#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3g9h n PHE 610 N 0.00 -3.22 0.00 1.08 3.01 -1.26 -4.91 117.46 112.15 3g9h n PHE 610 Ca 0.00 1.77 0.00 0.00 1.01 0.00 0.00 57.45 60.23 3g9h n PHE 610 Cb 0.00 -3.17 0.00 0.00 -0.01 0.00 0.00 39.48 36.30 3g9h n PHE 610 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3g9h n GLY 611 N 1.66 0.46 3.66 1.37 0.00 0.21 -4.89 105.19 107.66 3g9h n GLY 611 Ca -0.23 -1.99 -0.41 0.00 0.00 0.00 0.00 46.02 43.38 3g9h n GLY 611 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3g9h s LEU 612 N 0.00 4.15 -0.09 0.99 2.96 -1.26 -0.12 118.68 125.32 3g9h s LEU 612 Ca 0.00 1.08 0.03 0.00 -0.22 0.00 0.00 54.13 55.02 3g9h s LEU 612 Cb 0.00 -3.15 -0.01 0.00 0.50 0.00 0.00 46.19 43.52 3g9h s LEU 612 CO 0.00 -0.39 -0.18 0.20 -1.32 0.00 0.00 176.35 174.66 3g9h s ASN 613 N 1.20 3.63 0.21 3.68 0.01 0.24 -3.34 114.94 120.56 3g9h s ASN 613 Ca 0.36 -0.38 0.11 0.00 -0.71 0.00 0.00 52.86 52.23 3g9h s ASN 613 Cb -0.16 -1.21 -0.04 0.00 0.41 0.00 0.00 41.25 40.24 3g9h s ASN 613 CO 0.11 0.22 -0.20 0.00 -1.51 0.00 0.00 177.10 175.73 3g9h s ALA 614 N -0.02 2.68 -0.10 0.60 0.00 0.65 -0.84 121.76 124.72 3g9h s ALA 614 Ca -0.05 -1.65 -0.03 0.00 0.00 0.00 0.00 51.96 50.23 3g9h s ALA 614 Cb -0.14 -0.42 0.04 0.00 0.00 0.00 0.00 23.12 22.60 3g9h s ALA 614 CO 0.05 0.41 0.06 0.45 0.00 0.00 0.00 175.76 176.72 3g9h s SER 615 N -2.88 1.72 -0.18 0.00 0.15 -0.37 -1.88 113.70 110.26 3g9h s SER 615 Ca 0.24 -0.23 -0.05 0.00 0.70 0.00 0.00 55.95 56.61 3g9h s SER 615 Cb -0.08 -0.27 -0.03 0.00 -1.71 0.00 0.00 66.02 63.94 3g9h s SER 615 CO 0.12 -0.27 -0.01 -0.63 1.20 0.00 0.00 173.24 173.65 3g9h s ILE 616 N 2.10 4.03 -0.23 6.45 1.01 -0.08 -1.19 121.20 133.28 3g9h s ILE 616 Ca 0.04 -0.30 -0.00 0.00 0.00 0.00 0.00 60.65 60.38 3g9h s ILE 616 Cb -0.14 -2.79 0.07 0.00 0.01 0.00 0.00 42.46 39.60 3g9h s ILE 616 CO -0.06 0.46 -0.01 0.00 0.00 0.00 0.00 174.94 175.34 3g9h s ALA 617 N 0.60 1.66 -0.09 9.38 0.00 -0.63 -1.19 121.76 131.49 3g9h s ALA 617 Ca -0.01 -1.24 0.05 0.00 0.00 0.00 0.00 51.96 50.76 3g9h s ALA 617 Cb -0.14 -1.40 -0.00 0.00 0.00 0.00 0.00 23.12 21.58 3g9h s ALA 617 CO 0.02 -1.26 -0.24 -2.00 0.00 0.00 0.00 175.76 172.28 3g9h s GLU 618 N 1.54 2.90 0.21 0.00 2.12 -0.79 -0.86 118.70 123.82 3g9h s GLU 618 Ca -0.02 -0.89 0.10 0.00 0.36 0.00 0.00 54.97 54.52 3g9h s GLU 618 Cb -0.18 -2.26 -0.04 0.00 0.26 0.00 0.00 34.13 31.91 3g9h s GLU 618 CO -0.09 0.24 -0.10 0.14 -0.54 0.00 0.00 175.26 174.91 3g9h s VAL 619 N 0.19 3.09 -0.14 3.70 -7.23 0.23 -2.12 120.40 118.12 3g9h s VAL 619 Ca -0.14 -1.84 0.01 0.00 -1.81 0.00 0.00 61.98 58.20 3g9h s VAL 619 Cb -0.17 -2.56 0.02 0.00 0.56 0.00 0.00 36.38 34.23 3g9h s VAL 619 CO 0.07 -0.20 -0.17 -0.22 -0.31 0.00 0.00 175.10 174.27 3g9h s LEU 620 N -3.09 1.86 -0.09 1.32 2.96 0.13 -1.58 118.68 120.20 3g9h s LEU 620 Ca 0.27 -0.52 -0.05 0.00 -0.22 0.00 0.00 54.13 53.60 3g9h s LEU 620 Cb -0.08 -1.25 -0.04 0.00 0.50 0.00 0.00 46.19 45.32 3g9h s LEU 620 CO 0.16 0.01 0.14 0.20 -1.32 0.00 0.00 176.35 175.53 3g9h s ASN 621 N 1.12 6.28 -0.24 3.68 0.02 0.21 0.44 114.94 126.45 3g9h s ASN 621 Ca -0.02 0.41 -0.24 0.00 -1.02 0.00 0.00 52.86 51.98 3g9h s ASN 621 Cb -0.14 -2.00 0.07 0.00 0.02 0.00 0.00 41.25 39.20 3g9h s ASN 621 CO -0.06 0.37 0.68 0.00 0.02 0.00 0.00 177.10 178.12 3g9h s ALA 622 N -1.09 -1.70 -0.14 0.60 0.00 -0.09 -1.86 121.76 117.49 3g9h s ALA 622 Ca 0.18 1.87 -0.02 0.00 0.00 0.00 0.00 51.96 53.98 3g9h s ALA 622 Cb -0.12 -1.01 0.04 0.00 0.00 0.00 0.00 23.12 22.03 3g9h s ALA 622 CO 0.07 -0.33 0.02 0.45 0.00 0.00 0.00 175.76 175.97 3g9h s SER 623 N 0.21 2.28 0.02 0.00 0.15 0.03 -1.63 113.70 114.76 3g9h s SER 623 Ca -0.01 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.18 3g9h s SER 623 Cb -0.04 -0.53 -0.04 0.00 -1.71 0.00 0.00 66.02 63.70 3g9h s SER 623 CO 0.02 -0.25 0.05 -0.36 1.20 0.00 0.00 173.24 173.90 3g9h s PHE 624 N 1.91 3.18 -0.05 3.44 0.40 0.03 0.33 117.98 127.22 3g9h s PHE 624 Ca 0.02 0.13 -0.01 0.00 -0.60 0.00 0.00 56.93 56.47 3g9h s PHE 624 Cb -0.15 -1.68 0.03 0.00 0.51 0.00 0.00 43.02 41.73 3g9h s PHE 624 CO -0.07 0.51 0.02 0.21 0.70 0.00 0.00 175.22 176.59 3g9h s LYS 625 N -1.84 0.29 -1.43 0.44 2.20 0.11 0.91 119.74 120.43 3g9h s LYS 625 Ca 0.23 0.18 -0.08 0.00 -0.36 0.00 0.00 55.97 55.94 3g9h s LYS 625 Cb -0.12 -0.67 0.05 0.00 -1.51 0.00 0.00 37.83 35.58 3g9h s LYS 625 CO 0.15 -0.25 0.87 -3.47 -0.36 0.00 0.00 175.35 172.28 3g9h n ASP 626 N 4.86 -3.35 0.00 1.43 -0.08 0.19 -0.70 116.55 118.90 3g9h n ASP 626 Ca -0.12 -0.79 0.00 0.00 -1.51 0.00 0.00 54.79 52.37 3g9h n ASP 626 Cb 0.50 -3.99 0.00 0.00 2.34 0.00 0.00 41.12 39.97 3g9h n ASP 626 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3g9h n GLY 627 N -1.66 1.02 3.89 0.27 0.00 -1.26 -4.98 105.19 102.47 3g9h n GLY 627 Ca -0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.59 3g9h n GLY 627 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3g9h s MET 628 N -0.25 3.61 -0.52 1.61 -1.94 0.12 -4.92 119.30 117.02 3g9h s MET 628 Ca 0.00 -0.08 -0.24 0.00 -1.71 0.00 0.00 55.69 53.66 3g9h s MET 628 Cb 0.00 -2.96 0.04 0.00 2.01 0.00 0.00 34.83 33.92 3g9h s MET 628 CO 0.00 0.55 0.91 -1.17 -0.01 0.00 0.00 175.02 175.30 3g9h s LEU 629 N -2.26 4.14 -0.03 -0.03 2.96 -1.26 0.08 118.68 122.28 3g9h s LEU 629 Ca 0.35 -0.25 -0.25 0.00 -0.22 0.00 0.00 54.13 53.76 3g9h s LEU 629 Cb -0.13 -2.90 -0.19 0.00 0.50 0.00 0.00 46.19 43.47 3g9h s LEU 629 CO 0.21 -1.14 1.16 1.56 -1.32 0.00 0.00 176.35 176.83 3g9h h GLN 630 N 9.21 -0.11 -2.51 1.98 1.08 -0.47 -3.48 115.11 120.82 3g9h h GLN 630 Ca -0.26 0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 56.92 3g9h h GLN 630 Cb 1.08 0.02 -0.15 0.00 -0.05 0.00 0.00 27.48 28.38 3g9h h GLN 630 CO 1.05 0.35 0.23 0.54 -0.95 0.00 0.00 178.83 180.06 3g9h s ASN 631 N -5.56 -0.59 0.11 1.46 2.20 -1.19 -5.02 114.94 106.35 3g9h s ASN 631 Ca -0.15 0.31 -0.16 0.00 -0.94 0.00 0.00 52.86 51.92 3g9h s ASN 631 Cb 0.01 0.56 0.03 0.00 -2.00 0.00 0.00 41.25 39.85 3g9h s ASN 631 CO 0.61 -0.78 0.38 -0.94 -2.94 0.00 0.00 177.10 173.43 3g9h s SER 632 N -2.04 -0.21 -0.02 3.54 1.04 -1.26 -0.79 113.70 113.95 3g9h s SER 632 Ca -0.04 -0.29 -0.18 0.00 0.48 0.00 0.00 55.95 55.92 3g9h s SER 632 Cb -0.01 0.45 0.03 0.00 0.10 0.00 0.00 66.02 66.60 3g9h s SER 632 CO -0.03 -0.81 0.39 -1.58 0.98 0.00 0.00 173.24 172.19 3g9h s GLN 633 N -3.58 0.74 -0.14 4.02 0.74 -0.78 -3.19 119.66 117.47 3g9h s GLN 633 Ca 0.02 -0.09 0.02 0.00 0.05 0.00 0.00 55.36 55.36 3g9h s GLN 633 Cb 0.02 0.34 0.01 0.00 1.10 0.00 0.00 33.01 34.47 3g9h s GLN 633 CO -0.10 -0.21 -0.21 -1.17 -0.55 0.00 0.00 175.29 173.04 3g9h s LEU 634 N -1.27 2.13 -0.07 3.68 2.96 -0.95 -0.62 118.68 124.55 3g9h s LEU 634 Ca -0.13 -0.60 0.02 0.00 -0.22 0.00 0.00 54.13 53.20 3g9h s LEU 634 Cb -0.04 -1.45 0.01 0.00 0.50 0.00 0.00 46.19 45.21 3g9h s LEU 634 CO 0.05 0.08 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.41 3g9h s ILE 635 N 0.84 1.14 0.21 6.68 1.01 -0.61 -0.48 121.20 129.99 3g9h s ILE 635 Ca -0.06 -0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.01 3g9h s ILE 635 Cb -0.15 -1.05 -0.01 0.00 0.01 0.00 0.00 42.46 41.26 3g9h s ILE 635 CO -0.02 0.36 0.36 -0.83 0.00 0.00 0.00 174.94 174.80 3g9h s GLY 636 N 0.72 0.61 -0.01 6.18 0.00 -0.78 0.77 107.32 114.81 3g9h s GLY 636 Ca -0.14 -0.96 -0.05 0.00 0.00 0.00 0.00 44.72 43.58 3g9h s GLY 636 CO 0.03 -0.79 0.09 -1.83 0.00 0.00 0.00 173.10 170.60 3g9h s GLU 637 N -4.01 0.33 -0.09 2.90 -1.05 -0.04 -0.87 118.70 115.86 3g9h s GLU 637 Ca 0.22 -0.26 0.04 0.00 -0.15 0.00 0.00 54.97 54.83 3g9h s GLU 637 Cb 0.02 0.14 -0.00 0.00 -0.44 0.00 0.00 34.13 33.84 3g9h s