 0.00 0.00 39.48 40.00 2win n PHE 1445CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2win n ASN 1446N -1.81 -4.58 -3.68 -2.13 5.15 -1.26 -5.04 115.26 101.90 2win n ASN 1446Ca 0.00 1.03 -0.09 0.00 -0.60 0.00 0.00 54.58 54.91 2win n ASN 1446Cb 0.43 -1.86 -0.10 0.00 -0.53 0.00 0.00 39.78 37.72 2win n ASN 1446CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 2win s VAL 1447N -0.06 -0.22 0.52 3.44 0.11 -1.26 -5.15 120.40 117.79 2win s VAL 1447Ca -0.02 0.11 -0.20 0.00 -2.93 0.00 0.00 61.98 58.94 2win s VAL 1447Cb 0.00 -0.66 -0.08 0.00 -1.53 0.00 0.00 36.38 34.11 2win s VAL 1447CO 0.04 0.04 0.81 -1.84 -3.33 0.00 0.00 175.10 170.83 2win n GLU 1448N 4.61 0.89 -2.88 1.54 0.28 -1.26 -3.99 120.64 119.83 2win n GLU 1448Ca -0.19 0.33 -0.07 0.00 -0.16 0.00 0.00 57.16 57.08 2win n GLU 1448Cb 0.54 -1.94 0.01 0.00 1.43 0.00 0.00 31.44 31.48 2win n GLU 1448CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2win n LEU 1449N 0.16 -7.26 -4.86 -1.84 4.77 -1.26 -4.99 117.00 101.72 2win n LEU 1449Ca 0.12 0.82 -0.32 0.00 -0.03 0.00 0.00 56.01 56.59 2win n LEU 1449Cb 0.44 -3.12 -0.06 0.00 -2.33 0.00 0.00 43.42 38.35 2win n LEU 1449CO 0.52 -2.45 0.35 0.27 -1.33 0.00 0.00 177.39 174.76 2win s ILE 1450N -2.04 4.76 -0.08 -0.08 -5.25 -1.26 -5.05 121.20 112.21 2win s ILE 1450Ca 0.15 0.78 -0.25 0.00 -0.99 0.00 0.00 60.65 60.35 2win s ILE 1450Cb -0.04 -3.61 -0.03 0.00 2.95 0.00 0.00 42.46 41.73 2win s ILE 1450CO 0.74 -0.15 0.77 -1.58 -1.79 0.00 0.00 174.94 172.93 2win s GLN 1451N -2.93 4.42 0.23 0.37 0.74 -1.26 -4.98 119.66 116.26 2win s GLN 1451Ca 0.52 0.99 -0.32 0.00 0.05 0.00 0.00 55.36 56.61 2win s GLN 1451Cb -0.10 -3.48 -0.13 0.00 1.10 0.00 0.00 33.01 30.40 2win s GLN 1451CO 0.19 -0.04 1.52 -2.30 -0.55 0.00 0.00 175.29 174.10 2win n PRO 1452N 4.12 2.29 -1.09 1.67 -0.02 -1.26 -3.82 135.00 136.88 2win n PRO 1452Ca 0.01 0.82 -0.22 0.00 -2.02 0.00 0.00 63.50 62.09 2win n PRO 1452Cb 0.51 -2.55 0.17 0.00 -0.02 0.00 0.00 33.50 31.61 2win n PRO 1452CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2win n GLY 1453N 2.57 -2.07 3.58 -1.23 0.00 -0.88 -4.85 105.19 102.30 2win n GLY 1453Ca 0.12 -1.59 -0.15 0.00 0.00 0.00 0.00 46.02 44.40 2win n GLY 1453CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2win s ALA 1454N -3.48 -1.79 -0.06 4.61 0.00 -0.99 -2.92 121.76 117.13 2win s ALA 1454Ca 0.55 1.72 0.02 0.00 0.00 0.00 0.00 51.96 54.24 2win s ALA 1454Cb -0.03 -0.69 0.02 0.00 0.00 0.00 0.00 23.12 22.41 2win s ALA 1454CO 0.40 -0.35 -0.10 0.08 0.00 0.00 0.00 175.76 175.79 2win s VAL 1455N -0.32 1.00 -0.06 0.00 1.01 0.17 -0.54 120.40 121.67 2win s VAL 1455Ca -0.04 -0.40 0.06 0.00 0.00 0.00 0.00 61.98 61.60 2win s VAL 1455Cb -0.03 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 2win s VAL 1455CO 0.04 0.33 -0.24 -0.75 0.00 0.00 0.00 175.10 174.48 2win s LYS 1456N 0.75 2.56 -0.00 2.72 2.20 0.42 -1.76 119.74 126.62 2win s LYS 1456Ca -0.13 -0.90 0.07 0.00 -0.36 0.00 0.00 55.97 54.65 2win s LYS 1456Cb -0.15 -2.18 -0.02 0.00 -1.51 0.00 0.00 37.83 33.97 2win s LYS 1456CO 0.03 0.39 -0.22 0.14 -0.36 0.00 0.00 175.35 175.33 2win s VAL 1457N -0.18 1.74 -0.17 4.02 -7.23 -0.76 -1.33 120.40 116.49 2win s VAL 1457Ca -0.03 -1.01 -0.32 0.00 -1.81 0.00 0.00 61.98 58.82 2win s VAL 1457Cb -0.14 -1.46 0.14 0.00 0.56 0.00 0.00 36.38 35.48 2win s VAL 1457CO 0.03 0.43 1.13 -0.72 -0.31 0.00 0.00 175.10 175.66 2win s TYR 1458N -0.58 -0.21 0.68 2.82 -0.85 -1.23 -2.06 117.35 115.92 2win s TYR 1458Ca 0.08 0.25 -0.11 0.00 -0.52 0.00 0.00 57.07 56.78 2win s TYR 1458Cb -0.09 0.50 -0.00 0.00 0.38 0.00 0.00 41.96 42.75 2win s TYR 1458CO -0.00 -0.27 1.05 0.00 -1.52 0.00 0.00 175.55 174.82 2win s ALA 1459N -1.92 2.78 -0.09 9.51 0.00 -1.24 -1.89 121.76 128.91 2win s ALA 1459Ca 0.05 0.02 0.26 0.00 0.00 0.00 0.00 51.96 52.30 2win s ALA 1459Cb -0.01 -3.15 0.81 0.00 0.00 0.00 0.00 23.12 20.78 2win s ALA 1459CO -0.04 -1.10 1.78 0.10 0.00 0.00 0.00 175.76 176.50 2win h TYR 1460N -0.62 0.00 0.00 0.00 -0.00 -1.88 -3.15 116.97 111.31 2win h TYR 1460Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.29 2win h TYR 1460Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.94 2win h TYR 1460CO 0.62 0.10 -0.93 2.48 -0.00 0.00 0.00 178.16 180.44 2win n TYR 1461N -3.17 0.09 -3.68 0.10 0.18 -1.26 -4.87 117.16 104.55 2win n TYR 1461Ca 0.02 0.03 -0.16 0.00 1.88 0.00 0.00 57.90 59.66 2win n TYR 1461Cb 0.45 -0.23 -0.15 0.00 -0.38 0.00 0.00 39.34 39.02 2win n TYR 1461CO 0.00 0.00 0.00 1.21 -2.08 0.00 0.00 176.86 175.99 2win s ASN 1462N -3.38 0.62 -0.13 9.48 3.04 -1.19 -5.02 114.94 118.36 2win s ASN 1462Ca 0.07 0.35 0.14 0.00 0.04 0.00 0.00 52.86 53.46 2win s ASN 1462Cb 0.16 0.29 -0.24 0.00 -1.54 0.00 0.00 41.25 39.92 2win s ASN 1462CO 0.81 -0.23 0.32 -0.11 -3.04 0.00 0.00 177.10 174.85 2win n LEU 1463N 5.18 0.54 -0.02 3.21 7.94 -1.26 -3.58 117.00 129.01 2win n LEU 1463Ca -0.07 0.18 -0.09 0.00 -1.11 0.00 0.00 56.01 54.91 2win n LEU 1463Cb 0.50 0.27 -0.04 0.00 0.53 0.00 0.00 43.42 44.68 2win n LEU 1463CO 0.06 0.48 0.84 -0.33 -1.11 0.00 0.00 177.39 177.32 2win h GLU 1464N 0.00 -0.00 -3.56 1.96 3.07 -1.95 -3.23 114.58 110.87 2win h GLU 1464Ca -0.43 0.00 -0.67 0.00 -0.50 0.00 0.00 59.36 57.76 2win h GLU 1464Cb 2.13 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 30.04 2win h GLU 1464CO 0.05 -0.00 3.37 -0.85 -1.40 0.00 0.00 179.01 180.18 2win n GLU 1465N -5.17 3.09 -4.36 2.33 0.28 -1.26 -4.89 120.64 110.65 2win n GLU 1465Ca -0.03 -2.30 -0.25 0.00 -0.16 0.00 0.00 57.16 54.41 2win n GLU 1465Cb 0.10 -3.00 -0.09 0.00 1.43 0.00 0.00 31.44 29.88 2win n GLU 1465CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 2win s SER 1466N 2.88 4.04 -0.05 -1.84 1.04 -1.22 -4.63 113.70 113.91 2win s SER 1466Ca 0.57 -0.76 0.02 0.00 0.48 0.00 0.00 55.95 56.26 2win s SER 1466Cb 0.16 -0.58 0.01 0.00 0.10 0.00 0.00 66.02 65.71 2win s SER 1466CO -0.06 0.06 -0.09 0.00 0.98 0.00 0.00 173.24 174.13 2win s THR 1468N 0.65 1.32 0.23 0.00 2.01 -1.26 -1.83 115.64 116.76 2win s THR 1468Ca -0.11 -0.58 0.11 0.00 0.31 0.00 0.00 61.69 61.42 2win s THR 1468Cb -0.14 -1.19 -0.05 0.00 0.01 0.00 0.00 72.50 71.13 2win s THR 1468CO 0.02 0.40 -0.19 -0.13 -0.69 0.00 0.00 174.62 174.03 2win s ARG 1469N 0.66 1.71 0.42 4.92 3.00 -0.72 -4.97 118.95 123.97 2win s ARG 1469Ca -0.14 -1.58 0.07 0.00 0.00 0.00 0.00 55.73 54.08 2win s ARG 1469Cb -0.16 -1.88 -0.06 0.00 0.00 0.00 0.00 34.95 32.85 2win s ARG 1469CO 0.04 0.37 0.10 -0.06 0.00 0.00 0.00 175.30 175.75 