GLU 637 CO 0.05 -0.07 -0.24 0.42 0.95 0.00 0.00 175.26 176.38 3g9h s ILE 638 N -0.91 2.05 -0.06 1.83 1.01 0.11 -1.60 121.20 123.62 3g9h s ILE 638 Ca -0.10 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.56 3g9h s ILE 638 Cb -0.06 -1.76 -0.02 0.00 0.01 0.00 0.00 42.46 40.62 3g9h s ILE 638 CO 0.01 0.56 -0.14 0.00 0.00 0.00 0.00 174.94 175.36 3g9h s ALA 639 N 0.27 2.65 0.29 9.38 0.00 -0.33 0.04 121.76 134.07 3g9h s ALA 639 Ca -0.17 -0.97 0.10 0.00 0.00 0.00 0.00 51.96 50.92 3g9h s ALA 639 Cb -0.17 -0.99 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 3g9h s ALA 639 CO 0.08 0.51 -0.02 -0.51 0.00 0.00 0.00 175.76 175.83 3g9h s LEU 640 N -0.59 3.06 -0.29 0.00 1.43 -0.28 -1.24 118.68 120.77 3g9h s LEU 640 Ca 0.08 -0.80 -0.15 0.00 -1.03 0.00 0.00 54.13 52.23 3g9h s LEU 640 Cb -0.11 -1.53 0.11 0.00 0.03 0.00 0.00 46.19 44.68 3g9h s LEU 640 CO 0.01 -0.08 0.77 0.21 0.23 0.00 0.00 176.35 177.49 3g9h s ASN 641 N -3.68 -0.84 -0.18 2.29 2.47 -0.02 -1.90 114.94 113.08 3g9h s ASN 641 Ca 0.33 1.31 -0.03 0.00 0.42 0.00 0.00 52.86 54.88 3g9h s ASN 641 Cb -0.04 1.43 -0.02 0.00 -1.45 0.00 0.00 41.25 41.17 3g9h s ASN 641 CO 0.19 -0.20 -0.05 -0.47 -3.72 0.00 0.00 177.10 172.85 3g9h s TYR 642 N 1.70 2.95 -0.32 0.43 5.04 0.06 0.81 117.35 128.03 3g9h s TYR 642 Ca -0.09 -0.62 -0.08 0.00 -2.44 0.00 0.00 57.07 53.84 3g9h s TYR 642 Cb -0.05 -2.00 0.02 0.00 0.35 0.00 0.00 41.96 40.27 3g9h s TYR 642 CO -0.18 -0.29 0.11 -0.51 -1.34 0.00 0.00 175.55 173.34 3g9h s LEU 643 N 0.85 4.14 0.71 6.97 1.43 0.83 0.58 118.68 134.20 3g9h s LEU 643 Ca -0.01 -0.85 -0.15 0.00 -1.03 0.00 0.00 54.13 52.08 3g9h s LEU 643 Cb -0.15 -1.91 0.03 0.00 0.03 0.00 0.00 46.19 44.19 3g9h s LEU 643 CO 0.01 -0.26 1.20 -2.84 0.23 0.00 0.00 176.35 174.69 3g9h s PRO 644 N 1.49 2.25 -1.08 1.29 0.02 -1.26 0.63 135.00 138.35 3g9h s PRO 644 Ca 0.02 1.74 -0.26 0.00 0.02 0.00 0.00 61.00 62.51 3g9h s PRO 644 Cb -0.18 -1.85 -0.21 0.00 0.02 0.00 0.00 34.50 32.28 3g9h s PRO 644 CO 0.04 -1.74 2.11 -0.80 -0.33 0.00 0.00 177.00 176.28 3g9h s ASN 645 N -2.04 3.60 0.46 2.53 0.01 -1.26 -4.77 114.94 113.46 3g9h s ASN 645 Ca 0.74 -0.99 -0.25 0.00 -0.71 0.00 0.00 52.86 51.65 3g9h s ASN 645 Cb -0.29 -2.59 -0.08 0.00 0.41 0.00 0.00 41.25 38.70 3g9h s ASN 645 CO 0.44 -4.57 1.38 -0.55 -1.51 0.00 0.00 177.10 172.29 3g9h s SER 646 N 8.44 5.88 -1.11 -1.22 0.15 -1.26 -0.45 113.70 124.13 3g9h s SER 646 Ca 0.81 2.81 -0.00 0.00 0.70 0.00 0.00 55.95 60.26 3g9h s SER 646 Cb -0.05 -2.64 -0.00 0.00 -1.71 0.00 0.00 66.02 61.61 3g9h s SER 646 CO 0.17 -1.16 0.93 0.52 1.20 0.00 0.00 173.24 174.90 3g9h n VAL 647 N -0.28 -5.66 0.00 4.45 0.31 -1.26 -4.61 118.33 111.29 3g9h n VAL 647 Ca 0.06 -0.48 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3g9h n VAL 647 Cb 0.43 -4.86 0.00 0.00 -0.91 0.00 0.00 33.84 28.50 3g9h n VAL 647 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 3g9h n MET 648 N -3.89 0.00 0.00 5.55 0.00 -1.10 -5.07 117.12 112.60 3g9h n MET 648 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.44 3g9h n MET 648 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.88 3g9h n MET 648 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 3g9h n ASN 649 N 0.00 0.00 -4.89 6.12 3.02 0.40 -4.89 115.26 115.02 3g9h n ASN 649 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 3g9h n ASN 649 Cb 0.00 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.12 3g9h n ASN 649 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3g9h s SER 650 N 0.00 6.39 1.02 6.41 0.15 -1.25 -5.02 113.70 121.40 3g9h s SER 650 Ca 0.00 0.42 -0.14 0.00 0.70 0.00 0.00 55.95 56.93 3g9h s SER 650 Cb 0.00 -2.04 0.12 0.00 -1.71 0.00 0.00 66.02 62.39 3g9h s SER 650 CO 0.00 0.34 0.57 -2.65 1.20 0.00 0.00 173.24 172.70 3g9h n PRO 651 N 1.47 -1.02 -2.02 5.44 -0.02 -1.26 -4.41 135.00 133.18 3g9h n PRO 651 Ca -0.15 -0.26 -0.37 0.00 -2.02 0.00 0.00 63.50 60.69 3g9h n PRO 651 Cb 0.54 -1.98 0.02 0.00 -0.02 0.00 0.00 33.50 32.05 3g9h n PRO 651 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3g9h s LEU 652 N -3.35 3.89 0.23 2.45 1.02 -1.26 -4.91 118.68 116.75 3g9h s LEU 652 Ca 0.61 2.51 -0.14 0.00 0.02 0.00 0.00 54.13 57.12 3g9h s LEU 652 Cb -0.20 -4.32 0.27 0.00 0.02 0.00 0.00 46.19 41.97 3g9h s LEU 652 CO 0.65 -1.30 1.46 -2.65 0.02 0.00 0.00 176.35 174.53 3g9h n PRO 653 N -0.90 -0.19 0.00 1.29 -0.02 -1.26 -4.80 135.00 129.12 3g9h n PRO 653 Ca 0.10 1.45 0.00 0.00 -2.02 0.00 0.00 63.50 63.03 3g9h n PRO 653 Cb 0.47 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 3g9h n PRO 653 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3g9h n ILE 654 N -5.42 0.00 -3.64 4.25 -5.35 -1.25 -3.91 119.36 104.05 3g9h n ILE 654 Ca 0.11 0.00 -0.09 0.00 -0.27 0.00 0.00 62.75 62.50 3g9h n ILE 654 Cb 0.40 0.00 -0.07 0.00 -1.74 0.00 0.00 39.64 38.23 3g9h n ILE 654 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 3g9h s GLY 655 N -2.90 -0.34 -0.13 3.28 0.00 -1.25 -4.90 107.32 101.10 3g9h s GLY 655 Ca 0.00 2.54 -0.03 0.00 0.00 0.00 0.00 44.72 47.23 3g9h s GLY 655 CO 0.00 2.09 0.04 -0.42 0.00 0.00 0.00 173.10 174.81 3g9h s ILE 656 N 0.80 0.24 -0.01 0.90 1.01 -1.06 -0.47 121.20 122.60 3g9h s ILE 656 Ca -0.03 -0.10 -0.25 0.00 0.00 0.00 0.00 60.65 60.27 3g9h s ILE 656 Cb -0.05 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 3g9h s ILE 656 CO -0.09 -0.02 0.75 0.20 0.00 0.00 0.00 174.94 175.78 3g9h s ASN 657 N 2.01 7.12 -0.10 3.58 0.02 0.11 -1.62 114.94 126.06 3g9h s ASN 657 Ca 0.02 1.34 0.03 0.00 -1.02 0.00 0.00 52.86 53.24 3g9h s ASN 657 Cb -0.15 -2.45 0.00 0.00 0.02 0.00 0.00 41.25 38.68 3g9h s ASN 657 CO -0.07 -0.07 -0.20 -0.22 0.02 0.00 0.00 177.10 176.56 3g9h s LEU 658 N 0.43 1.96 -0.06 0.60 0.20 0.15 -0.25 118.68 121.71 3g9h s LEU 658 Ca 0.39 -0.49 0.04 0.00 0.69 0.00 0.00 54.13 54.76 3g9h s LEU 658 Cb -0.19 -1.25 -0.02 0.00 -0.43 0.00 0.00 46.19 44.30 3g9h s LEU 658 CO 0.21 0.11 -0.18 0.00 -0.29 0.00 0.00 176.35 176.20 3g9h s ARG 659 N 0.50 2.59 -0.33 1.98 1.70 0.54 -0.12 118.95 125.81 3g9h s ARG 659 Ca -0.16 -0.77 0.03 0.00 -0.47 0.00 0.00 55.73 54.36 3g9h s ARG 659 Cb -0.17 -2.33 0.09 0.00 -0.57 0.00 0.00 34.95 31.97 3g9h s ARG 659 CO 0.06 0.51 0.02 0.42 -1.08 0.00 0.00 175.30 175.23 3g9h s ILE 660 N -0.45 2.41 0.28 4.99 1.01 0.41 -1.92 121.20 127.93 3g9h s ILE 660 Ca 0.05 -2.08 -0.30 0.00 0.00 0.00 0.00 60.65 58.31 3g9h s ILE 660 Cb -0.12 -2.65 -0.12 0.00 0.01 0.00 0.00 42.46 39.58 3g9h s ILE 660 CO 0.02 -0.44 1.63 -3.20 0.00 0.00 0.00 174.94 172.95 3g9h n ASN 661 N 4.35 3.95 0.00 3.58 5.15 -0.16 -0.72 115.26 131.41 3g9h n ASN 661 Ca -0.02 1.13 0.00 0.00 -0.60 0.00 0.00 54.58 55.09 3g9h n ASN 661 Cb 0.42 -1.60 0.00 0.00 -0.53 0.00 0.00 39.78 38.07 3g9h n ASN 661 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 3g9h n ASN 662 N 2.51 -0.95 0.06 1.20 5.03 -1.26 -2.81 115.26 119.04 3g9h n ASN 662 Ca 0.10 0.00 0.20 0.00 0.87 0.00 0.00 54.58 55.75 3g9h n ASN 662 Cb 0.37 -0.40 0.73 0.00 -1.02 0.00 0.00 39.78 39.46 3g9h n ASN 662 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3g9h h GLY 663 N 0.00 0.00 1.87 7.41 0.00 -1.18 -0.86 103.07 110.31 3g9h h GLY 663 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3g9h h GLY 663 CO 0.00 0.00 0.06 0.00 0.00 0.00 0.00 176.54 176.60 3g9h h ALA 664 N 1.65 1.09 0.00 3.60 0.00 -1.81 -2.00 119.26 121.80 3g9h h ALA 664 Ca 0.21 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 3g9h h ALA 664 Cb 0.98 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3g9h h ALA 664 CO -0.00 -0.06 -0.23 0.87 0.00 0.00 0.00 179.25 179.83 3g9h h LYS 665 N 0.00 0.00 -6.18 0.00 1.57 -1.51 -3.45 116.57 107.00 3g9h h LYS 665 Ca 0.00 0.00 -0.72 0.00 -1.87 0.00 0.00 60.65 58.06 3g9h h LYS 665 Cb 0.13 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.46 3g9h h LYS 665 CO -0.00 0.23 0.85 1.19 -0.57 0.00 0.00 179.45 181.15 3g9h n PHE 666 N -3.30 2.00 -0.06 -1.35 0.99 -0.75 -4.51 117.46 110.47 3g9h n PHE 666 Ca 0.01 0.50 -0.08 0.00 -0.00 0.00 0.00 57.45 57.88 3g9h n PHE 666 Cb 0.48 -2.46 -0.07 0.00 -1.00 0.00 0.00 39.48 36.44 3g9h n PHE 666 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.76 178.25 3g9h h GLU 667 N 6.98 0.00 -5.89 -1.08 4.57 0.43 -3.47 114.58 116.11 3g9h h GLU 667 Ca -0.47 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.18 3g9h h GLU 667 Cb 1.32 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.76 3g9h h GLU 667 CO 0.93 0.51 -0.74 0.15 -1.18 0.00 0.00 179.01 178.67 3g9h s LYS 668 N -1.92 1.52 -0.13 1.92 1.02 -1.15 -4.99 119.74 116.01 3g9h s LYS 668 Ca -0.10 -1.69 -0.09 0.00 0.02 0.00 0.00 55.97 54.10 3g9h s LYS 668 Cb -0.01 -1.46 0.04 0.00 -0.52 0.00 0.00 37.83 35.88 3g9h s LYS 668 CO 0.35 0.25 0.33 0.08 -0.92 0.00 0.00 175.35 175.45 3g9h s VAL 669 N -2.73 -0.02 -0.17 3.17 1.01 -1.26 -2.45 120.40 117.95 3g9h s VAL 669 Ca 0.27 0.06 0.01 0.00 0.00 0.00 0.00 61.98 62.31 3g9h s VAL 669 Cb -0.03 -0.49 0.03 0.00 0.00 0.00 0.00 36.38 35.90 3g9h s VAL 669 CO 0.11 0.02 -0.12 -0.63 0.00 0.00 0.00 175.10 174.49 3g9h s ILE 670 N 0.76 1.58 0.33 2.22 1.01 -0.07 -4.99 121.20 122.04 3g9h s ILE 670 Ca -0.05 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 59.89 3g9h s ILE 670 Cb -0.06 -1.56 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 3g9h s ILE 670 CO -0.05 0.33 0.37 -0.76 0.00 0.00 0.00 174.94 174.82 3g9h s LEU 671 N 1.46 3.78 -1.02 2.97 1.43 -1.26 -1.67 118.68 124.37 3g9h s LEU 671 Ca 0.02 -0.35 -0.09 0.00 -1.03 0.00 0.00 54.13 52.69 3g9h s LEU 671 Cb -0.14 -2.46 0.26 0.00 0.03 0.00 0.00 46.19 43.87 3g9h s LEU 671 CO -0.10 -0.37 0.98 0.21 0.23 0.00 0.00 176.35 177.30 3g9h s ASN 672 N -4.07 6.98 0.20 2.29 3.04 -1.01 -4.91 114.94 117.47 3g9h s ASN 672 Ca 0.42 -3.42 0.10 0.00 0.04 0.00 0.00 52.86 50.00 3g9h s ASN 672 Cb -0.07 -2.16 0.72 0.00 -1.54 0.00 0.00 41.25 38.19 3g9h s ASN 672 CO 0.28 -0.33 0.88 0.00 -3.04 0.00 0.00 177.10 174.90 3g9h n GLN 673 N 2.91 -0.03 -0.31 0.43 3.00 -1.26 -0.58 117.38 121.54 3g9h n GLN 673 Ca 0.21 0.78 0.15 0.00 -0.01 0.00 0.00 57.00 58.13 3g9h n GLN 673 Cb 0.40 -1.38 0.32 0.00 0.00 0.00 0.00 30.24 29.58 3g9h n GLN 673 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3g9h h ALA 674 N 1.12 1.37 0.00 -1.58 0.00 -2.00 -3.32 119.26 114.85 3g9h h ALA 674 Ca 0.46 0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.60 3g9h h ALA 674 Cb 1.19 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.31 3g9h h ALA 674 CO -0.44 -0.51 0.00 1.97 0.00 0.00 0.00 179.25 180.27 3g9h n PHE 675 N -5.23 0.00 -4.46 0.00 1.16 0.25 -4.94 117.46 104.23 3g9h n PHE 675 Ca 0.23 -0.01 -0.20 0.00 -1.87 0.00 0.00 57.45 55.60 3g9h n PHE 675 Cb 0.74 -0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.46 3g9h n PHE 675 CO 0.00 0.00 0.00 0.96 -1.87 0.00 0.00 176.76 175.85 3g9h s ILE 676 N -0.02 0.86 -0.02 1.97 -4.36 -0.96 -0.93 121.20 117.74 3g9h s ILE 676 Ca 0.00 -0.48 0.03 0.00 -0.26 0.00 0.00 60.65 59.94 3g9h s ILE 676 Cb 0.00 -0.72 -0.00 0.00 1.25 0.00 0.00 42.46 42.98 3g9h s ILE 676 CO 0.00 0.23 -0.11 -0.70 0.24 0.00 0.00 174.94 174.61 3g9h s GLU 677 N -0.29 0.94 -0.53 0.37 2.12 0.54 -4.12 118.70 117.73 3g9h s GLU 677 Ca 0.04 -0.37 -0.17 0.00 0.36 0.00 0.00 54.97 54.83 3g9h s GLU 677 Cb -0.04 -0.89 0.10 0.00 0.26 0.00 0.00 34.13 33.55 3g9h s GLU 677 CO -0.00 0.20 0.56 0.50 -0.54 0.00 0.00 175.26 175.97 3g9h s ARG 678 N -0.10 3.03 0.09 4.30 3.52 -1.26 0.49 118.95 129.01 3g9h s ARG 678 Ca 0.02 -1.37 -0.10 0.00 -0.13 0.00 0.00 55.73 54.15 3g9h s ARG 678 Cb -0.06 -4.22 -0.18 0.00 -1.56 0.00 0.00 34.95 28.93 3g9h s ARG 678 CO -0.00 -1.30 1.23 0.28 -0.81 0.00 0.00 175.30 174.70 3g9h h VAL 679 N 5.86 1.32 -3.44 7.11 2.07 -1.66 -3.48 116.25 124.04 3g9h h VAL 679 Ca -0.29 -2.32 -0.04 0.00 0.82 0.00 0.00 66.70 64.87 3g9h h VAL 679 Cb 1.10 2.39 -0.11 0.00 -1.52 0.00 0.00 31.29 33.15 3g9h h VAL 679 CO 1.01 0.71 -0.06 0.00 0.02 0.00 0.00 177.57 179.24 3g9h s ALA 680 N -3.30 -0.74 0.38 1.67 0.00 -0.08 -4.97 121.76 114.72 3g9h s ALA 680 Ca -0.08 -0.33 0.28 0.00 0.00 0.00 0.00 51.96 51.83 3g9h s ALA 680 Cb 0.08 0.82 1.29 0.00 0.00 0.00 0.00 23.12 25.31 3g9h s ALA 680 CO 0.90 -0.74 1.35 -0.35 0.00 0.00 0.00 175.76 176.92 3g9h n PRO 681 N -0.29 -0.03 0.00 0.00 -0.04 -1.26 -0.57 135.00 132.81 3g9h n PRO 681 Ca -0.10 1.08 0.00 0.00 -0.04 0.00 0.00 63.50 64.44 3g9h n PRO 681 Cb 0.63 -2.14 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 3g9h n PRO 681 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3g9h n GLU 682 N -4.42 0.57 -4.64 0.54 1.02 -1.26 -3.75 120.64 108.70 3g9h n GLU 682 Ca 0.35 -0.72 -0.33 0.00 -0.02 0.00 0.00 57.16 56.43 3g9h n GLU 682 Cb 1.36 -0.84 -0.14 0.00 -0.02 0.00 0.00 31.44 31.80 3g9h n GLU 682 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3g9h s GLU 683 N -0.31 3.37 0.14 3.49 8.01 0.26 -0.44 118.70 133.23 3g9h s GLU 683 Ca 0.00 -0.68 0.05 0.00 0.01 0.00 0.00 54.97 54.35 3g9h s GLU 683 Cb 0.00 -2.68 -0.04 0.00 -4.31 0.00 0.00 34.13 27.10 3g9h s GLU 683 CO 0.00 0.15 -0.12 -0.06 0.01 0.00 0.00 175.26 175.24 3g9h s PHE 684 N 0.52 1.35 -0.08 1.61 0.40 0.83 -0.90 117.98 121.70 3g9h s PHE 684 Ca -0.08 -0.67 0.03 0.00 -0.60 0.00 0.00 56.93 55.61 3g9h s PHE 684 Cb -0.16 -0.68 -0.02 0.00 0.51 0.00 0.00 43.02 42.68 3g9h s PHE 684 CO 0.04 0.13 -0.18 0.15 0.70 0.00 0.00 175.22 176.06 3g9h s LYS 685 N -3.37 2.86 -0.07 0.44 1.02 0.18 -0.67 119.74 120.12 3g9h s LYS 685 Ca 0.15 -0.77 0.02 0.00 0.02 0.00 0.00 55.97 55.38 3g9h s LYS 685 Cb -0.00 -2.39 0.01 0.00 -0.52 0.00 0.00 37.83 34.93 3g9h s LYS 685 CO 0.02 0.37 -0.13 0.08 -0.92 0.00 0.00 175.35 174.78 3g9h s VAL 686 N -0.10 1.19 -0.39 3.17 1.01 -0.64 -0.34 120.40 124.30 3g9h s VAL 686 Ca -0.03 -0.51 -0.14 0.00 0.00 0.00 0.00 61.98 61.29 3g9h s VAL 686 Cb -0.14 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.16 3g9h s VAL 686 CO 0.04 0.37 0.29 0.21 0.00 0.00 0.00 175.10 176.00 3g9h s ASN 687 N 0.66 6.10 0.21 3.32 2.47 -0.11 -2.57 114.94 125.02 3g9h s ASN 687 Ca -0.14 -0.78 0.19 0.00 0.42 0.00 0.00 52.86 52.54 3g9h s ASN 687 Cb -0.16 -2.15 0.87 0.00 -1.45 0.00 0.00 41.25 38.36 3g9h s ASN 687 CO 0.04 -0.40 1.57 -0.81 -3.72 0.00 0.00 177.10 173.78 3g9h n PRO 688 N 5.15 0.13 -0.11 0.43 -0.04 -1.26 -3.60 135.00 135.69 3g9h n PRO 688 Ca -0.11 0.48 -0.05 0.00 -0.04 0.00 0.00 63.50 63.78 3g9h n PRO 688 Cb 0.48 -1.80 0.02 0.00 -0.04 0.00 0.00 33.50 32.15 3g9h n PRO 688 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3g9h h SER 689 N 0.00 -0.16 0.89 3.54 0.87 -1.97 -1.49 113.55 115.22 3g9h h SER 689 Ca 0.00 0.09 -0.10 0.00 -1.23 0.00 0.00 61.79 60.55 3g9h h SER 689 Cb 0.18 0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 3g9h h SER 689 CO 0.00 -0.04 -0.48 -0.26 -0.53 0.00 0.00 176.83 175.52 3g9h h PHE 690 N 0.10 0.00 -0.90 2.24 -1.00 -1.94 -3.16 116.94 112.29 3g9h h PHE 690 Ca 0.19 0.00 -0.50 0.00 2.81 0.00 0.00 57.97 60.47 3g9h h PHE 690 Cb 0.26 0.00 -0.28 0.00 3.61 0.00 0.00 35.95 39.54 3g9h h PHE 690 CO -0.26 0.48 0.55 0.44 -1.61 0.00 0.00 178.31 177.90 3g9h n ILE 691 N -3.54 3.18 -2.29 -0.55 -5.35 -0.88 -4.76 119.36 105.18 3g9h n ILE 691 Ca -0.00 -2.30 -0.43 0.00 -0.27 0.00 0.00 62.75 59.74 3g9h n ILE 691 Cb 0.58 -0.60 -0.02 0.00 -1.74 0.00 0.00 39.64 37.86 3g9h n ILE 691 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 3g9h s ASP 692 N -1.65 6.34 -0.68 7.28 -1.08 -0.62 -0.76 116.67 125.51 