2win s PHE 1470N -2.06 2.53 -0.18 -0.53 0.40 -1.24 -0.65 117.98 116.25 2win s PHE 1470Ca 0.26 -0.64 -0.12 0.00 -0.60 0.00 0.00 56.93 55.82 2win s PHE 1470Cb -0.07 -1.87 0.06 0.00 0.51 0.00 0.00 43.02 41.65 2win s PHE 1470CO 0.13 0.29 0.46 1.52 0.70 0.00 0.00 175.22 178.33 2win s TYR 1471N -2.66 -0.62 -0.06 0.36 -0.85 -1.15 -4.27 117.35 108.10 2win s TYR 1471Ca 0.37 1.37 -0.04 0.00 -0.52 0.00 0.00 57.07 58.24 2win s TYR 1471Cb 0.06 0.28 0.02 0.00 0.38 0.00 0.00 41.96 42.70 2win s TYR 1471CO 0.20 -0.33 0.14 -1.58 -1.52 0.00 0.00 175.55 172.46 2win s HIS 1472N 1.03 -0.16 0.45 -3.49 2.46 -1.26 -2.07 115.29 112.24 2win s HIS 1472Ca -0.06 0.42 0.32 0.00 0.47 0.00 0.00 55.06 56.20 2win s HIS 1472Cb -0.06 0.01 1.76 0.00 -0.13 0.00 0.00 32.58 34.15 2win s HIS 1472CO -0.09 -0.11 1.98 -1.35 -2.47 0.00 0.00 174.74 172.70 2win h PRO 1473N 6.35 0.00 0.00 2.88 0.11 -1.96 -3.34 132.00 136.03 2win h PRO 1473Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2win h PRO 1473Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2win h PRO 1473CO 0.42 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.60 2win n GLU 1474N -2.76 0.00 -1.15 1.05 1.02 -1.26 -5.09 120.64 112.45 2win n GLU 1474Ca -0.02 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.76 2win n GLU 1474Cb 0.20 -0.15 0.08 0.00 -0.02 0.00 0.00 31.44 31.55 2win n GLU 1474CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2win n LYS 1475N -2.83 0.17 0.00 3.49 5.02 -1.26 -4.91 118.16 117.85 2win n LYS 1475Ca 0.00 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2win n LYS 1475Cb 0.00 -1.83 0.00 0.00 -0.02 0.00 0.00 35.03 33.18 2win n LYS 1475CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2win n GLU 1476N -0.92 0.00 -2.77 1.97 4.07 -1.26 -4.19 120.64 117.54 2win n GLU 1476Ca 0.09 0.41 -0.02 0.00 -0.06 0.00 0.00 57.16 57.58 2win n GLU 1476Cb 0.51 -0.88 0.05 0.00 -0.06 0.00 0.00 31.44 31.05 2win n GLU 1476CO 0.00 0.00 0.00 -0.40 -0.06 0.00 0.00 177.13 176.67 2win n ASP 1477N -0.86 1.81 0.00 4.31 5.75 -1.26 -4.78 116.55 121.52 2win n ASP 1477Ca 0.00 -2.19 0.00 0.00 -0.01 0.00 0.00 54.79 52.59 2win n ASP 1477Cb 0.00 -0.47 0.00 0.00 -1.03 0.00 0.00 41.12 39.62 2win n ASP 1477CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2win n GLY 1478N -0.58 2.89 3.68 6.12 0.00 -1.26 -3.58 105.19 112.46 2win n GLY 1478Ca 0.10 -0.27 -0.48 0.00 0.00 0.00 0.00 46.02 45.37 2win n GLY 1478CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2win n LYS 1479N 0.00 2.20 -1.53 1.61 4.01 -1.26 -4.86 118.16 118.33 2win n LYS 1479Ca 0.00 0.81 -0.36 0.00 -0.51 0.00 0.00 58.31 58.25 2win n LYS 1479Cb 0.00 -2.64 0.09 0.00 -0.51 0.00 0.00 35.03 31.97 2win n LYS 1479CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 2win n LEU 1480N 6.01 5.54 -1.84 -0.35 4.77 -1.26 -4.56 117.00 125.31 2win n LEU 1480Ca 0.21 0.75 -0.09 0.00 -0.03 0.00 0.00 56.01 56.85 2win n LEU 1480Cb 0.30 -1.54 -0.06 0.00 -2.33 0.00 0.00 43.42 39.79 2win n LEU 1480CO 0.71 -1.22 1.31 0.59 -1.33 0.00 0.00 177.39 177.45 2win n ASN 1481N -2.33 5.60 -4.73 -1.43 3.02 -1.26 -4.94 115.26 109.18 2win n ASN 1481Ca 0.15 -2.62 -0.42 0.00 -0.03 0.00 0.00 54.58 51.67 2win n ASN 1481Cb 0.49 -1.23 -0.03 0.00 -0.61 0.00 0.00 39.78 38.40 2win n ASN 1481CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 2win s LYS 1482N -0.10 4.26 0.08 3.52 -2.85 -1.26 -4.51 119.74 118.87 2win s LYS 1482Ca 0.34 2.30 -0.30 0.00 -1.00 0.00 0.00 55.97 57.31 2win s LYS 1482Cb 0.19 -3.14 -0.05 0.00 -2.06 0.00 0.00 37.83 32.77 2win s LYS 1482CO -0.02 -0.48 1.02 -1.17 0.10 0.00 0.00 175.35 174.80 2win s LEU 1483N 0.25 4.43 0.05 2.77 2.96 -1.11 -4.87 118.68 123.17 2win s LEU 1483Ca 0.63 1.82 -0.12 0.00 -0.22 0.00 0.00 54.13 56.25 2win s LEU 1483Cb -0.42 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 42.70 2win s LEU 1483CO 0.38 -0.22 0.26 0.00 -1.32 0.00 0.00 176.35 175.46 2win s ARG 1485N -2.85 0.51 1.92 0.00 0.52 -1.08 -4.96 118.95 113.01 2win s ARG 1485Ca -0.03 0.59 0.00 0.00 -0.52 0.00 0.00 55.73 55.78 2win s ARG 1485Cb 0.00 0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.72 2win s ARG 1485CO -0.05 -0.06 0.00 -3.47 0.02 0.00 0.00 175.30 171.74 2win n ASP 1486N 2.83 0.00 0.00 0.23 2.03 -1.26 -1.40 116.55 118.99 2win n ASP 1486Ca -0.13 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.18 2win n ASP 1486Cb 0.57 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 2win n ASP 1486CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2win n GLU 1487N 0.00 2.14 -3.38 -0.67 -0.58 -1.26 -5.06 120.64 111.84 2win n GLU 1487Ca 0.00 0.00 -0.40 0.00 -0.42 0.00 0.00 57.16 56.34 2win n GLU 1487Cb 0.00 -0.18 -0.09 0.00 -0.57 0.00 0.00 31.44 30.60 2win n GLU 1487CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2win s LEU 1488N 0.00 4.19 0.53 -4.62 2.96 -0.49 -5.06 118.68 116.18 2win s LEU 1488Ca 0.00 0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.04 2win s LEU 1488Cb 0.00 -2.42 0.01 0.00 0.50 0.00 0.00 46.19 44.29 2win s LEU 1488CO 0.00 -0.26 0.22 0.00 -1.32 0.00 0.00 176.35 174.99 2win s ARG 1490N -4.10 0.59 -0.06 0.00 3.52 -0.16 -4.99 118.95 113.77 2win s ARG 1490Ca 0.21 1.16 -0.37 0.00 -0.13 0.00 0.00 55.73 56.60 2win s ARG 1490Cb -0.00 0.23 -0.15 0.00 -1.56 0.00 0.00 34.95 33.47 2win s ARG 1490CO 0.13 -0.17 1.63 0.00 -0.81 0.00 0.00 175.30 176.08 2win n ALA 1492N 4.51 0.67 0.00 0.00 0.00 -1.26 -4.83 120.51 119.60 2win n ALA 1492Ca 0.22 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 53.14 2win n ALA 1492Cb 0.21 -0.24 0.00 0.00 0.00 0.00 0.00 19.45 19.42 2win n ALA 1492CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2win n GLU 1493N -4.50 0.00 -3.68 0.00 -0.58 -1.26 -4.78 120.64 105.83 2win n GLU 1493Ca -0.22 0.00 -0.13 0.00 -0.42 0.00 0.00 57.16 56.40 2win n GLU 1493Cb 0.51 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 31.29 2win n GLU 1493CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2win s GLU 1494N 0.00 0.64 -0.63 3.49 2.02 -1.26 -4.92 118.70 118.04 2win s GLU 1494Ca 0.00 0.83 -0.27 0.00 0.02 0.00 0.00 54.97 55.55 2win s GLU 1494Cb 0.00 0.27 -0.11 0.00 0.10 0.00 0.00 34.13 34.39 2win s GLU 1494CO 0.00 -0.09 2.49 0.09 0.02 0.00 0.00 175.26 177.77 2win n ASN 1495N 3.08 1.77 0.00 -0.19 3.02 -1.26 -4.74 115.26 116.94 2win n ASN 1495Ca -0.15 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.05 2win n ASN 1495Cb 0.56 -1.41 0.00 0.00 -0.61 0.00 0.00 39.78 38.32 2win n ASN 1495CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2win