3g9h s ASP 692 Ca 0.57 1.06 0.00 0.00 -0.52 0.00 0.00 52.55 53.65 3g9h s ASP 692 Cb 0.47 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.40 3g9h s ASP 692 CO 0.07 -1.38 0.00 -1.20 0.52 0.00 0.00 175.17 173.17 3g9h n SER 693 N 8.75 -2.84 -4.04 -0.34 7.64 0.20 -4.89 113.62 118.09 3g9h n SER 693 Ca 0.17 0.30 -0.15 0.00 1.01 0.00 0.00 58.87 60.20 3g9h n SER 693 Cb 0.47 -2.48 -0.13 0.00 -1.01 0.00 0.00 64.21 61.07 3g9h n SER 693 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3g9h s ARG 694 N -4.95 0.57 -0.24 1.43 1.81 -1.17 -5.00 118.95 111.39 3g9h s ARG 694 Ca 0.00 -0.58 -0.04 0.00 -1.72 0.00 0.00 55.73 53.39 3g9h s ARG 694 Cb 0.00 -0.45 0.00 0.00 -0.45 0.00 0.00 34.95 34.06 3g9h s ARG 694 CO 0.00 0.10 -0.02 0.99 -0.68 0.00 0.00 175.30 175.69 3g9h s THR 695 N -0.90 3.37 0.18 0.02 2.01 -1.26 -4.14 115.64 114.92 3g9h s THR 695 Ca -0.04 -0.66 0.11 0.00 0.31 0.00 0.00 61.69 61.41 3g9h s THR 695 Cb -0.07 -2.61 -0.04 0.00 0.01 0.00 0.00 72.50 69.78 3g9h s THR 695 CO 0.00 0.30 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.24 3g9h s LEU 696 N 1.45 2.42 0.08 4.42 1.43 -0.80 -4.96 118.68 122.72 3g9h s LEU 696 Ca 0.04 -0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 51.98 3g9h s LEU 696 Cb -0.15 -1.11 -0.06 0.00 0.03 0.00 0.00 46.19 44.90 3g9h s LEU 696 CO -0.02 0.10 1.17 -0.83 0.23 0.00 0.00 176.35 176.99 3g9h s GLY 697 N -2.61 2.52 -0.17 -3.19 0.00 -1.26 -1.13 107.32 101.49 3g9h s GLY 697 Ca 0.19 0.82 -0.06 0.00 0.00 0.00 0.00 44.72 45.67 3g9h s GLY 697 CO 0.09 1.95 -0.20 0.00 0.00 0.00 0.00 173.10 174.94 3g9h n ALA 698 N 3.66 1.86 -3.36 3.20 0.00 0.11 -4.67 120.51 121.30 3g9h n ALA 698 Ca 0.08 -0.67 -0.15 0.00 0.00 0.00 0.00 53.44 52.70 3g9h n ALA 698 Cb 0.47 0.25 -0.15 0.00 0.00 0.00 0.00 19.45 20.01 3g9h n ALA 698 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3g9h s ILE 699 N -2.31 0.14 -0.14 0.00 1.01 -0.63 -2.41 121.20 116.87 3g9h s ILE 699 Ca -0.23 0.03 -0.01 0.00 0.00 0.00 0.00 60.65 60.45 3g9h s ILE 699 Cb 0.08 -0.19 -0.01 0.00 0.01 0.00 0.00 42.46 42.34 3g9h s ILE 699 CO 0.31 0.10 -0.12 -0.75 0.00 0.00 0.00 174.94 174.47 3g9h s LYS 700 N 0.59 3.38 0.10 2.79 2.47 -0.67 0.06 119.74 128.45 3g9h s LYS 700 Ca -0.06 -0.68 0.02 0.00 -1.56 0.00 0.00 55.97 53.70 3g9h s LYS 700 Cb -0.08 -2.67 -0.04 0.00 -1.46 0.00 0.00 37.83 33.58 3g9h s LYS 700 CO -0.01 0.17 -0.07 1.52 0.16 0.00 0.00 175.35 177.12 3g9h s TYR 701 N 0.47 0.90 -0.01 4.03 -0.85 -0.05 -0.89 117.35 120.95 3g9h s TYR 701 Ca -0.09 -0.86 0.02 0.00 -0.52 0.00 0.00 57.07 55.62 3g9h s TYR 701 Cb -0.16 -0.52 -0.00 0.00 0.38 0.00 0.00 41.96 41.66 3g9h s TYR 701 CO 0.04 -0.12 -0.08 0.45 -1.52 0.00 0.00 175.55 174.32 3g9h s SER 702 N -2.91 1.01 -0.14 -0.18 0.15 -1.03 -1.86 113.70 108.75 3g9h s SER 702 Ca 0.10 -0.15 0.02 0.00 0.70 0.00 0.00 55.95 56.62 3g9h s SER 702 Cb 0.04 -0.17 0.01 0.00 -1.71 0.00 0.00 66.02 64.18 3g9h s SER 702 CO -0.04 0.08 -0.21 -0.63 1.20 0.00 0.00 173.24 173.65 3g9h s ILE 703 N -0.05 2.21 0.33 6.45 1.01 0.37 0.11 121.20 131.62 3g9h s ILE 703 Ca 0.01 -0.94 -0.28 0.00 0.00 0.00 0.00 60.65 59.45 3g9h s ILE 703 Cb -0.05 -1.89 -0.09 0.00 0.01 0.00 0.00 42.46 40.44 3g9h s ILE 703 CO -0.00 0.54 1.13 -0.75 0.00 0.00 0.00 174.94 175.87 3g9h s LYS 704 N 0.71 4.40 -0.10 2.79 2.20 -1.26 -2.23 119.74 126.25 3g9h s LYS 704 Ca -0.09 1.82 -0.01 0.00 -0.36 0.00 0.00 55.97 57.33 3g9h s LYS 704 Cb -0.16 -2.96 0.00 0.00 -1.51 0.00 0.00 37.83 33.20 3g9h s LYS 704 CO 0.01 -0.01 0.08 0.39 -0.36 0.00 0.00 175.35 175.46 3g9h n GLU 705 N 0.70 -0.21 -2.15 4.03 4.71 -1.19 -4.92 120.64 121.60 3g9h n GLU 705 Ca 0.01 0.11 -0.27 0.00 -0.01 0.00 0.00 57.16 57.00 3g9h n GLU 705 Cb 0.45 -0.29 0.12 0.00 -1.01 0.00 0.00 31.44 30.72 3g9h n GLU 705 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 3g9h s PRO 706 N -2.10 1.47 0.34 3.49 0.04 -1.26 -4.98 135.00 131.99 3g9h s PRO 706 Ca 0.01 -0.46 -0.22 0.00 0.04 0.00 0.00 61.00 60.37 3g9h s PRO 706 Cb -0.00 -2.06 -0.10 0.00 0.04 0.00 0.00 34.50 32.38 3g9h s PRO 706 CO 0.12 -1.77 0.88 0.96 0.04 0.00 0.00 177.00 177.23 3g9h s ILE 707 N -3.50 4.40 -0.42 0.56 -4.36 -1.26 -4.78 121.20 111.84 3g9h s ILE 707 Ca 0.67 1.50 -0.14 0.00 -0.26 0.00 0.00 60.65 62.41 3g9h s ILE 707 Cb -0.07 -3.80 0.03 0.00 1.25 0.00 0.00 42.46 39.88 3g9h s ILE 707 CO 0.48 -0.04 0.31 0.00 0.24 0.00 0.00 174.94 175.93 3g9h s ALA 708 N -1.83 3.47 0.36 2.27 0.00 -1.26 -4.95 121.76 119.82 3g9h s ALA 708 Ca 0.53 -1.82 0.04 0.00 0.00 0.00 0.00 51.96 50.71 3g9h s ALA 708 Cb -0.14 -2.89 0.69 0.00 0.00 0.00 0.00 23.12 20.78 3g9h s ALA 708 CO 0.19 -1.52 2.00 -1.00 0.00 0.00 0.00 175.76 175.43 3g9h h PRO 709 N 8.63 0.71 -5.21 0.00 0.13 -1.91 -3.42 132.00 130.93 3g9h h PRO 709 Ca -0.27 -0.06 -0.64 0.00 -0.87 0.00 0.00 66.00 64.16 3g9h h PRO 709 Cb 1.11 -0.15 -0.24 0.00 0.13 0.00 0.00 31.00 31.86 3g9h h PRO 709 CO 0.76 0.50 -0.69 0.42 -0.23 0.00 0.00 178.00 178.76 3g9h s ILE 710 N -5.55 3.70 -0.09 -3.56 1.09 -1.26 0.12 121.20 115.66 3g9h s ILE 710 Ca -0.09 -0.41 -0.17 0.00 -1.10 0.00 0.00 60.65 58.88 3g9h s ILE 710 Cb 0.17 -2.64 -0.05 0.00 -1.06 0.00 0.00 42.46 38.89 3g9h s ILE 710 CO 0.76 0.47 0.44 -0.69 -0.10 0.00 0.00 174.94 175.82 3g9h s VAL 711 N 0.70 5.14 -0.36 2.92 1.01 0.15 -4.89 120.40 125.08 3g9h s VAL 711 Ca -0.02 0.89 -0.00 0.00 0.00 0.00 0.00 61.98 62.84 3g9h s VAL 711 Cb -0.15 -3.77 0.09 0.00 0.00 0.00 0.00 36.38 32.56 3g9h s VAL 711 CO 0.02 0.41 0.11 -0.63 0.00 0.00 0.00 175.10 175.00 3g9h s ILE 712 N 0.11 2.89 -0.33 2.22 -1.09 -1.26 -2.38 121.20 121.34 3g9h s ILE 712 Ca 0.24 -1.99 0.03 0.00 -2.23 0.00 0.00 60.65 56.70 3g9h s ILE 712 Cb -0.15 -2.95 0.09 0.00 -1.58 0.00 0.00 42.46 37.87 3g9h s ILE 712 CO 0.11 -0.52 0.04 -2.28 -1.23 0.00 0.00 174.94 171.05 3g9h s HIS 713 N 1.09 3.67 0.16 3.97 2.46 -0.87 -4.44 115.29 121.33 3g9h s HIS 713 Ca 0.06 -2.82 0.00 0.00 0.47 0.00 0.00 55.06 52.77 3g9h s HIS 713 Cb -0.21 -2.79 -0.04 0.00 -0.13 0.00 0.00 32.58 29.41 3g9h s HIS 713 CO -0.05 -0.94 0.33 -1.25 -2.47 0.00 0.00 174.74 170.36 3g9h s PRO 714 N 0.96 3.49 -0.04 2.88 0.04 -1.26 -2.11 135.00 138.95 3g9h s PRO 714 Ca 0.07 -0.44 0.01 0.00 0.04 0.00 0.00 61.00 60.68 3g9h s PRO 714 Cb -0.20 -2.91 0.02 0.00 0.04 0.00 0.00 34.50 31.46 3g9h s PRO 714 CO -0.07 0.48 -0.03 0.08 0.04 0.00 0.00 177.00 177.50 3g9h s VAL 715 N -1.76 0.44 0.27 -0.36 1.01 -0.56 -4.36 120.40 115.07 3g9h s VAL 715 Ca 0.37 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.38 3g9h s VAL 715 Cb -0.11 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 3g9h s VAL 715 CO 0.28 0.21 0.10 0.26 0.00 0.00 0.00 175.10 175.95 3g9h s TRP 716 N 1.03 2.88 -0.32 5.22 0.52 -1.26 -1.25 118.94 125.76 3g9h s TRP 716 Ca -0.09 -0.19 -0.01 0.00 0.02 0.00 0.00 56.10 55.83 3g9h s TRP 716 Cb -0.14 -1.33 0.13 0.00 -1.15 0.00 0.00 33.47 30.98 3g9h s TRP 716 CO -0.01 0.55 0.23 1.03 0.02 0.00 0.00 176.95 178.77 3g9h s ARG 717 N -3.77 0.40 -0.03 4.98 0.52 0.68 -4.94 118.95 116.79 3g9h s ARG 717 Ca 0.33 -0.76 -0.13 0.00 -0.52 0.00 0.00 55.73 54.65 3g9h s ARG 717 Cb -0.07 -1.03 -0.05 0.00 0.52 0.00 0.00 34.95 34.32 3g9h s ARG 717 CO 0.22 -1.11 0.34 -0.06 0.02 0.00 0.00 175.30 174.71 3g9h s PHE 718 N 1.71 3.69 0.28 -0.53 0.40 -1.26 -0.41 117.98 121.87 3g9h s PHE 718 Ca 0.13 0.86 0.06 0.00 -0.60 0.00 0.00 56.93 57.39 3g9h s PHE 718 Cb -0.18 -2.20 -0.02 0.00 0.51 0.00 0.00 43.02 41.13 3g9h s PHE 718 CO -0.19 0.66 0.22 0.39 0.70 0.00 0.00 175.22 177.01 3g9h n GLU 719 N 1.89 0.37 0.00 0.44 1.02 -0.32 -4.99 120.64 119.06 3g9h n GLU 719 Ca -0.16 -2.79 0.14 0.00 -0.02 0.00 0.00 57.16 54.34 3g9h n GLU 719 Cb 0.53 2.20 0.69 0.00 -0.02 0.00 0.00 31.44 