s PHE 1497N -3.12 -0.41 0.00 0.00 -0.12 -1.26 -3.32 117.98 109.75 2win s PHE 1497Ca 0.00 0.93 0.00 0.00 -0.05 0.00 0.00 56.93 57.81 2win s PHE 1497Cb 0.00 0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.43 2win s PHE 1497CO 0.00 -0.30 0.00 0.44 -0.05 0.00 0.00 175.22 175.31 2win n ILE 1498N 4.73 0.00 -3.60 -4.49 -0.00 -0.37 -4.84 119.36 110.79 2win n ILE 1498Ca -0.17 0.00 -0.05 0.00 -0.00 0.00 0.00 62.75 62.54 2win n ILE 1498Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 39.64 40.13 2win n ILE 1498CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.55 174.97 2win s GLN 1499N 0.00 0.29 -0.22 6.28 -0.44 -1.26 -4.99 119.66 119.32 2win s GLN 1499Ca 0.00 -0.07 -0.01 0.00 -2.50 0.00 0.00 55.36 52.78 2win s GLN 1499Cb 0.00 0.13 0.01 0.00 -1.64 0.00 0.00 33.01 31.51 2win s GLN 1499CO 0.00 -0.12 0.03 1.63 0.50 0.00 0.00 175.29 177.33 2win n LYS 1500N 0.08 -2.91 -0.50 1.67 5.02 -1.26 -5.01 118.16 115.25 2win n LYS 1500Ca -0.00 2.42 0.05 0.00 -2.02 0.00 0.00 58.31 58.75 2win n LYS 1500Cb 0.58 -4.31 0.24 0.00 -0.02 0.00 0.00 35.03 31.52 2win n LYS 1500CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2win n SER 1501N 1.01 3.66 -0.05 4.39 3.41 -1.26 -4.70 113.62 120.08 2win n SER 1501Ca -0.05 -2.49 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 2win n SER 1501Cb 0.18 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.56 2win n SER 1501CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2win n ASP 1502N 0.43 0.00 0.13 4.04 8.00 -1.26 -4.95 116.55 122.94 2win n ASP 1502Ca 0.16 -0.68 -0.07 0.00 0.71 0.00 0.00 54.79 54.92 2win n ASP 1502Cb 0.76 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.83 2win n ASP 1502CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 2win h ASP 1503N 0.00 -0.46 -1.48 -2.24 3.58 -1.98 -3.43 116.42 110.41 2win h ASP 1503Ca 0.00 0.03 -0.07 0.00 0.42 0.00 0.00 57.03 57.41 2win h ASP 1503Cb 0.68 0.14 -0.26 0.00 1.72 0.00 0.00 39.33 41.61 2win h ASP 1503CO 0.00 -0.25 -0.42 -0.54 -2.88 0.00 0.00 179.24 175.14 2win s LYS 1504N -4.00 0.45 -0.06 0.28 1.02 -1.26 -5.14 119.74 111.03 2win s LYS 1504Ca -0.06 0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.49 2win s LYS 1504Cb 0.01 -0.05 0.02 0.00 -0.52 0.00 0.00 37.83 37.29 2win s LYS 1504CO 0.21 -0.80 -0.06 0.14 -0.92 0.00 0.00 175.35 173.92 2win s VAL 1505N 2.67 0.69 0.41 3.17 -7.23 -1.26 -5.01 120.40 113.83 2win s VAL 1505Ca 0.14 -0.17 0.02 0.00 -1.81 0.00 0.00 61.98 60.16 2win s VAL 1505Cb -0.14 -0.71 0.02 0.00 0.56 0.00 0.00 36.38 36.11 2win s VAL 1505CO -0.22 0.28 0.19 0.35 -0.31 0.00 0.00 175.10 175.39 2win n THR 1506N 4.32 0.00 0.15 5.32 -2.24 -1.26 -5.02 114.28 115.55 2win n THR 1506Ca -0.20 -1.73 0.00 0.00 -2.27 0.00 0.00 64.05 59.86 2win n THR 1506Cb 0.51 0.05 0.22 0.00 -2.10 0.00 0.00 70.33 69.01 2win n THR 1506CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2win h LEU 1507N 0.00 0.00 0.04 3.22 6.46 -1.98 -3.15 115.31 119.90 2win h LEU 1507Ca -0.29 0.00 -0.26 0.00 -0.12 0.00 0.00 57.88 57.22 2win h LEU 1507Cb 0.97 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.88 2win h LEU 1507CO 0.46 0.55 -1.31 -0.33 -0.62 0.00 0.00 178.44 177.19 2win h GLU 1508N 0.00 0.08 0.00 1.25 3.07 -1.99 -3.01 114.58 113.98 2win h GLU 1508Ca -0.01 -0.14 -0.04 0.00 -0.50 0.00 0.00 59.36 58.68 2win h GLU 1508Cb 1.01 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.96 2win h GLU 1508CO 0.07 0.92 -0.20 0.93 -1.40 0.00 0.00 179.01 179.33 2win h GLU 1509N 0.02 0.00 0.11 2.33 4.39 -1.95 -2.91 114.58 116.57 2win h GLU 1509Ca -0.14 0.00 -0.28 0.00 0.34 0.00 0.00 59.36 59.28 2win h GLU 1509Cb 1.90 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.55 2win h GLU 1509CO 0.13 0.20 -1.45 0.00 -1.16 0.00 0.00 179.01 176.74 2win h ARG 1510N 0.00 0.23 -0.03 2.33 3.08 -1.61 -3.16 114.38 115.22 2win h ARG 1510Ca -0.00 -0.40 0.01 0.00 0.07 0.00 0.00 59.98 59.66 2win h ARG 1510Cb 0.45 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 2win h ARG 1510CO 0.03 1.19 0.04 -0.07 -1.07 0.00 0.00 179.97 180.09 2win h LEU 1511N -0.31 0.00 0.12 3.04 3.38 -1.46 0.22 115.31 120.30 2win h LEU 1511Ca -0.31 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.35 2win h LEU 1511Cb 1.76 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.50 2win h LEU 1511CO 0.05 0.00 -1.60 0.44 0.09 0.00 0.00 178.44 177.42 2win h ASP 1512N 0.00 0.40 0.75 -0.43 3.32 -1.64 -3.27 116.42 115.54 2win h ASP 1512Ca 0.01 -0.86 0.00 0.00 0.02 0.00 0.00 57.03 56.20 2win h ASP 1512Cb 0.10 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.52 2win h ASP 1512CO -0.00 1.70 -0.03 0.29 -1.72 0.00 0.00 179.24 179.48 2win n LYS 1513N -3.80 0.23 -0.20 3.56 5.02 -0.94 -2.91 118.16 119.12 2win n LYS 1513Ca -0.27 -0.02 0.09 0.00 -2.02 0.00 0.00 58.31 56.09 2win n LYS 1513Cb 0.95 -1.50 0.20 0.00 -0.02 0.00 0.00 35.03 34.66 2win n LYS 1513CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2win n ALA 1514N -1.37 2.33 -1.13 7.82 0.00 0.72 -4.22 120.51 124.67 2win n ALA 1514Ca 0.11 -1.07 0.04 0.00 0.00 0.00 0.00 53.44 52.51 2win n ALA 1514Cb 0.29 -0.67 0.05 0.00 0.00 0.00 0.00 19.45 19.12 2win n ALA 1514CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2win s GLU 1516N -1.23 0.65 0.00 0.00 2.02 -1.20 -4.95 118.70 113.99 2win s GLU 1516Ca 0.12 0.43 -0.01 0.00 0.02 0.00 0.00 54.97 55.52 2win s GLU 1516Cb 0.10 -1.77 -0.00 0.00 0.10 0.00 0.00 34.13 32.56 2win s GLU 1516CO 0.01 -2.56 1.02 -1.35 0.02 0.00 0.00 175.26 172.40 2win h PRO 1517N -1.77 -0.02 0.00 0.39 0.11 -1.96 -2.75 132.00 126.01 2win h PRO 1517Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2win h PRO 1517Cb 1.33 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 2win h PRO 1517CO 0.59 -0.01 0.15 0.78 -0.21 0.00 0.00 178.00 179.30 2win h GLY 1518N -0.02 0.00 -6.75 -0.55 0.00 -1.94 -3.43 103.07 90.38 2win h GLY 1518Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 2win h GLY 1518CO -0.01 0.00 1.30 -0.62 0.00 0.00 0.00 176.54 177.21 2win n VAL 1519N -2.99 0.24 -0.01 4.60 0.31 -1.04 -3.65 118.33 115.79 2win n VAL 1519Ca -0.03 -0.20 -0.03 0.00 -0.01 0.00 0.00 64.34 64.08 2win n VAL 1519Cb 0.21 -1.57 -0.01 0.00 -0.91 0.00 0.00 33.84 31.56 2win n VAL 1519CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2win n ASP 1520N 8.71 0.58 -4.22 4.52 -0.08 -0.91 -4.92 116.55 120.23 2win n ASP 1520Ca 0.37 0.03 -0.25 0.00 -1.51 0.00 0.00 54.79 53.43 2win n ASP 1520Cb 0.21 -0.07 -0.15 0.00 2.34 0.00 0.00 41.12 43.45 2win n ASP 1520CO 0.00 0.00 0.00 -0.72 0.12 0.00 0.00 177.20 176.60 2win s TYR 1521N -2.05 1.73 -0.12 -0.67 -0.85 -1.25 -3.61 117.35 110.52 2win s TYR 1521Ca -0.04 -0.35 -0.04 0.00 -0.52 0.00 0.00 57.07 56.13 2win s TYR 1521Cb 0.01 -1.06 0.06 0.00 0.38 0.00 0.00 41.96 41.35 2win s TYR 1521CO 0.05 0.04 0.13 0.08 -1.52 0.00 0.00 175.55 174.32 2win s VAL 1522N -0.66 -0.18 0.10 -3.49 1.01 -1.07 -3.41 120.40 112.70 2win s VAL 1522Ca 0.07 0.13 0.04 0.00 0.00 0.00 0.00 61.98 62.22 2win s VAL 1522Cb -0.08 -0.41 -0.04 0.00 0.00 0.00 0.00 36.38 35.85 2win s VAL 1522CO 0.01 -0.04 -0.10 -0.31 0.00 0.00 0.00 175.10 174.66 2win s TYR 1523N 2.22 1.07 -0.68 5.22 2.02 -0.97 -1.23 117.35 125.00 2win s TYR 1523Ca 0.04 -0.68 -0.07 0.00 -0.37 0.00 0.00 57.07 55.98 2win s TYR 1523Cb -0.14 -0.58 0.18 0.00 -0.40 0.00 0.00 41.96 41.02 2win s TYR 1523CO -0.07 0.00 0.55 0.21 -1.57 0.00 0.00 175.55 174.67 2win s LYS 1524N -2.97 2.92 0.32 -0.62 2.20 -1.12 -2.52 119.74 117.95 2win s LYS 1524Ca 0.07 -2.45 0.06 0.00 -0.36 0.00 0.00 55.97 53.29 2win s LYS 1524Cb -0.02 -3.99 -0.01 0.00 -1.51 0.00 0.00 37.83 32.30 2win s LYS 1524CO -0.00 -1.22 0.45 0.95 -0.36 0.00 0.00 175.35 175.17 2win s THR 1525N 0.12 4.29 -0.15 3.43 -4.23 -0.87 -1.78 115.64 116.44 2win s THR 1525Ca 0.16 -0.99 -0.00 0.00 -1.18 0.00 0.00 61.69 59.68 2win s THR 1525Cb -0.17 -3.49 0.03 0.00 1.34 0.00 0.00 72.50 70.21 2win s THR 1525CO -0.05 -0.19 -0.09 -0.60 -0.54 0.00 0.00 174.62 173.15 2win s ARG 1526N -4.14 1.81 -0.06 3.99 3.52 -0.04 -1.31 118.95 122.72 2win s ARG 1526Ca 0.43 -0.51 -0.30 0.00 -0.13 0.00 0.00 55.73 55.23 2win s ARG 1526Cb -0.09 -1.98 -0.06 0.00 -1.56 0.00 0.00 34.95 31.26 2win s ARG 1526CO 0.31 -0.33 1.71 -1.17 -0.81 0.00 0.00 175.30 175.01 2win s LEU 1527N 1.57 4.27 -0.25 -0.88 2.96 -0.94 -1.40 118.68 124.01 2win s LEU 1527Ca 0.03 2.23 -0.17 0.00 -0.22 0.00 0.00 54.13 56.00 2win s LEU 1527Cb -0.14 -3.53 -0.15 0.00 0.50 0.00 0.00 46.19 42.87 2win s LEU 1527CO -0.09 -1.00 -0.13 0.52 -1.32 0.00 0.00 176.35 174.33 2win n VAL 1528N 5.64 1.53 -4.36 1.68 0.31 -0.46 -0.05 118.33 122.62 2win n VAL 1528Ca 0.18 -0.25 -0.19 0.00 -0.01 0.00 0.00 64.34 64.07 2win n VAL 1528Cb 0.43 -1.94 -0.14 0.00 -0.91 0.00 0.00 33.84 31.28 2win n VAL 1528CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2win s LYS 1529N -2.45 0.87 -0.28 5.55 2.20 -1.09 -4.70 119.74 119.84 2win s LYS 1529Ca -0.35 -0.64 0.01 0.00 -0.36 0.00 0.00 55.97 54.63 2win s LYS 1529Cb 0.11 -0.85 0.08 0.00 -1.51 0.00 0.00 37.83 35.67 2win s LYS 1529CO 0.53 0.21 0.01 0.08 -0.36 0.00 0.00 175.35 175.83 2win s VAL 1530N -0.71 1.58 0.20 4.02 1.01 -1.26 -1.56 120.40 123.68 2win s VAL 1530Ca 0.01 -1.58 0.05 0.00 0.00 0.00 0.00 61.98 60.47 2win s VAL 1530Cb -0.07 -2.01 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 2win s VAL 1530CO 0.01 -0.38 0.23 -1.10 0.00 0.00 0.00 175.10 173.85 2win s GLN 1531N 1.31 3.12 -0.16 2.72 -0.21 -1.21 -5.05 119.66 120.18 2win s GLN 1531Ca 0.03 -0.85 -0.07 0.00 0.02 0.00 0.00 55.36 54.49 2win s GLN 1531Cb -0.19 -2.73 0.07 0.00 1.00 0.00 0.00 33.01 31.16 2win s GLN 1531CO -0.11 0.46 0.35 -1.17 -2.12 0.00 0.00 175.29 172.70 2win s LEU 1532N -3.51 -0.20 0.00 2.90 0.20 -1.26 -2.40 118.68 114.41 2win s LEU 1532Ca 0.33 0.79 0.04 0.00 0.69 0.00 0.00 54.13 55.98 2win s LEU 1532Cb -0.09 1.11 0.04 0.00 -0.43 0.00 0.00 46.19 46.81 2win s LEU 1532CO 0.26 -0.21 0.35 -1.20 -0.29 0.00 0.00 176.35 175.26 2win n SER 1533N 4.79 2.74 -0.14 3.68 7.64 -0.79 -5.00 113.62 126.54 2win n SER 1533Ca -0.16 -2.83 0.14 0.00 1.01 0.00 0.00 58.87 57.03 2win n SER 1533Cb 0.52 0.00 0.55 0.00 -1.01 0.00 0.00 64.21 64.27 2win n SER 1533CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2win n ASN 1534N -1.78 0.58 0.00 6.43 5.15 -1.26 -3.88 115.26 120.49 2win n ASN 1534Ca -0.04 -0.60 0.00 0.00 -0.60 0.00 0.00 54.58 53.34 2win n ASN 1534Cb 0.59 -0.03 0.00 0.00 -0.53 0.00 0.00 39.78 39.81 2win n ASN 1534CO 0.00 0.00 0.00 -0.90 1.40 0.00 0.00 177.26 177.76 2win n ASP 1535N -0.92 0.40 0.00 1.20 5.68 -1.26 -5.03 116.55 116.61 2win n ASP 1535Ca 0.13 -0.75 0.00 0.00 -0.50 0.00 0.00 54.79 53.68 2win n ASP 1535Cb 0.30 0.23 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 2win n ASP 1535CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 2win n PHE 1536N -0.23 0.00 -3.20 2.11 -0.00 -1.25 -4.55 117.46 110.33 2win n PHE 1536Ca 0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.45 57.25 2win n PHE 1536Cb 0.06 0.00 0.04 0.00 -0.00 0.00 0.00 39.48 39.58 2win n PHE 1536CO 0.00 0.00 0.00 0.16 -0.00 0.00 0.00 176.76 176.92 2win s ASP 1537N 0.00 5.09 0.21 5.98 1.47 -0.27 -1.89 116.67 127.26 2win s ASP 1537Ca 0.00 -0.86 -0.22 0.00 1.18 0.00 0.00 52.55 52.66 2win s ASP 1537Cb 0.00 0.16 0.05 0.00 -0.34 0.00 0.00 42.92 42.78 2win s ASP 1537CO 0.00 -1.20 0.64 -1.83 0.68 0.00 0.00 175.17 173.46 2win s GLU 1538N -4.53 1.49 -0.15 2.11 -1.05 -1.01 -2.25 118.70 113.31 2win s GLU 1538Ca 0.56 -0.72 -0.04 0.00 -0.15 0.00 0.00 54.97 54.62 2win s GLU 1538Cb -0.06 0.59 0.07 0.00 -0.44 0.00 0.00 34.13 34.30 2win s GLU 1538CO 0.35 -0.67 0.18 0.71 0.95 0.00 0.00 175.26 176.79 2win s TYR 1539N -3.83 -0.19 -0.88 4.83 2.02 0.18 -3.33 117.35 116.15 2win s TYR 1539Ca 0.06 0.33 -0.22 0.00 -0.37 0.00 0.00 57.07 56.86 2win s TYR 1539Cb -0.03 -0.35 0.07 0.00 -0.40 0.00 0.00 41.96 41.25 2win s TYR 1539CO -0.04 -0.46 1.25 0.42 -1.57 0.00 0.00 175.55 175.15 2win s ILE 1540N 2.29 4.17 -0.08 2.71 1.01 -0.60 -1.55 121.20 129.16 2win s ILE 1540Ca 0.05 -0.71 -0.02 0.00 0.00 0.00 0.00 60.65 59.96 2win s ILE 1540Cb -0.14 -4.90 -0.03 0.00 0.01 0.00 0.00 42.46 37.40 2win s ILE 1540CO -0.09 -1.73 0.03 -0.04 0.00 0.00 0.00 174.94 173.11 2win s MET 1541N 4.33 3.05 -0.20 2.79 -1.94 -1.22 -1.36 119.30 124.76 2win s MET 1541Ca 0.36 -0.38 -0.09 0.00 -1.71 0.00 0.00 55.69 53.87 2win s MET 1541Cb -0.06 -2.85 -0.05 0.00 2.01 0.00 0.00 34.83 33.88 2win s MET 1541CO -0.02 0.71 0.11 0.00 -0.01 0.00 0.00 175.02 175.80 2win s ALA 1542N -0.95 3.56 -0.10 3.03 0.00 -0.50 -1.88 121.76 124.92 2win s ALA 1542Ca 0.15 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 51.06 2win s ALA 1542Cb -0.11 -2.09 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 2win s ALA 1542CO 0.04 0.10 1.25 0.42 0.00 0.00 0.00 175.76 177.58 2win s ILE 1543N 0.49 4.21 -0.64 0.00 1.01 -1.02 -0.86 121.20 124.39 2win s ILE 1543Ca 0.06 1.51 0.23 0.00 0.00 0.00 0.00 60.65 62.45 2win s ILE 1543Cb -0.12 -3.97 -0.09 0.00 0.01 0.00 0.00 42.46 