34.84 3g9h n GLU 719 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3g9h n SER 720 N -1.87 0.00 0.00 1.62 7.64 -1.26 -3.28 113.62 116.46 3g9h n SER 720 Ca 0.05 0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.97 3g9h n SER 720 Cb 0.50 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 3g9h n SER 720 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3g9h n HIS 721 N -1.34 0.00 -4.41 1.43 1.44 -1.26 -2.76 115.22 108.32 3g9h n HIS 721 Ca 0.12 0.00 -0.21 0.00 -2.01 0.00 0.00 57.72 55.62 3g9h n HIS 721 Cb 0.25 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.27 3g9h n HIS 721 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 3g9h s GLN 722 N -0.12 1.65 -0.21 -1.40 -0.21 -1.25 -0.02 119.66 118.09 3g9h s GLN 722 Ca 0.00 -1.95 -0.04 0.00 0.02 0.00 0.00 55.36 53.39 3g9h s GLN 722 Cb 0.00 -0.50 0.11 0.00 1.00 0.00 0.00 33.01 33.62 3g9h s GLN 722 CO 0.00 -0.34 0.37 0.00 -2.12 0.00 0.00 175.29 173.20 3g9h s ALA 723 N -3.45 -1.02 -0.16 6.09 0.00 -0.49 -1.18 121.76 121.56 3g9h s ALA 723 Ca 0.33 1.07 -0.02 0.00 0.00 0.00 0.00 51.96 53.35 3g9h s ALA 723 Cb 0.06 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.69 3g9h s ALA 723 CO 0.15 -1.03 -0.10 -1.12 0.00 0.00 0.00 175.76 173.66 3g9h s SER 724 N 2.54 4.12 -0.11 0.00 0.01 0.46 0.32 113.70 121.04 3g9h s SER 724 Ca 0.07 -0.35 0.03 0.00 1.31 0.00 0.00 55.95 57.01 3g9h s SER 724 Cb -0.14 -1.66 0.01 0.00 0.21 0.00 0.00 66.02 64.44 3g9h s SER 724 CO -0.14 0.10 -0.20 -0.69 0.41 0.00 0.00 173.24 172.73 3g9h s VAL 725 N 0.75 1.81 -0.30 3.43 1.01 -0.24 -0.23 120.40 126.63 3g9h s VAL 725 Ca -0.04 -0.85 -0.03 0.00 0.00 0.00 0.00 61.98 61.06 3g9h s VAL 725 Cb -0.15 -1.60 0.04 0.00 0.00 0.00 0.00 36.38 34.67 3g9h s VAL 725 CO 0.02 0.50 0.02 -0.69 0.00 0.00 0.00 175.10 174.95 3g9h s VAL 726 N 0.73 3.20 -0.18 2.92 1.01 -0.38 -1.98 120.40 125.71 3g9h s VAL 726 Ca -0.11 -1.27 -0.04 0.00 0.00 0.00 0.00 61.98 60.56 3g9h s VAL 726 Cb -0.16 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.39 3g9h s VAL 726 CO 0.02 -0.09 -0.04 -0.22 0.00 0.00 0.00 175.10 174.77 3g9h s LEU 727 N 1.30 3.11 -0.01 3.92 2.96 0.26 -1.50 118.68 128.73 3g9h s LEU 727 Ca -0.04 -0.24 0.05 0.00 -0.22 0.00 0.00 54.13 53.68 3g9h s LEU 727 Cb -0.19 -1.77 -0.03 0.00 0.50 0.00 0.00 46.19 44.70 3g9h s LEU 727 CO -0.00 0.09 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.09 3g9h s THR 728 N 0.83 3.12 -0.23 3.68 2.01 -0.90 0.56 115.64 124.71 3g9h s THR 728 Ca -0.01 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 3g9h s THR 728 Cb -0.15 -2.28 0.07 0.00 0.01 0.00 0.00 72.50 70.16 3g9h s THR 728 CO 0.02 0.47 0.06 -0.69 -0.69 0.00 0.00 174.62 173.78 3g9h s VAL 729 N -0.85 0.57 0.16 3.82 1.01 -0.18 -2.04 120.40 122.89 3g9h s VAL 729 Ca 0.14 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.37 3g9h s VAL 729 Cb -0.11 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 3g9h s VAL 729 CO 0.04 -0.37 -0.07 -1.59 0.00 0.00 0.00 175.10 173.11 3g9h s LYS 730 N 1.82 1.10 0.42 2.72 -2.85 -1.00 -0.55 119.74 121.39 3g9h s LYS 730 Ca 0.02 -1.49 -0.26 0.00 -1.00 0.00 0.00 55.97 53.24 3g9h s LYS 730 Cb -0.17 -0.54 -0.09 0.00 -2.06 0.00 0.00 37.83 34.97 3g9h s LYS 730 CO -0.15 0.01 1.41 1.41 0.10 0.00 0.00 175.35 178.13 3g9h s MET 731 N -3.80 3.86 -0.20 1.78 -2.45 -1.26 -0.67 119.30 116.56 3g9h s MET 731 Ca 0.19 2.39 -0.22 0.00 -1.25 0.00 0.00 55.69 56.79 3g9h s MET 731 Cb 0.04 -2.76 -0.02 0.00 1.25 0.00 0.00 34.83 33.34 3g9h s MET 731 CO 0.02 -0.67 0.71 0.45 1.05 0.00 0.00 175.02 176.58 3g9h s SER 732 N -0.48 6.77 0.42 1.11 0.15 0.33 -4.71 113.70 117.29 3g9h s SER 732 Ca 0.58 0.94 0.29 0.00 0.70 0.00 0.00 55.95 58.47 3g9h s SER 732 Cb -0.43 -2.39 1.46 0.00 -1.71 0.00 0.00 66.02 62.96 3g9h s SER 732 CO 0.56 -0.34 1.88 1.55 1.20 0.00 0.00 173.24 178.10 3g9h h PRO 733 N 7.48 0.00 0.00 5.44 0.13 -1.89 -2.27 132.00 140.89 3g9h h PRO 733 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 3g9h h PRO 733 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 3g9h h PRO 733 CO 0.80 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.44 3g9h n SER 734 N -2.56 0.39 -4.76 1.44 3.41 -1.26 -4.64 113.62 105.64 3g9h n SER 734 Ca -0.01 0.66 -0.37 0.00 -0.26 0.00 0.00 58.87 58.90 3g9h n SER 734 Cb 0.12 -0.72 0.02 0.00 -0.26 0.00 0.00 64.21 63.37 3g9h n SER 734 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3g9h s LEU 735 N -4.00 3.82 1.00 1.04 1.43 -0.86 -4.94 118.68 116.18 3g9h s LEU 735 Ca -0.00 2.44 -0.14 0.00 -1.03 0.00 0.00 54.13 55.40 3g9h s LEU 735 Cb 0.05 -4.41 0.07 0.00 0.03 0.00 0.00 46.19 41.93 3g9h s LEU 735 CO 0.17 -1.35 0.36 -0.81 0.23 0.00 0.00 176.35 174.95 3g9h n PRO 736 N -1.09 -0.70 0.00 1.29 -0.04 -1.26 -4.92 135.00 128.28 3g9h n PRO 736 Ca 0.11 -0.17 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 3g9h n PRO 736 Cb 0.48 -1.85 0.00 0.00 -0.04 0.00 0.00 33.50 32.09 3g9h n PRO 736 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3g9h n ASP 737 N -1.67 0.00 0.00 3.54 8.00 -1.26 -3.27 116.55 121.88 3g9h n ASP 737 Ca 0.05 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.55 3g9h n ASP 737 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.66 3g9h n ASP 737 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3g9h n GLU 738 N 0.00 0.00 -3.99 -1.24 4.71 -1.26 -4.80 120.64 114.06 3g9h n GLU 738 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 3g9h n GLU 738 Cb 0.00 -3.64 -0.15 0.00 -1.01 0.00 0.00 31.44 26.64 3g9h n GLU 738 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 3g9h s ILE 739 N -0.79 2.14 -0.28 -3.67 -1.09 -1.20 -4.94 121.20 111.37 3g9h s ILE 739 Ca 0.00 -2.26 0.23 0.00 -2.23 0.00 0.00 60.65 56.38 3g9h s ILE 739 Cb 0.00 -2.59 0.05 0.00 -1.58 0.00 0.00 42.46 38.34 3g9h s ILE 739 CO 0.00 -0.61 1.14 0.77 -1.23 0.00 0.00 174.94 175.01 3g9h h SER 740 N 7.65 0.00 -4.96 3.58 4.64 -1.88 -3.44 113.55 119.14 3g9h h SER 740 Ca -0.05 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.25 3g9h h SER 740 Cb 1.02 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.97 3g9h h SER 740 CO 0.52 0.00 0.23 0.00 -0.87 0.00 0.00 176.83 176.71 3g9h s GLN 741 N -3.34 1.20 0.03 4.77 -2.07 -1.26 0.12 119.66 119.11 3g9h s GLN 741 Ca 0.01 -0.32 0.04 0.00 -1.82 0.00 0.00 55.36 53.28 3g9h s GLN 741 Cb 0.09 0.55 -0.02 0.00 -1.09 0.00 0.00 33.01 32.54 3g9h s GLN 741 CO 0.77 -0.50 -0.13 -1.50 -1.32 0.00 0.00 175.29 172.61 3g9h s ILE 742 N -3.20 1.02 -0.18 3.63 2.07 0.10 -4.94 121.20 119.70 3g9h s ILE 742 Ca -0.01 -0.91 -0.01 0.00 -1.41 0.00 0.00 60.65 58.31 3g9h s ILE 742 Cb -0.01 -0.92 0.01 0.00 0.13 0.00 0.00 42.46 41.67 3g9h s ILE 742 CO -0.08 0.01 -0.14 0.54 -1.91 0.00 0.00 174.94 173.35 3g9h s VAL 743 N -0.79 2.59 -0.07 4.00 0.11 -1.26 -1.30 120.40 123.68 3g9h s VAL 743 Ca 0.01 -0.77 -0.04 0.00 -2.93 0.00 0.00 61.98 58.25 3g9h s VAL 743 Cb -0.07 -2.12 -0.04 0.00 -1.53 0.00 0.00 36.38 32.62 3g9h s VAL 743 CO 0.01 0.50 0.13 -0.63 -3.33 0.00 0.00 175.10 171.78 3g9h s ILE 744 N 1.20 5.28 0.12 7.04 1.01 -0.06 -2.29 121.20 133.50 3g9h s ILE 744 Ca 0.02 -0.03 0.07 0.00 0.00 0.00 0.00 60.65 60.72 3g9h s ILE 744 Cb -0.14 -3.36 -0.04 0.00 0.01 0.00 0.00 42.46 38.93 3g9h s ILE 744 CO -0.06 0.49 -0.17 -1.61 0.00 0.00 0.00 174.94 173.58 3g9h s GLU 745 N -1.39 1.09 -1.31 2.79 2.02 0.89 -0.47 118.70 122.33 3g9h s GLU 745 Ca 0.20 -1.22 -0.05 0.00 0.02 0.00 0.00 54.97 53.92 3g9h s GLU 745 Cb -0.12 -1.17 0.03 0.00 0.10 0.00 0.00 34.13 32.97 3g9h s GLU 745 CO 0.10 0.25 0.35 -0.25 0.02 0.00 0.00 175.26 175.72 3g9h n ASP 746 N 0.76 -4.47 -4.72 -0.19 8.00 -1.26 -0.67 116.55 113.99 3g9h n ASP 746 Ca -0.17 -0.17 -0.42 0.00 0.71 0.00 0.00 54.79 54.73 3g9h n ASP 746 Cb 0.55 -3.70 -0.01 0.00 -0.02 0.00 0.00 41.12 37.95 3g9h n ASP 746 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3g9h n LEU 747 N -3.49 3.93 -3.87 0.64 7.94 -1.26 -4.42 117.00 116.48 3g9h n LEU 747 Ca -0.09 1.18 -0.15 0.00 -1.11 0.00 0.00 56.01 55.83 3g9h n LEU 747 Cb 0.59 -1.53 -0.15 0.00 0.53 0.00 0.00 43.42 42.86 3g9h n LEU 747 CO 0.39 -0.17 -0.38 -0.69 -1.11 0.00 0.00 177.39 175.43 3g9h s VAL 748 N -0.54 0.20 -0.09 1.96 1.01 0.57 -1.91 120.40 121.60 3g9h s VAL 748 Ca 0.60 -0.02 -0.00 0.00 0.00 0.00 0.00 61.98 62.56 3g9h s VAL 748 Cb -0.55 -0.23 0.02 0.00 0.00 0.00 0.00 36.38 35.63 3g9h s VAL 748 CO 0.56 0.10 -0.06 -0.69 0.00 0.00 0.00 175.10 175.01 3g9h s VAL 749 N 0.45 0.80 -0.15 2.92 1.01 0.23 -1.02 120.40 124.63 3g9h s VAL 749 Ca -0.04 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 61.74 3g9h s VAL 749 Cb -0.07 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.45 3g9h s VAL 749 CO -0.01 0.32 -0.08 -0.36 0.00 0.00 0.00 175.10 174.97 3g9h s PHE 750 N 1.55 2.93 -0.03 5.22 0.40 -0.33 -0.61 117.98 127.10 3g9h s PHE 750 Ca 0.00 -0.48 0.06 0.00 -0.60 0.00 0.00 56.93 55.91 3g9h s PHE 750 Cb -0.13 -1.92 -0.01 0.00 0.51 0.00 0.00 43.02 41.47 3g9h s PHE 750 CO -0.05 -0.14 -0.20 0.08 0.70 0.00 0.00 175.22 175.61 3g9h s VAL 751 N 0.43 1.63 0.06 -0.44 1.01 -0.30 -1.23 120.40 121.57 3g9h s VAL 751 Ca -0.06 -0.85 -0.21 0.00 0.00 0.00 0.00 61.98 60.85 3g9h s VAL 751 Cb -0.15 -1.38 0.05 0.00 0.00 0.00 0.00 36.38 34.90 3g9h s VAL 751 CO 0.04 0.46 0.49 0.54 0.00 0.00 0.00 175.10 176.63 3g9h s ASN 752 N -0.24 -0.40 0.42 3.32 4.22 -1.26 -1.14 114.94 119.87 3g9h s ASN 752 Ca 0.02 0.08 0.01 0.00 -2.14 0.00 0.00 52.86 50.83 3g9h s ASN 752 Cb -0.10 0.48 0.01 0.00 1.28 0.00 0.00 41.25 42.92 3g9h s ASN 752 CO 0.01 -0.74 0.08 2.30 -2.04 0.00 0.00 177.10 176.71 3g9h n ILE 753 N 0.31 0.00 -1.20 0.54 -5.35 -1.16 -3.10 119.36 109.40 3g9h n ILE 753 Ca -0.18 -1.92 0.00 0.00 -0.27 0.00 0.00 62.75 60.38 3g9h n ILE 753 Cb 0.61 0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.78 3g9h n ILE 753 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 3g9h n ASP 754 N -1.40 0.00 -1.13 7.28 5.75 -1.11 -4.70 116.55 121.24 3g9h n ASP 754 Ca -0.14 -0.60 0.05 0.00 -0.01 0.00 0.00 54.79 54.09 3g9h n ASP 754 Cb 0.52 0.00 0.22 0.00 -1.03 0.00 0.00 41.12 40.83 3g9h n ASP 754 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3g9h n GLY 755 N 0.00 1.89 0.00 6.12 0.00 -1.26 -4.82 105.19 107.12 3g9h n GLY 755 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 3g9h n GLY 755 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g9h n ALA 756 N 0.50 0.00 -2.39 4.61 0.00 -1.26 -3.93 120.51 118.04 3g9h n ALA 756 Ca 0.16 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.42 3g9h n ALA 756 Cb 0.65 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.99 3g9h n ALA 756 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3g9h s ASN 757 N -4.00 2.13 -0.15 0.00 -0.87 -1.26 -5.00 114.94 105.80 3g9h s ASN 757 Ca 0.00 -0.92 0.00 0.00 -1.57 0.00 0.00 52.86 50.38 3g9h s ASN 757 Cb 0.00 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.25 41.15 3g9h s ASN 757 CO 0.00 -0.19 -0.15 0.00 -2.57 0.00 0.00 177.10 174.19 3g9h s ALA 758 N -2.64 2.50 -0.05 0.60 0.00 -1.26 -2.00 121.76 118.91 3g9h s ALA 758 Ca 0.15 -1.00 -0.05 0.00 0.00 0.00 0.00 51.96 51.05 3g9h s ALA 758 Cb -0.02 -1.19 -0.03 0.00 0.00 0.00 0.00 23.12 21.88 3g9h s ALA 758 CO 0.04 0.06 0.26 1.15 0.00 0.00 0.00 175.76 177.26 3g9h h THR 759 N 5.61 0.00 -4.49 0.00 2.02 0.46 -3.48 112.91 113.03 3g9h h THR 759 Ca -0.30 -0.61 -0.43 0.00 0.77 0.00 0.00 66.41 65.84 3g9h h THR 759 Cb 1.20 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 67.51 3g9h h THR 759 CO 0.56 0.00 -0.39 -0.24 0.37 0.00 0.00 175.52 175.82 3g9h n SER 760 N -4.18 0.45 0.00 4.18 2.88 -1.24 -4.99 113.62 110.71 3g9h n SER 760 Ca -0.02 -2.81 0.00 0.00 -1.33 0.00 0.00 58.87 54.71 3g9h n SER 760 Cb 0.07 1.08 0.00 0.00 -0.75 0.00 0.00 64.21 64.61 3g9h n SER 760 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3g9h n ALA 761 N -1.27 0.00 -2.71 -1.46 0.00 -1.26 0.33 120.51 114.13 3g9h n ALA 761 Ca -0.12 0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.14 3g9h n ALA 761 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.83 3g9h n ALA 761 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3g9h s LEU 762 N 0.00 2.23 0.85 0.00 1.02 -1.13 -4.65 118.68 117.00 3g9h s LEU 762 Ca 0.00 -0.53 -0.11 0.00 0.02 0.00 0.00 54.13 53.51 3g9h s LEU 762 Cb 0.00 -0.48 0.14 0.00 0.02 0.00 0.00 46.19 45.87 3g9h s LEU 762 CO 0.00 -0.05 1.19 -0.94 0.02 0.00 0.00 176.35 176.57 3g9h s SER 763 N -1.44 3.90 -0.09 2.29 1.04 -1.26 -2.95 113.70 115.20 3g9h s SER 763 Ca -0.02 0.33 -0.02 0.00 0.48 0.00 0.00 55.95 56.72 3g9h s SER 763 Cb -0.09 -0.63 -0.01 0.00 0.10 0.00 0.00 66.02 65.39 3g9h s SER 763 CO 0.01 -2.22 -0.05 0.50 0.98 0.00 0.00 173.24 172.46 3g9h h LYS 764 N -1.17 0.00 0.00 4.02 3.11 0.13 -3.46 116.57 119.20 3g9h h LYS 764 Ca -0.44 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.40 3g9h h LYS 764 Cb 1.28 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.51 3g9h h LYS 764 CO 0.49 0.00 0.00 -0.35 -2.81 0.00 0.00 179.45 176.78 3g9h n PRO 765 N -4.29 0.00 0.00 1.90 -0.04 -1.26 -4.95 135.00 126.35 3g9h n PRO 765 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 3g9h n PRO 765 Cb 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.53 3g9h n PRO 765 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3g9h n GLN 766 N 0.00 0.00 0.00 0.54 6.02 -1.26 -5.11 117.38 117.57 3g9h n GLN 766 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3g9h n GLN 766 Cb 0.00 -0.05 0.00 0.00 1.02 0.00 0.00 30.24 31.21 3g9h n GLN 766 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3g9h n GLY 767 N 2.82 3.21 0.00 1.08 0.00 -1.26 -4.59 105.19 106.45 3g9h n GLY 767 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 3g9h n GLY 767 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3g9h n SER 768 N 0.00 0.00 -4.78 1.61 2.88 -1.26 -4.86 113.62 107.21 3g9h n SER 768 Ca 0.00 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.15 3g9h n SER 768 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 3g9h n SER 768 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 3g9h s PHE 769 N 0.00 3.85 -0.63 0.66 5.36 -1.26 -1.32 117.98 124.65 3g9h s PHE 769 Ca 0.00 1.70 0.04 0.00 -0.96 0.00 0.00 56.93 57.72 3g9h s PHE 769 Cb 0.00 -2.83 0.34 0.00 -0.34 0.00 0.00 43.02 40.19 3g9h s PHE 769 CO 0.00 0.42 1.08 -1.13 -1.46 0.00 0.00 175.22 174.13 3g9h n SER 770 N 1.24 4.89 0.00 6.13 3.41 0.03 -4.99 113.62 124.33 3g9h n SER 770 Ca -0.03 -3.69 0.00 0.00 -0.26 0.00 0.00 58.87 54.89 3g9h n SER 770 Cb 0.49 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 3g9h n SER 770 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3g9h n LYS 771 N -0.25 0.00 0.00 4.33 2.85 -1.26 -2.15 118.16 121.68 3g9h n LYS 771 Ca 0.34 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.60 3g9h n LYS 771 Cb 0.39 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.77 3g9h n LYS 771 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 3g9h n GLU 772 N 0.00 0.00 -1.54 -1.58 0.28 -1.26 -3.99 120.64 112.55 3g9h n GLU 772 Ca 0.00 0.24 -0.39 0.00 -0.16 0.00 0.00 57.16 56.85 3g9h n GLU 772 Cb 0.00 -0.96 -0.05 0.00 1.43 0.00 0.00 31.44 31.85 3g9h n GLU 772 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 3g9h n LYS 773 N -0.70 0.97 -1.54 3.44 4.76 -0.92 -4.75 118.16 119.43 3g9h n LYS 773 Ca 0.00 0.07 -0.13 0.00 -2.87 0.00 0.00 58.31 55.38 3g9h n LYS 773 Cb 0.00 -3.05 -0.09 0.00 -1.84 0.00 0.00 35.03 