38.28 2win s ILE 1543CO -0.00 -0.06 1.07 -0.62 0.00 0.00 0.00 174.94 175.32 2win n GLU 1544N 5.90 0.27 -3.63 2.79 1.02 -0.73 -0.74 120.64 125.52 2win n GLU 1544Ca 0.13 0.01 -0.08 0.00 -0.02 0.00 0.00 57.16 57.19 2win n GLU 1544Cb 0.45 -1.60 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 2win n GLU 1544CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2win s GLN 1545N -3.18 0.44 -0.81 3.49 -2.07 -1.25 -4.85 119.66 111.44 2win s GLN 1545Ca 0.04 0.40 -0.14 0.00 -1.82 0.00 0.00 55.36 53.84 2win s GLN 1545Cb 0.14 0.21 0.21 0.00 -1.09 0.00 0.00 33.01 32.49 2win s GLN 1545CO 0.79 -0.08 0.75 0.95 -1.32 0.00 0.00 175.29 176.38 2win s THR 1546N -0.14 5.58 0.27 3.63 -4.23 -1.26 -2.79 115.64 116.70 2win s THR 1546Ca 0.03 -2.40 -0.04 0.00 -1.18 0.00 0.00 61.69 58.10 2win s THR 1546Cb -0.04 -4.46 0.26 0.00 1.34 0.00 0.00 72.50 69.61 2win s THR 1546CO -0.06 -1.02 1.94 0.40 -0.54 0.00 0.00 174.62 175.34 2win h ILE 1547N 4.86 1.21 -2.12 2.99 2.04 -1.54 -3.40 117.51 121.55 2win h ILE 1547Ca 0.08 -0.42 -0.23 0.00 1.00 0.00 0.00 64.86 65.29 2win h ILE 1547Cb 1.04 -0.12 -0.32 0.00 -0.74 0.00 0.00 36.82 36.68 2win h ILE 1547CO 0.77 0.22 -0.55 -0.75 0.00 0.00 0.00 178.15 177.85 2win s LYS 1548N -6.02 0.30 0.25 2.37 2.20 -0.90 -4.60 119.74 113.33 2win s LYS 1548Ca -0.12 0.32 -0.30 0.00 -0.36 0.00 0.00 55.97 55.51 2win s LYS 1548Cb 0.18 -0.74 -0.09 0.00 -1.51 0.00 0.00 37.83 35.67 2win s LYS 1548CO 0.81 -0.71 1.30 -1.12 -0.36 0.00 0.00 175.35 175.26 2win s SER 1549N 2.45 6.89 0.00 1.43 0.01 -1.26 -2.61 113.70 120.61 2win s SER 1549Ca 0.10 2.48 0.00 0.00 1.31 0.00 0.00 55.95 59.85 2win s SER 1549Cb -0.15 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.45 2win s SER 1549CO -0.17 -0.50 0.00 0.61 0.41 0.00 0.00 173.24 173.59 2win n GLY 1550N 1.80 3.61 0.00 3.44 0.00 -1.24 -4.86 105.19 107.94 2win n GLY 1550Ca 0.04 -1.71 0.13 0.00 0.00 0.00 0.00 46.02 44.47 2win n GLY 1550CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2win n SER 1551N 0.00 0.00 -4.45 1.61 7.64 -1.26 -4.64 113.62 112.52 2win n SER 1551Ca 0.00 0.35 -0.42 0.00 1.01 0.00 0.00 58.87 59.80 2win n SER 1551Cb 0.00 -0.45 -0.10 0.00 -1.01 0.00 0.00 64.21 62.65 2win n SER 1551CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2win s ASP 1552N -2.89 6.01 -0.83 6.43 2.15 -1.26 -5.02 116.67 121.25 2win s ASP 1552Ca 0.16 -0.87 -0.25 0.00 0.43 0.00 0.00 52.55 52.02 2win s ASP 1552Cb 0.18 -2.12 -0.01 0.00 -0.30 0.00 0.00 42.92 40.67 2win s ASP 1552CO 0.47 -0.41 1.71 -1.61 -0.17 0.00 0.00 175.17 175.16 2win s GLU 1553N 1.65 2.90 -0.09 4.34 0.41 -1.26 -4.94 118.70 121.72 2win s GLU 1553Ca 0.04 -0.25 0.02 0.00 -0.41 0.00 0.00 54.97 54.37 2win s GLU 1553Cb -0.19 -4.84 0.01 0.00 -1.78 0.00 0.00 34.13 27.34 2win s GLU 1553CO 0.09 -2.77 -0.13 0.54 -0.49 0.00 0.00 175.26 172.50 2win s VAL 1554N 8.02 1.26 0.51 2.63 0.11 -1.26 -5.14 120.40 126.52 2win s VAL 1554Ca 0.59 -0.52 -0.07 0.00 -2.93 0.00 0.00 61.98 59.05 2win s VAL 1554Cb -0.07 -1.16 -0.04 0.00 -1.53 0.00 0.00 36.38 33.58 2win s VAL 1554CO 0.05 0.39 0.84 -1.10 -3.33 0.00 0.00 175.10 171.95 2win s GLN 1555N 0.90 3.58 -0.09 1.54 1.11 -1.26 -4.97 119.66 120.47 2win s GLN 1555Ca -0.10 0.35 -0.29 0.00 0.01 0.00 0.00 55.36 55.33 2win s GLN 1555Cb -0.15 -2.31 -0.05 0.00 -1.01 0.00 0.00 33.01 29.49 2win s GLN 1555CO 0.01 -0.28 1.73 0.08 0.01 0.00 0.00 175.29 176.84 2win s VAL 1556N -2.81 3.48 0.00 1.09 1.01 -1.26 -2.94 120.40 118.97 2win s VAL 1556Ca 0.50 0.57 0.00 0.00 0.00 0.00 0.00 61.98 63.05 2win s VAL 1556Cb -0.10 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.86 2win s VAL 1556CO 0.46 -0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.07 2win n GLY 1557N 4.43 2.47 3.64 4.51 0.00 0.08 -5.01 105.19 115.31 2win n GLY 1557Ca 0.19 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 2win n GLY 1557CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2win s GLN 1558N 0.00 0.68 -0.16 1.61 -0.21 -1.15 -4.60 119.66 115.83 2win s GLN 1558Ca 0.00 1.16 -0.03 0.00 0.02 0.00 0.00 55.36 56.51 2win s GLN 1558Cb 0.00 -1.72 -0.02 0.00 1.00 0.00 0.00 33.01 32.27 2win s GLN 1558CO 0.00 -2.74 -0.07 -0.65 -2.12 0.00 0.00 175.29 169.71 2win s GLN 1559N -4.69 3.52 -0.17 2.91 -0.21 -1.26 -2.45 119.66 117.31 2win s GLN 1559Ca 0.66 -0.60 -0.02 0.00 0.02 0.00 0.00 55.36 55.42 2win s GLN 1559Cb -0.22 -2.84 -0.01 0.00 1.00 0.00 0.00 33.01 30.94 2win s GLN 1559CO 0.59 0.14 -0.09 1.03 -2.12 0.00 0.00 175.29 174.84 2win s ARG 1560N 0.59 3.38 0.10 2.91 1.81 -0.79 -4.98 118.95 121.97 2win s ARG 1560Ca -0.04 -0.66 -0.30 0.00 -1.72 0.00 0.00 55.73 53.01 2win s ARG 1560Cb -0.15 -2.80 -0.06 0.00 -0.45 0.00 0.00 34.95 31.49 2win s ARG 1560CO 0.03 0.02 1.10 0.99 -0.68 0.00 0.00 175.30 176.76 2win s THR 1561N 0.86 4.17 0.01 0.02 2.01 -1.26 -3.41 115.64 118.05 2win s THR 1561Ca -0.03 1.68 0.04 0.00 0.31 0.00 0.00 61.69 63.69 2win s THR 1561Cb -0.15 -4.07 -0.03 0.00 0.01 0.00 0.00 72.50 68.25 2win s THR 1561CO 0.01 0.20 -0.07 -0.36 -0.69 0.00 0.00 174.62 173.70 2win s PHE 1562N 0.50 2.87 -0.01 4.92 0.40 -0.59 -0.32 117.98 125.75 2win s PHE 1562Ca 0.53 -0.05 0.04 0.00 -0.60 0.00 0.00 56.93 56.85 2win s PHE 1562Cb -0.27 -1.59 -0.01 0.00 0.51 0.00 0.00 43.02 41.65 2win s PHE 1562CO 0.31 0.37 -0.13 0.42 0.70 0.00 0.00 175.22 176.89 2win s ILE 1563N -1.01 1.06 -0.01 0.64 1.01 -0.22 -0.65 121.20 122.03 2win s ILE 1563Ca 0.17 -0.58 -0.13 0.00 0.00 0.00 0.00 60.65 60.11 2win s ILE 1563Cb -0.11 -0.89 0.02 0.00 0.01 0.00 0.00 42.46 41.49 2win s ILE 1563CO 0.08 0.29 0.26 -0.55 0.00 0.00 0.00 174.94 175.02 2win s SER 1564N -0.33 -0.13 0.90 3.58 0.15 -0.95 -0.88 113.70 116.03 2win s SER 1564Ca 0.05 -0.00 -0.12 0.00 0.70 0.00 0.00 55.95 56.58 2win s SER 1564Cb -0.05 0.28 0.10 0.00 -1.71 0.00 0.00 66.02 64.63 2win s SER 1564CO -0.00 -0.43 0.93 -2.65 1.20 0.00 0.00 173.24 172.29 2win n PRO 1565N 1.32 -0.26 0.16 5.44 -0.02 -1.26 -1.11 135.00 139.26 2win n PRO 1565Ca -0.22 -0.01 0.13 0.00 -2.02 0.00 0.00 63.50 61.38 2win n PRO 1565Cb 0.56 -2.22 0.50 0.00 -0.02 0.00 0.00 33.50 32.32 2win n PRO 1565CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 2win h ILE 1566N -1.55 0.00 -0.00 4.25 2.10 -1.89 -2.77 117.51 117.64 2win h ILE 1566Ca -0.44 -0.35 0.00 0.00 1.08 0.00 0.00 64.86 65.15 2win h ILE 1566Cb 1.28 1.18 0.00 0.00 -1.09 0.00 0.00 36.82 38.19 2win h ILE 1566CO 0.40 0.00 -0.32 0.29 -1.08 0.00 0.00 178.15 177.44 2win n LYS 1567N -2.42 0.21 -0.76 2.19 5.02 -1.26 -3.55 118.16 117.59 2win n LYS 1567Ca 0.02 -0.10 0.05 0.00 -2.02 0.00 0.00 58.31 56.26 2win n LYS 1567Cb 0.29 -1.50 0.33 0.00 -0.02 0.00 0.00 35.03 34.13 2win n LYS 1567CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2win h ARG 1569N 3.22 0.00 0.00 0.00 3.08 -1.74 -2.29 114.38 116.65 2win h ARG 1569Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 2win h ARG 1569Cb 1.