30.04 3g9h n LYS 773 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 3g9h n LYS 774 N 8.84 0.34 -3.76 1.97 0.00 -1.26 -4.27 118.16 120.02 3g9h n LYS 774 Ca 0.41 -1.06 -0.13 0.00 -0.00 0.00 0.00 58.31 57.53 3g9h n LYS 774 Cb 0.43 -3.51 -0.11 0.00 -0.00 0.00 0.00 35.03 31.85 3g9h n LYS 774 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 3g9h s ARG 775 N 8.53 0.39 -0.16 -1.58 3.52 -1.26 -2.97 118.95 125.42 3g9h s ARG 775 Ca 0.88 0.41 -0.03 0.00 -0.13 0.00 0.00 55.73 56.86 3g9h s ARG 775 Cb -0.14 0.19 -0.02 0.00 -1.56 0.00 0.00 34.95 33.41 3g9h s ARG 775 CO 0.15 -0.05 -0.06 0.42 -0.81 0.00 0.00 175.30 174.94 3g9h s ILE 776 N 0.09 3.61 -0.23 4.11 -1.09 -0.29 -0.79 121.20 126.60 3g9h s ILE 776 Ca -0.01 -0.45 0.02 0.00 -2.23 0.00 0.00 60.65 57.98 3g9h s ILE 776 Cb -0.02 -2.58 0.05 0.00 -1.58 0.00 0.00 42.46 38.33 3g9h s ILE 776 CO 0.01 0.49 -0.12 -0.89 -1.23 0.00 0.00 174.94 173.19 3g9h s THR 777 N 0.53 2.00 -0.08 2.92 2.01 -0.43 -1.15 115.64 121.44 3g9h s THR 777 Ca -0.05 -1.34 -0.15 0.00 0.31 0.00 0.00 61.69 60.47 3g9h s THR 777 Cb -0.15 -2.05 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 3g9h s THR 777 CO 0.03 0.13 0.37 0.26 -0.69 0.00 0.00 174.62 174.71 3g9h s TRP 778 N 1.22 3.59 -0.27 4.92 0.51 0.22 -4.24 118.94 124.89 3g9h s TRP 778 Ca -0.04 0.81 -0.02 0.00 -2.12 0.00 0.00 56.10 54.73 3g9h s TRP 778 Cb -0.18 -2.33 0.09 0.00 -0.81 0.00 0.00 33.47 30.24 3g9h s TRP 778 CO -0.07 0.43 0.09 0.50 -0.51 0.00 0.00 176.95 177.38 3g9h s ARG 779 N -0.26 0.56 0.23 4.98 3.52 -1.26 -0.60 118.95 126.12 3g9h s ARG 779 Ca 0.21 -0.73 -0.30 0.00 -0.13 0.00 0.00 55.73 54.79 3g9h s ARG 779 Cb -0.15 -1.82 -0.09 0.00 -1.56 0.00 0.00 34.95 31.33 3g9h s ARG 779 CO 0.09 -0.88 0.96 -0.06 -0.81 0.00 0.00 175.30 174.59 3g9h s PHE 780 N 1.82 3.93 -0.19 5.12 0.40 -0.80 -4.96 117.98 123.30 3g9h s PHE 780 Ca 0.06 1.88 0.22 0.00 -0.60 0.00 0.00 56.93 58.50 3g9h s PHE 780 Cb -0.17 -3.02 -0.25 0.00 0.51 0.00 0.00 43.02 40.09 3g9h s PHE 780 CO -0.22 0.34 0.64 0.36 0.70 0.00 0.00 175.22 177.03 3g9h n LYS 781 N 1.62 0.57 -4.31 0.44 2.85 -1.26 -4.30 118.16 113.76 3g9h n LYS 781 Ca -0.01 -0.12 -0.30 0.00 -1.05 0.00 0.00 58.31 56.82 3g9h n LYS 781 Cb 0.47 -1.57 -0.10 0.00 -0.65 0.00 0.00 35.03 33.18 3g9h n LYS 781 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 3g9h s GLU 782 N -3.43 2.15 0.36 -1.58 2.02 -1.26 -4.90 118.70 112.06 3g9h s GLU 782 Ca -0.05 -0.99 -0.27 0.00 0.02 0.00 0.00 54.97 53.68 3g9h s GLU 782 Cb 0.14 -2.30 -0.12 0.00 0.10 0.00 0.00 34.13 31.94 3g9h s GLU 782 CO 0.88 0.52 1.27 -0.35 0.02 0.00 0.00 175.26 177.61 3g9h n PRO 783 N 0.91 2.06 -3.66 0.39 -0.04 -1.26 -4.76 135.00 128.64 3g9h n PRO 783 Ca -0.14 0.72 -0.38 0.00 -0.04 0.00 0.00 63.50 63.66 3g9h n PRO 783 Cb 0.52 -2.32 -0.12 0.00 -0.04 0.00 0.00 33.50 31.55 3g9h n PRO 783 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3g9h s VAL 784 N -1.12 4.69 -0.56 0.52 1.01 0.39 -4.96 120.40 120.37 3g9h s VAL 784 Ca 0.57 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 62.13 3g9h s VAL 784 Cb -0.56 -3.33 0.14 0.00 0.00 0.00 0.00 36.38 32.62 3g9h s VAL 784 CO 0.61 0.14 0.51 -0.69 0.00 0.00 0.00 175.10 175.67 3g9h s VAL 785 N 1.64 5.12 0.07 2.92 1.01 -1.26 -0.88 120.40 129.02 3g9h s VAL 785 Ca 0.05 -1.64 -0.17 0.00 0.00 0.00 0.00 61.98 60.23 3g9h s VAL 785 Cb -0.17 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 31.87 3g9h s VAL 785 CO 0.07 -0.87 0.52 -0.76 0.00 0.00 0.00 175.10 174.05 3g9h s LEU 786 N 1.42 4.47 0.23 3.92 1.43 -0.42 -4.95 118.68 124.78 3g9h s LEU 786 Ca 0.05 1.13 0.10 0.00 -1.03 0.00 0.00 54.13 54.38 3g9h s LEU 786 Cb -0.28 -2.90 -0.05 0.00 0.03 0.00 0.00 46.19 43.00 3g9h s LEU 786 CO 0.01 0.25 -0.17 0.42 0.23 0.00 0.00 176.35 177.09 3g9h s THR 787 N -1.19 2.07 0.25 5.49 -4.23 -1.26 -0.72 115.64 116.05 3g9h s THR 787 Ca 0.30 -2.27 -0.09 0.00 -1.18 0.00 0.00 61.69 58.44 3g9h s THR 787 Cb -0.18 -2.14 0.35 0.00 1.34 0.00 0.00 72.50 71.88 3g9h s THR 787 CO 0.18 -0.49 1.59 -0.09 -0.54 0.00 0.00 174.62 175.27 3g9h h ARG 788 N 2.50 0.01 -0.18 3.99 9.65 0.67 -1.45 114.38 129.57 3g9h h ARG 788 Ca -0.39 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.49 3g9h h ARG 788 Cb 1.24 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.81 3g9h h ARG 788 CO 0.60 0.01 0.00 0.09 2.80 0.00 0.00 179.97 183.47 3g9h n ASN 789 N -5.51 3.11 -4.24 -3.80 3.02 -1.26 -4.87 115.26 101.71 3g9h n ASN 789 Ca 0.13 -2.75 -0.29 0.00 -0.03 0.00 0.00 54.58 51.65 3g9h n ASN 789 Cb 0.46 -0.40 0.26 0.00 -0.61 0.00 0.00 39.78 39.49 3g9h n ASN 789 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 3g9h s GLY 790 N -1.92 1.51 0.12 7.41 0.00 -0.55 -4.94 107.32 108.95 3g9h s GLY 790 Ca 0.32 -0.34 0.25 0.00 0.00 0.00 0.00 44.72 44.95 3g9h s GLY 790 CO 0.08 0.46 1.50 -2.21 0.00 0.00 0.00 173.10 172.93 3g9h n GLU 791 N -5.10 0.23 -0.67 2.90 4.07 -1.26 -4.94 120.64 115.87 3g9h n GLU 791 Ca 0.05 0.11 0.08 0.00 -0.06 0.00 0.00 57.16 57.34 3g9h n GLU 791 Cb 0.56 -1.69 -0.04 0.00 -0.06 0.00 0.00 31.44 30.22 3g9h n GLU 791 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3g9h n GLY 792 N 1.36 -2.57 3.72 8.31 0.00 -1.26 -4.80 105.19 109.95 3g9h n GLY 792 Ca 0.04 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.39 3g9h n GLY 792 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3g9h s GLN 793 N -3.01 4.35 -0.13 1.61 -1.52 0.29 -4.84 119.66 116.40 3g9h s GLN 793 Ca 0.00 0.52 -0.03 0.00 -1.95 0.00 0.00 55.36 53.89 3g9h s GLN 793 Cb 0.00 -3.43 -0.03 0.00 -0.22 0.00 0.00 33.01 29.32 3g9h s GLN 793 CO 0.00 0.15 -0.01 0.50 -0.25 0.00 0.00 175.29 175.69 3g9h s ARG 794 N 0.61 3.41 -0.02 2.91 3.52 -1.26 -1.01 118.95 127.12 3g9h s ARG 794 Ca 0.28 -0.45 0.05 0.00 -0.13 0.00 0.00 55.73 55.48 3g9h s ARG 794 Cb -0.16 -2.90 -0.01 0.00 -1.56 0.00 0.00 34.95 30.33 3g9h s ARG 794 CO 0.12 0.45 -0.17 -0.51 -0.81 0.00 0.00 175.30 174.37 3g9h s LEU 795 N -0.18 2.02 -0.01 -0.88 1.43 0.19 -4.79 118.68 116.47 3g9h s LEU 795 Ca 0.04 -0.32 0.05 0.00 -1.03 0.00 0.00 54.13 52.88 3g9h s LEU 795 Cb -0.13 -0.90 -0.01 0.00 0.03 0.00 0.00 46.19 45.18 3g9h s LEU 795 CO 0.02 0.21 -0.17 -0.63 0.23 0.00 0.00 176.35 176.00 3g9h s ILE 796 N -0.35 1.37 -0.17 -0.59 -1.09 -1.26 0.92 121.20 120.02 3g9h s ILE 796 Ca 0.05 -0.78 -0.12 0.00 -2.23 0.00 0.00 60.65 57.57 3g9h s ILE 796 Cb -0.07 -1.14 0.05 0.00 -1.58 0.00 0.00 42.46 39.71 3g9h s ILE 796 CO -0.00 0.35 0.43 0.00 -1.23 0.00 0.00 174.94 174.49 3g9h s ALA 797 N -0.45 -1.08 -0.14 9.38 0.00 -0.84 0.17 121.76 128.80 3g9h s ALA 797 Ca 0.06 1.40 0.02 0.00 0.00 0.00 0.00 51.96 53.45 3g9h s ALA 797 Cb -0.07 -0.84 0.01 0.00 0.00 0.00 0.00 23.12 22.23 3g9h s ALA 797 CO -0.00 -0.24 -0.21 0.50 0.00 0.00 0.00 175.76 175.80 3g9h s ARG 798 N 0.84 3.04 -0.14 0.00 6.06 -1.15 -1.08 118.95 126.51 3g9h s ARG 798 Ca -0.05 -0.84 -0.08 0.00 -2.50 0.00 0.00 55.73 52.26 3g9h s ARG 798 Cb -0.06 -2.46 -0.04 0.00 0.06 0.00 0.00 34.95 32.45 3g9h s ARG 798 CO -0.06 -0.02 0.13 -0.06 -2.50 0.00 0.00 175.30 172.79 3g9h s PHE 799 N 0.83 3.53 -0.79 5.12 0.40 0.15 -2.82 117.98 124.41 3g9h s PHE 799 Ca -0.06 0.46 -0.17 0.00 -0.60 0.00 0.00 56.93 56.55 3g9h s PHE 799 Cb -0.15 -1.99 0.15 0.00 0.51 0.00 0.00 43.02 41.54 3g9h s PHE 799 CO -0.02 0.61 0.87 0.42 0.70 0.00 0.00 175.22 177.79 3g9h s ILE 800 N -0.65 5.05 0.24 0.64 -1.09 0.15 -1.39 121.20 124.15 3g9h s ILE 800 Ca 0.13 -1.69 0.06 0.00 -2.23 0.00 0.00 60.65 56.92 3g9h s ILE 800 Cb -0.12 -4.58 -0.03 0.00 -1.58 0.00 0.00 42.46 36.15 3g9h s ILE 800 CO 0.02 -1.22 0.30 0.42 -1.23 0.00 0.00 174.94 173.23 3g9h s THR 801 N 1.85 4.99 -0.46 2.92 -4.23 0.97 0.11 115.64 121.78 3g9h s THR 801 