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.82 2win h ARG 1569CO 0.43 0.00 -0.98 -1.91 -1.07 0.00 0.00 179.97 176.45 2win n GLU 1570N -2.30 0.06 0.00 0.04 2.13 -1.26 -4.37 120.64 114.94 2win n GLU 1570Ca 0.03 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.84 2win n GLU 1570Cb 0.28 -1.51 0.00 0.00 0.27 0.00 0.00 31.44 30.48 2win n GLU 1570CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2win n ALA 1571N -1.57 0.00 -3.97 4.31 0.00 -0.86 -4.69 120.51 113.73 2win n ALA 1571Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.17 2win n ALA 1571Cb 0.35 0.01 -0.15 0.00 0.00 0.00 0.00 19.45 19.66 2win n ALA 1571CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2win s LEU 1572N -0.46 3.64 -0.99 0.00 2.01 -1.26 -5.04 118.68 116.58 2win s LEU 1572Ca 0.00 -1.71 -0.26 0.00 0.01 0.00 0.00 54.13 52.18 2win s LEU 1572Cb 0.00 -1.40 -0.16 0.00 0.01 0.00 0.00 46.19 44.64 2win s LEU 1572CO 0.00 -0.31 2.16 -0.54 1.01 0.00 0.00 176.35 178.67 2win s LYS 1573N 1.16 1.65 -0.81 1.70 1.02 -1.26 -4.85 119.74 118.34 2win s LYS 1573Ca 0.03 -0.24 -0.25 0.00 0.02 0.00 0.00 55.97 55.53 2win s LYS 1573Cb -0.19 -4.97 -0.06 0.00 -0.52 0.00 0.00 37.83 32.10 2win s LYS 1573CO -0.09 -4.72 2.02 -0.51 -0.92 0.00 0.00 175.35 171.13 2win s LEU 1574N 14.70 3.15 1.13 3.17 1.43 -1.26 -4.95 118.68 136.05 2win s LEU 1574Ca 0.82 -0.30 -0.17 0.00 -1.03 0.00 0.00 54.13 53.44 2win s LEU 1574Cb -0.07 -2.55 0.25 0.00 0.03 0.00 0.00 46.19 43.85 2win s LEU 1574CO 0.12 -2.86 1.11 -0.70 0.23 0.00 0.00 176.35 174.25 2win s GLU 1575N 7.36 -0.60 0.06 1.70 2.12 -1.26 -4.99 118.70 123.09 2win s GLU 1575Ca 0.74 0.10 -0.11 0.00 0.36 0.00 0.00 54.97 56.06 2win s GLU 1575Cb -0.09 -1.65 -0.06 0.00 0.26 0.00 0.00 34.13 32.59 2win s GLU 1575CO 0.06 -3.33 0.40 -1.21 -0.54 0.00 0.00 175.26 170.64 2win s GLU 1576N -5.29 3.81 -1.20 4.30 2.02 -1.26 -4.21 118.70 116.87 2win s GLU 1576Ca 0.69 0.25 0.00 0.00 0.02 0.00 0.00 54.97 55.93 2win s GLU 1576Cb -0.12 -3.06 0.00 0.00 0.10 0.00 0.00 34.13 31.05 2win s GLU 1576CO 0.56 0.60 0.00 1.63 0.02 0.00 0.00 175.26 178.07 2win n LYS 1577N 1.17 -1.00 -4.30 1.61 4.76 0.92 -5.01 118.16 116.33 2win n LYS 1577Ca -0.10 0.73 -0.30 0.00 -2.87 0.00 0.00 58.31 55.78 2win n LYS 1577Cb 0.52 -4.90 -0.10 0.00 -1.84 0.00 0.00 35.03 28.71 2win n LYS 1577CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2win s LYS 1578N -4.16 2.13 0.19 1.97 1.02 -1.26 -4.92 119.74 114.71 2win s LYS 1578Ca 0.00 -1.01 -0.08 0.00 0.02 0.00 0.00 55.97 54.90 2win s LYS 1578Cb 0.00 -2.29 -0.07 0.00 -0.52 0.00 0.00 37.83 34.95 2win s LYS 1578CO 0.00 0.52 0.48 -1.01 -0.92 0.00 0.00 175.35 174.42 2win s HIS 1579N -1.16 3.45 -0.11 3.18 3.76 -1.26 -2.22 115.29 120.93 2win s HIS 1579Ca 0.20 0.76 -0.10 0.00 -0.15 0.00 0.00 55.06 55.76 2win s HIS 1579Cb -0.11 -2.16 0.03 0.00 1.11 0.00 0.00 32.58 31.45 2win s HIS 1579CO 0.12 0.34 0.30 0.71 -0.85 0.00 0.00 174.74 175.36 2win s TYR 1580N -1.74 -0.33 -0.25 1.40 2.02 -0.43 -0.83 117.35 117.19 2win s TYR 1580Ca 0.44 0.81 -0.14 0.00 -0.37 0.00 0.00 57.07 57.81 2win s TYR 1580Cb -0.12 0.11 -0.04 0.00 -0.40 0.00 0.00 41.96 41.52 2win s TYR 1580CO 0.22 -0.16 0.34 -1.17 -1.57 0.00 0.00 175.55 173.21 2win s LEU 1581N 0.19 4.07 0.03 -1.29 2.96 -0.64 -2.05 118.68 121.94 2win s LEU 1581Ca -0.00 0.29 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 2win s LEU 1581Cb -0.02 -2.38 -0.02 0.00 0.50 0.00 0.00 46.19 44.26 2win s LEU 1581CO 0.00 -0.12 -0.06 -0.04 -1.32 0.00 0.00 176.35 174.81 2win s MET 1582N 1.76 0.46 -0.22 1.98 -1.94 -1.05 -2.33 119.30 117.96 2win s MET 1582Ca 0.14 -0.67 -0.21 0.00 -1.71 0.00 0.00 55.69 53.24 2win s MET 1582Cb -0.15 -0.21 0.06 0.00 2.01 0.00 0.00 34.83 36.53 2win s MET 1582CO 0.09 0.03 0.59 1.67 -0.01 0.00 0.00 175.02 177.40 2win s TRP 1583N -1.28 -0.65 0.00 -0.03 -2.14 -1.16 -2.30 118.94 111.38 2win s TRP 1583Ca -0.10 1.58 0.00 0.00 2.66 0.00 0.00 56.10 60.24 2win s TRP 1583Cb -0.09 0.23 0.00 0.00 -3.10 0.00 0.00 33.47 30.50 2win s TRP 1583CO 0.00 -0.32 0.00 0.41 -2.66 0.00 0.00 176.95 174.38 2win n GLY 1584N 2.72 4.26 3.99 3.67 0.00 -1.22 -0.82 105.19 117.78 2win n GLY 1584Ca -0.14 -1.45 -0.19 0.00 0.00 0.00 0.00 46.02 44.24 2win n GLY 1584CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2win s LEU 1585N 0.00 3.86 0.30 0.99 1.43 -1.26 -2.15 118.68 121.85 2win s LEU 1585Ca 0.00 -0.15 0.26 0.00 -1.03 0.00 0.00 54.13 53.21 2win s LEU 1585Cb 0.00 -2.80 0.86 0.00 0.03 0.00 0.00 46.19 44.28 2win s LEU 1585CO 0.00 -0.54 1.76 0.77 0.23 0.00 0.00 176.35 178.57 2win h SER 1586N 0.77 0.00 0.00 2.29 4.64 -1.94 -2.82 113.55 116.48 2win h SER 1586Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2win h SER 1586Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2win h SER 1586CO 0.52 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 174.94 2win n SER 1587N -2.47 0.00 -0.71 4.97 3.41 -1.26 -2.89 113.62 114.67 2win n SER 1587Ca 0.04 -1.11 0.12 0.00 -0.26 0.00 0.00 58.87 57.65 2win n SER 1587Cb 0.37 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.37 2win n SER 1587CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2win n ASP 1588N -0.90 2.47 -4.76 4.04 8.00 -1.07 -4.96 116.55 119.37 2win n ASP 1588Ca 0.18 -1.74 -0.36 0.00 0.71 0.00 0.00 54.79 53.58 2win n ASP 1588Cb 0.08 0.25 0.02 0.00 -0.02 0.00 0.00 41.12 41.45 2win n ASP 1588CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2win s PHE 1589N -2.25 2.49 -0.09 1.24 0.08 -1.14 -2.18 117.98 116.12 2win s PHE 1589Ca 0.23 1.51 -0.03 0.00 0.12 0.00 0.00 56.93 58.76 2win s PHE 1589Cb 0.19 -3.45 0.05 0.00 -0.57 0.00 0.00 43.02 39.23 2win s PHE 1589CO 0.44 -2.06 0.12 -0.46 -0.10 0.00 0.00 175.22 173.17 2win s TRP 1590N -1.60 -0.05 0.00 0.36 -0.00 0.99 -4.94 118.94 113.69 2win s TRP 1590Ca 0.75 0.32 0.00 0.00 -0.00 0.00 0.00 56.10 57.17 2win s TRP 1590Cb -0.29 -0.41 0.00 0.00 -0.00 0.00 0.00 33.47 32.77 2win s TRP 1590CO 0.33 -0.31 0.00 0.41 -0.00 0.00 0.00 176.95 177.38 2win n GLY 1591N 5.31 -0.91 3.19 5.86 0.00 -1.26 0.05 105.19 117.43 2win n GLY 1591Ca -0.04 -2.13 -0.26 0.00 0.00 0.00 0.00 46.02 43.58 2win n GLY 1591CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2win s GLU 1592N 0.00 1.65 0.58 1.61 0.41 -1.17 -4.90 118.70 116.88 2win s GLU 1592Ca 0.00 -0.70 -0.20 0.00 -0.41 0.00 0.00 54.97 53.66 2win s GLU 1592Cb 0.00 -1.56 -0.04 0.00 -1.78 0.00 0.00 34.13 30.74 2win s GLU 1592CO 0.00 0.40 1.22 1.63 -0.49 0.00 0.00 175.26 178.02 2win n LYS 1593N 2.69 1.34 0.00 1.61 5.02 -1.26 -0.95 118.16 126.61 2win n LYS 1593Ca -0.16 0.50 0.14 0.00 -2.02 0.00 0.00 58.31 56.78 2win n LYS 1593Cb 0.53 -2.43 0.66 0.00 -0.02 0.00 0.00 35.03 33.77 2win n LYS 1593CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2win n PRO 1594N -1.15 0.23 -2.11 1.97 -0.02 -1.26 -4.94 135.00 127.71 2win n PRO 1594Ca 0.12 -0.02 -0.42 0.00 -2.02 0.00 0.00 63.50 61.16 2win n PRO 1594Cb 0.46 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.44 2win n PRO 1594CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2win n ASN 1595N -1.37 4.35 -5.00 2.55 3.02 -0.12 -4.94 115.26 113.74 2win n ASN 1595Ca 0.10 -2.88 -0.19 0.00 -0.03 0.00 0.00 54.58 51.58 2win n ASN 1595Cb 0.30 -1.70 0.06 0.00 -0.61 0.00 0.00 39.78 37.82 2win n ASN 1595CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2win s LEU 1596N 3.07 3.20 -0.21 3.41 1.43 -1.25 -3.05 118.68 125.28 2win s LEU 1596Ca 0.50 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.76 2win s LEU 1596Cb 0.10 -1.88 0.07 0.00 0.03 0.00 0.00 46.19 44.51 2win s LEU 1596CO -0.01 -1.27 0.52 -0.44 0.23 0.00 0.00 176.35 175.37 2win s SER 1597N -4.61 -0.68 0.48 2.29 0.01 0.11 -4.66 113.70 106.64 2win s SER 1597Ca 0.61 1.14 -0.16 0.00 1.31 0.00 0.00 55.95 58.85 2win s SER 1597Cb -0.07 1.02 -0.08 0.00 0.21 0.00 0.00 66.02 67.11 2win s SER 1597CO 0.38 -0.21 0.94 -0.31 0.41 0.00 0.00 173.24 174.45 2win s TYR 1598N 1.40 3.43 -0.14 2.43 1.51 0.56 -0.01 117.35 126.54 2win s TYR 1598Ca -0.09 1.41 0.00 0.00 -1.01 0.00 0.00 57.07 57.38 2win s TYR 1598Cb -0.07 -2.73 0.02 0.00 -0.11 0.00 0.00 41.96 39.07 2win s TYR 1598CO -0.14 -0.28 -0.13 0.42 -1.11 0.00 0.00 175.55 174.31 2win s ILE 1599N -2.51 1.47 -1.15 2.71 -1.09 -0.93 -1.05 121.20 118.66 2win s ILE 1599Ca 0.58 -0.58 -0.21 0.00 -2.23 0.00 0.00 60.65 58.21 2win s ILE 1599Cb -0.10 -1.39 0.02 0.00 -1.58 0.00 0.00 42.46 39.41 2win s ILE 1599CO 0.28 0.44 1.73 -0.63 -1.23 0.00 0.00 174.94 175.54 2win s ILE 1600N 1.46 3.86 0.09 2.92 1.01 -0.06 -4.87 121.20 125.61 2win s ILE 1600Ca 0.03 -1.21 0.01 0.00 0.00 0.00 0.00 60.65 59.48 2win s ILE 1600Cb -0.13 -4.88 0.02 0.00 0.01 0.00 0.00 42.46 37.48 2win s ILE 1600CO -0.09 -1.65 0.12 0.61 0.00 0.00 0.00 174.94 173.93 2win n GLY 1601N 6.06 1.71 0.36 6.18 0.00 -1.26 -4.83 105.19 113.40 2win n GLY 1601Ca 0.43 -2.11 0.09 0.00 0.00 0.00 0.00 46.02 44.43 2win n GLY 1601CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2win h LYS 1602N 0.00 0.66 -0.56 1.61 2.10 -1.72 -0.91 116.57 117.75 2win h LYS 1602Ca -0.04 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 2win h LYS 1602Cb 0.18 -0.15 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2win h LYS 1602CO 0.06 0.44 0.00 -0.25 -2.00 0.00 0.00 179.45 177.69 2win n ASP 1603N -4.50 2.88 -4.63 7.07 8.00 -1.26 -1.24 116.55 122.87 2win n ASP 1603Ca 0.13 -2.22 -0.39 0.00 0.71 0.00 0.00 54.79 53.03 2win n ASP 1603Cb 0.35 -0.42 -0.08 0.00 -0.02 0.00 0.00 41.12 40.95 2win n ASP 1603CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2win s THR 1604N -1.66 5.16 -0.41 -3.53 2.01 -0.35 -4.30 115.64 112.56 2win s THR 1604Ca 0.30 0.68 -0.20 0.00 0.31 0.00 0.00 61.69 62.78 2win s THR 1604Cb 0.19 -3.74 0.02 0.00 0.01 0.00 0.00 72.50 68.98 2win s THR 1604CO 0.15 0.17 0.63 0.86 -0.69 0.00 0.00 174.62 175.74 2win s TRP 1605N 1.91 3.10 -0.27 4.92 -0.11 -0.00 -3.99 118.94 124.49 2win s TRP 1605Ca 0.18 0.08 -0.04 0.00 1.22 0.00 0.00 56.10 57.53 2win s TRP 1605Cb -0.15 -3.26 0.02 0.00 -1.50 0.00 0.00 33.47 28.58 2win s TRP 1605CO 0.09 -0.77 0.00 0.08 -4.62 0.00 0.00 176.95 171.73 2win s VAL 1606N 2.75 3.38 0.00 5.86 1.01 -1.26 -2.97 120.40 129.18 2win s VAL 1606Ca 0.23 -0.84 0.04 0.00 0.00 0.00 0.00 61.98 61.41 2win s VAL 1606Cb -0.14 -2.72 -0.01 0.00 0.00 0.00 0.00 36.38 33.51 2win s VAL 1606CO 0.17 0.17 -0.12 -0.70 0.00 0.00 0.00 175.10 174.62 2win s GLU 1607N 1.41 0.91 -0.13 2.72 2.12 -0.99 -5.01 118.70 119.73 2win s GLU 1607Ca 0.02 -0.50 -0.29 0.00 0.36 0.00 0.00 54.97 54.55 2win s GLU 1607Cb -0.17 -0.88 -0.01 0.00 0.26 0.00 0.00 34.13 33.33 2win s GLU 1607CO -0.01 0.24 1.06 -1.58 -0.54 0.00 0.00 175.26 174.42 2win s HIS 1608N -0.45 3.39 -0.39 5.30 5.65 -1.26 -1.63 115.29 125.91 2win s HIS 1608Ca 0.03 1.48 -0.15 0.00 0.25 0.00 0.00 55.06 56.68 2win s HIS 1608Cb -0.05 -3.26 0.01 0.00 -1.18 0.00 0.00 32.58 28.10 2win s HIS 1608CO -0.00 -0.52 0.30 -0.46 -0.65 0.00 0.00 174.74 173.42 2win s TRP 1609N 2.39 3.23 0.71 3.88 -0.11 -0.01 -4.88 118.94 124.15 2win s TRP 1609Ca 0.49 -0.45 -0.16 0.00 1.22 0.00 0.00 56.10 57.19 2win s TRP 1609Cb -0.19 -2.60 -0.02 0.00 -1.50 0.00 0.00 33.47 29.17 2win s TRP 1609CO 0.16 -0.54 0.82 -2.30 -4.62 0.00 0.00 176.95 170.46 2win n PRO 1610N 5.20 0.47 -1.64 5.86 -0.02 -1.26 -4.01 135.00 139.59 2win n PRO 1610Ca -0.11 0.21 -0.30 0.00 -2.02 0.00 0.00 63.50 61.28 2win n PRO 1610Cb 0.48 -2.08 0.21 0.00 -0.02 0.00 0.00 33.50 32.09 2win n PRO 1610CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2win s GLU 1611N -3.07 -0.16 0.10 -0.52 2.56 -1.26 -4.90 118.70 111.45 2win s GLU 1611Ca 0.71 -0.36 -0.19 0.00 0.00 0.00 0.00 54.97 55.13 2win s GLU 1611Cb -0.36 -1.75 -0.07 0.00 2.00 0.00 0.00 34.13 33.96 2win s GLU 1611CO 0.52 -2.96 1.63 1.49 -0.56 0.00 0.00 175.26 175.39 2win h GLU 1612N -2.03 0.37 -0.67 4.30 4.57 -2.03 -2.90 114.58 116.18 2win h GLU 1612Ca -0.44 -0.07 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 2win h GLU 1612Cb 1.24 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2win h GLU 1612CO 0.33 0.43 0.00 -0.40 -1.18 0.00 0.00 179.01 178.19 2win n ASP 1613N -4.77 3.68 -0.02 1.04 5.75 -1.26 -3.82 116.55 117.15 2win n ASP 1613Ca -0.03 -2.46 0.04 0.00 -0.01 0.00 0.00 54.79 52.33 2win n ASP 1613Cb 0.14 -0.55 -0.11 0.00 -1.03 0.00 0.00 41.12 39.57 2win n ASP 1613CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2win n GLU 1614N 0.51 0.81 0.00 0.11 1.02 -1.10 -4.32 120.64 117.67 2win n GLU 1614Ca 0.17 -0.10 0.07 0.00 -0.02 0.00 0.00 57.16 57.28 2win n GLU 1614Cb 0.75 -1.35 0.33 0.00 -0.02 0.00 0.00 31.44 31.15 2win n GLU 1614CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2win h GLN 1616N 0.00 0.00 -6.72 0.00 1.08 -1.81 -3.39 115.11 104.28 2win h GLN 1616Ca 0.00 0.00 -0.52 0.00 -1.45 0.00 0.00 58.65 56.68 2win h GLN 1616Cb 0.22 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 27.72 2win h GLN 1616CO 0.00 0.58 0.96 0.34 -0.95 0.00 0.00 178.83 179.76 2win s ASP 1617N -6.66 6.37 0.00 1.46 2.15 -0.90 -4.85 116.67 114.25 2win s ASP 1617Ca -0.00 2.91 0.00 0.00 0.43 0.00 0.00 52.55 55.89 2win s ASP 1617Cb 0.11 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.12 2win s ASP 1617CO 0.74 -0.95 0.43 -1.84 -0.17 0.00 0.00 175.17 173.38 2win n GLU 1618N 3.21 0.68 0.00 4.34 0.28 -1.26 -2.16 120.64 125.74 2win n GLU 1618Ca 0.13 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.13 2win n GLU 1618Cb 0.36 -1.25 0.00 0.00 1.43 0.00 0.00 31.44 31.98 2win n GLU 1618CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2win n GLU 1619N -0.02 2.81 -0.04 3.44 1.02 -1.26 -4.69 120.64 121.90 2win n GLU 1619Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 57.23 2win n GLU 1619Cb 0.13 -0.71 0.10 0.00 -0.02 0.00 0.00 31.44 30.93 2win n GLU 1619CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2win n ASN 1620N -1.02 2.57 -0.18 1.62 5.03 -0.92 -4.54 115.26 117.83 2win n ASN 1620Ca 0.00 -1.75 -0.10 0.00 0.87 0.00 0.00 54.58 53.60 2win n ASN 1620Cb 0.00 -0.05 0.01 0.00 -1.02 0.00 0.00 39.78 38.71 2win n ASN 1620CO 0.00 0.00 0.00 1.56 -1.83 0.00 0.00 177.26 176.99 2win h GLN 1621N 3.30 0.94 -0.04 3.52 4.20 -1.73 -1.93 115.11 123.37 2win h GLN 1621Ca 0.00 -0.32 0.01 0.00 0.06 0.00 0.00 58.65 58.40 2win h GLN 1621Cb 0.73 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 2win h GLN 1621CO 0.00 0.98 0.05 -0.22 -0.67 0.00 0.00 178.83 178.96 2win h LYS 1622N 0.80 0.00 0.02 1.46 1.63 -1.91 -1.77 116.57 116.80 2win h LYS 1622Ca 0.14 0.00 -0.33 0.00 -0.85 0.00 0.00 60.65 59.61 2win h LYS 1622Cb 0.58 0.00 -0.05 0.00 -0.60 0.00 0.00 32.23 32.16 2win h LYS 1622CO 0.03 0.00 -2.01 0.94 -3.45 0.00 0.00 179.45 174.96 2win n GLN 1623N -3.87 0.67 -0.06 1.90 7.27 -1.09 -3.65 117.38 118.55 2win n GLN 1623Ca -0.02 0.19 -0.05 0.00 0.07 0.00 0.00 57.00 57.20 2win n GLN 1623Cb 0.14 -1.68 0.16 0.00 2.41 0.00 0.00 30.24 31.26 2win n GLN 1623CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2win h GLN 1625N 0.61 0.44 -0.21 0.00 4.20 -1.52 -1.73 115.11 116.90 2win h GLN 1625Ca 0.10 -0.40 -0.09 0.00 0.06 0.00 0.00 58.65 58.32 2win h GLN 1625Cb 0.60 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 2win h GLN 1625CO 0.04 1.05 -0.22 -0.44 -0.67 0.00 0.00 178.83 178.58 2win h ASP 1626N 0.29 0.56 -0.36 1.46 3.32 -1.59 -1.04 116.42 119.06 2win h ASP 1626Ca -0.05 -0.48 -0.05 0.00 0.02 0.00 0.00 57.03 56.47 2win h ASP 1626Cb 1.41 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.79 2win h ASP 1626CO 0.14 0.93 0.04 -0.07 -1.72 0.00 0.00 179.24 178.56 2win h LEU 1627N 0.21 0.60 -0.85 1.55 3.38 -1.21 0.11 115.31 119.10 2win h LEU 1627Ca 0.03 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.68 2win h LEU 1627Cb 0.78 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 2win h LEU 1627CO 0.05 0.73 0.31 1.23 0.09 0.00 0.00 178.44 180.85 2win h GLY 1628N 0.45 1.24 0.97 0.83 0.00 -1.33 -1.41 103.07 103.81 2win h GLY 1628Ca 0.11 -0.67 -0.11 0.00 0.00 0.00 0.00 47.33 46.66 2win h GLY 1628CO 0.01 0.63 -0.23 0.00 0.00 0.00 0.00 176.54 176.96 2win h ALA 1629N 1.20 0.46 0.00 3.60 0.00 -1.05 -2.93 119.26 120.53 2win h ALA 1629Ca 0.26 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2win h ALA 1629Cb 0.22 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 2win h ALA 1629CO -0.02 0.43 -0.03 0.35 0.00 0.00 0.00 179.25 179.97 2win h PHE 1630N 0.48 0.00 0.48 0.00 3.57 -0.51 -1.09 116.94 119.87 2win h PHE 1630Ca 0.06 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2win h PHE 1630Cb 0.79 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.53 2win h PHE 1630CO 0.07 0.03 -0.23 1.15 -2.23 0.00 0.00 178.31 177.10 2win h THR 1631N 0.00 0.38 -0.09 4.41 2.02 -1.08 -3.03 112.91 115.52 2win h THR 1631Ca -0.00 -0.47 -0.05 0.00 0.77 0.00 0.00 66.41 66.66 2win h THR 1631Cb 0.06 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.00 2win h THR 1631CO 0.00 0.06 -0.20 -0.33 0.37 0.00 0.00 175.52 175.43 2win h GLU 1632N -0.97 0.15 0.00 6.66 5.08 -1.42 -1.71 114.58 122.36 2win h GLU 1632Ca -0.07 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 2win h GLU 1632Cb 0.59 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.82 2win h GLU 1632CO 0.11 0.35 0.00 0.45 -1.00 0.00 0.00 179.01 178.91 2win n SER 1633N -4.24 0.00 -0.03 1.42 2.88 -0.43 -3.41 113.62 109.81 2win n SER 1633Ca -0.01 -0.33 -0.05 0.00 -1.33 0.00 0.00 58.87 57.15 2win n SER 1633Cb 0.30 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.58 2win n SER 1633CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2win n MET 1634N -1.15 0.16 0.44 -1.46 2.81 -0.72 -2.61 117.12 114.60 2win n MET 1634Ca 0.13 0.04 -0.19 0.00 -1.81 0.00 0.00 57.70 55.88 2win n MET 1634Cb 0.12 -1.05 -0.09 0.00 -0.71 0.00 0.00 33.22 31.49 2win n MET 1634CO 0.00 0.00 0.00 -0.39 1.51 0.00 0.00 175.97 177.09 2win h VAL 1635N -0.05 0.14 0.14 2.03 -1.51 -1.40 -3.26 116.25 112.34 2win h VAL 1635Ca -0.16 -0.08 -0.26 0.00 -1.23 0.00 0.00 66.70 64.97 2win h VAL 1635Cb 1.22 0.15 0.03 0.00 -2.13 0.00 0.00 31.29 30.56 2win h VAL 1635CO -0.04 0.01 -1.10 1.62 -1.23 0.00 0.00 177.57 176.82 2win h VAL 1636N -1.18 1.36 0.00 7.19 3.04 -1.84 -3.45 116.25 121.37 2win h VAL 1636Ca -0.11 -2.48 0.00 0.00 -1.01 0.00 0.00 66.70 63.10 2win h VAL 1636Cb 0.86 2.89 0.00 0.00 -2.01 0.00 0.00 31.29 33.03 2win h VAL 1636CO 0.19 0.73 0.00 0.49 -1.01 0.00 0.00 177.57 177.97 2win n PHE 1637N -3.92 0.00 0.00 3.17 0.99 -1.25 -5.10 117.46 111.35 2win n PHE 1637Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.31 2win n PHE 1637Cb 0.93 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.41 2win n PHE 1637CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2win n GLY 1638N 5.00 -0.97 3.27 1.37 0.00 -1.07 -4.76 105.19 108.02 2win n GLY 1638Ca 0.00 0.35 -0.25 0.00 0.00 0.00 0.00 46.02 46.12 2win n GLY 1638CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2win n PRO 1640N 1.54 2.13 0.00 0.00 -0.05 -1.26 -5.18 135.00 132.17 2win n PRO 1640Ca -0.18 -1.68 0.12 0.00 -0.05 0.00 0.00 63.50 61.71 2win n PRO 1640Cb 0.53 -1.46 0.13 0.00 -0.05 0.00 0.00 33.50 32.65 2win n PRO 1640CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 175.50 173.74