Ca 0.21 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.63 3g9h s THR 801 Cb -0.13 -3.71 0.46 0.00 1.34 0.00 0.00 72.50 70.46 3g9h s THR 801 CO -0.04 -0.33 1.58 -0.90 -0.54 0.00 0.00 174.62 174.39 3g9h n ASP 802 N -1.31 6.20 0.00 3.99 5.68 -0.84 -4.02 116.55 126.24 3g9h n ASP 802 Ca -0.09 -3.77 0.00 0.00 -0.50 0.00 0.00 54.79 50.44 3g9h n ASP 802 Cb 0.57 -0.63 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 3g9h n ASP 802 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3g9h n GLY 803 N -0.81 3.26 3.53 6.12 0.00 -1.11 -4.80 105.19 111.37 3g9h n GLY 803 Ca 0.53 -0.22 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 3g9h n GLY 803 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3g9h n LEU 804 N 0.00 1.62 -4.94 0.99 0.00 -1.21 -4.53 117.00 108.94 3g9h n LEU 804 Ca 0.00 -0.22 -0.27 0.00 0.00 0.00 0.00 56.01 55.52 3g9h n LEU 804 Cb 0.00 -1.34 0.10 0.00 0.00 0.00 0.00 43.42 42.18 3g9h n LEU 804 CO 0.00 -1.24 0.67 0.00 0.00 0.00 0.00 177.39 176.83 3g9h s ALA 805 N 10.87 3.01 0.13 1.96 0.00 -1.25 -4.64 121.76 131.83 3g9h s ALA 805 Ca 1.12 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 51.98 3g9h s ALA 805 Cb -0.58 -2.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 3g9h s ALA 805 CO 0.35 -1.60 0.01 -3.38 0.00 0.00 0.00 175.76 171.14 3g9h s HIS 806 N -3.39 0.92 0.38 0.00 -3.43 -1.26 -4.75 115.29 103.75 3g9h s HIS 806 Ca 0.64 -1.10 -0.28 0.00 -0.80 0.00 0.00 55.06 53.52 3g9h s HIS 806 Cb -0.08 -0.54 -0.11 0.00 -1.43 0.00 0.00 32.58 30.42 3g9h s HIS 806 CO 0.47 -0.36 1.47 -1.91 -2.00 0.00 0.00 174.74 172.41 3g9h n GLU 807 N -0.10 2.62 -0.58 -0.38 2.13 -1.26 -2.76 120.64 120.31 3g9h n GLU 807 Ca -0.08 0.92 -0.29 0.00 0.66 0.00 0.00 57.16 58.37 3g9h n GLU 807 Cb 0.63 -2.65 0.24 0.00 0.27 0.00 0.00 31.44 29.93 3g9h n GLU 807 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 3g9h s SER 808 N -0.16 1.25 0.14 4.31 0.15 -1.18 -4.81 113.70 113.40 3g9h s SER 808 Ca 0.54 1.60 -0.13 0.00 0.70 0.00 0.00 55.95 58.66 3g9h s SER 808 Cb -0.48 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.50 3g9h s SER 808 CO 0.63 -4.05 1.57 0.00 1.20 0.00 0.00 173.24 172.60 3g9h h ALA 809 N -2.52 0.63 0.00 5.45 0.00 -1.93 -3.14 119.26 117.75 3g9h h ALA 809 Ca -0.59 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.02 3g9h h ALA 809 Cb 1.32 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3g9h h ALA 809 CO 0.49 0.47 -0.82 0.36 0.00 0.00 0.00 179.25 179.76 3g9h n LYS 810 N -4.31 0.01 0.00 0.00 2.85 -1.26 -5.03 118.16 110.41 3g9h n LYS 810 Ca 0.00 -0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 3g9h n LYS 810 Cb 0.34 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.22 3g9h n LYS 810 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3g9h n GLY 811 N 1.50 3.25 3.70 2.58 0.00 -1.19 -4.28 105.19 110.75 3g9h n GLY 811 Ca 0.05 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 3g9h n GLY 811 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3g9h s VAL 812 N 0.00 4.66 -0.15 1.61 1.01 -0.77 -4.40 120.40 122.36 3g9h s VAL 812 Ca 0.00 1.92 -0.03 0.00 0.00 0.00 0.00 61.98 63.87 3g9h s VAL 812 Cb 0.00 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.12 3g9h s VAL 812 CO 0.00 0.08 -0.05 -0.63 0.00 0.00 0.00 175.10 174.50 3g9h s ILE 813 N 1.51 3.76 -0.10 2.22 -1.09 -0.36 -1.78 121.20 125.36 3g9h s ILE 813 Ca 0.52 -0.41 0.03 0.00 -2.23 0.00 0.00 60.65 58.56 3g9h s ILE 813 Cb -0.22 -2.64 0.01 0.00 -1.58 0.00 0.00 42.46 38.03 3g9h s ILE 813 CO 0.24 0.50 -0.19 0.42 -1.23 0.00 0.00 174.94 174.68 3g9h s THR 814 N 0.35 1.68 -0.10 2.92 -4.23 -0.59 -1.19 115.64 114.48 3g9h s THR 814 Ca -0.05 -0.78 0.03 0.00 -1.18 0.00 0.00 61.69 59.70 3g9h s THR 814 Cb -0.14 -1.48 -0.01 0.00 1.34 0.00 0.00 72.50 72.20 3g9h s THR 814 CO 0.03 0.48 -0.20 -0.54 -0.54 0.00 0.00 174.62 173.85 3g9h s LYS 815 N 0.62 3.07 0.01 3.99 1.02 -0.19 -4.28 119.74 123.97 3g9h s LYS 815 Ca -0.14 -0.80 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 3g9h s LYS 815 Cb -0.16 -2.40 0.10 0.00 -0.52 0.00 0.00 37.83 34.84 3g9h s LYS 815 CO 0.04 0.25 1.02 -0.59 -0.92 0.00 0.00 175.35 175.15 3g9h s PHE 816 N 0.21 -0.20 0.13 3.18 -0.12 -1.26 -0.31 117.98 119.60 3g9h s PHE 816 Ca -0.12 0.03 0.07 0.00 -0.05 0.00 0.00 56.93 56.85 3g9h s PHE 816 Cb -0.16 0.57 -0.04 0.00 -0.63 0.00 0.00 43.02 42.75 3g9h s PHE 816 CO 0.07 -0.54 -0.04 0.99 -0.05 0.00 0.00 175.22 175.65 3g9h s THR 817 N -2.96 3.64 -0.25 -4.49 2.01 0.15 -1.60 115.64 112.14 3g9h s THR 817 Ca 0.09 -1.27 -0.02 0.00 0.31 0.00 0.00 61.69 60.80 3g9h s THR 817 Cb -0.00 -2.76 0.02 0.00 0.01 0.00 0.00 72.50 69.77 3g9h s THR 817 CO -0.04 0.03 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.25 3g9h s ILE 818 N -1.43 3.06 0.38 1.82 1.01 -0.18 -0.08 121.20 125.78 3g9h s ILE 818 Ca 0.25 -0.94 -0.26 0.00 0.00 0.00 0.00 60.65 59.70 3g9h s ILE 818 Cb -0.11 -2.54 -0.11 0.00 0.01 0.00 0.00 42.46 39.71 3g9h s ILE 818 CO 0.17 0.20 1.19 -1.20 0.00 0.00 0.00 174.94 175.30 3g9h n SER 819 N 4.71 2.20 -4.74 3.58 7.64 -0.97 -4.40 113.62 121.65 3g9h n SER 819 Ca -0.16 1.13 -0.40 0.00 1.01 0.00 0.00 58.87 60.45 3g9h n SER 819 Cb 0.47 -1.44 -0.05 0.00 -1.01 0.00 0.00 64.21 62.18 3g9h n SER 819 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 3g9h s GLU 820 N -1.99 4.49 0.42 1.43 2.12 -1.26 -4.52 118.70 119.39 3g9h s GLU 820 Ca 0.59 1.06 0.03 0.00 0.36 0.00 0.00 54.97 57.01 3g9h s GLU 820 Cb -0.56 -3.37 0.08 0.00 0.26 0.00 0.00 34.13 30.54 3g9h s GLU 820 CO 0.59 0.26 0.58 0.25 -0.54 0.00 0.00 175.26 176.40 3g9h n THR 821 N 2.91 0.00 -0.64 -1.70 -2.24 0.31 -4.99 114.28 107.94 3g9h n THR 821 Ca -0.02 -1.12 0.07 0.00 -2.27 0.00 0.00 64.05 60.71 3g9h n THR 821 Cb 0.50 -0.89 0.36 0.00 -2.10 0.00 0.00 70.33 68.20 3g9h n THR 821 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3g9h n ASP 822 N -2.77 5.08 -4.64 3.42 3.85 -1.26 -4.87 116.55 115.35 3g9h n ASP 822 Ca 0.11 -2.73 -0.36 0.00 -0.71 0.00 0.00 54.79 51.10 3g9h n ASP 822 Cb 0.38 -0.64 -0.10 0.00 -1.35 0.00 0.00 41.12 39.41 3g9h n ASP 822 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.20 176.40 3g9h s ASN 823 N -0.75 5.89 0.10 -1.12 3.84 -1.26 -5.01 114.94 116.64 3g9h s ASN 823 Ca 0.49 0.09 -0.16 0.00 0.21 0.00 0.00 52.86 53.49 3g9h s ASN 823 Cb 0.36 -2.04 -0.07 0.00 -0.55 0.00 0.00 41.25 38.95 3g9h s ASN 823 CO 0.17 0.11 1.47 0.58 -2.79 0.00 0.00 177.10 176.64 3g9h h VAL 824 N 4.96 1.29 -0.19 -5.21 2.07 -1.97 -2.49 116.25 114.72 3g9h h VAL 824 Ca -0.38 -1.22 -0.18 0.00 0.82 0.00 0.00 66.70 65.74 3g9h h VAL 824 Cb 1.17 1.43 -0.00 0.00 -1.52 0.00 0.00 31.29 32.37 3g9h h VAL 824 CO 0.68 0.39 -0.61 0.00 0.02 0.00 0.00 177.57 178.05 3g9h h ALA 825 N 0.77 0.57 -2.23 1.67 0.00 -1.95 -3.36 119.26 114.74 3g9h h ALA 825 Ca 0.07 -0.54 -0.58 0.00 0.00 0.00 0.00 54.91 53.86 3g9h h ALA 825 Cb 0.65 -0.07 -0.42 0.00 0.00 0.00 0.00 17.79 17.95 3g9h h ALA 825 CO 0.04 0.70 -0.70 1.28 0.00 0.00 0.00 179.25 180.57 3g9h n LEU 826 N -3.95 3.80 -0.50 0.00 7.99 -1.23 -4.81 117.00 118.30 3g9h n LEU 826 Ca -0.04 -5.53 0.42 0.00 -0.01 0.00 0.00 56.01 50.85 3g9h n LEU 826 Cb 0.65 -0.41 0.70 0.00 -0.11 0.00 0.00 43.42 44.24 3g9h n LEU 826 CO 0.49 2.27 1.27 -0.65 -1.51 0.00 0.00 177.39 179.26 3g9h h PRO 827 N 3.29 0.02 -1.06 3.23 0.11 -1.60 0.38 132.00 136.36 3g9h h PRO 827 Ca 0.14 -0.00 -0.47 0.00 0.11 0.00 0.00 66.00 65.78 3g9h h PRO 827 Cb 0.60 -0.00 -0.41 0.00 0.11 0.00 0.00 31.00 31.29 3g9h h PRO 827 CO 0.78 0.01 -0.92 0.72 -0.21 0.00 0.00 178.00 178.38 3g9h n HIS 828 N -4.62 2.40 -2.99 0.65 8.25 -1.26 0.11 115.22 117.76 3g9h n HIS 828 Ca 0.40 -2.70 -0.21 0.00 -0.26 0.00 0.00 57.72 54.95 3g9h n HIS 828 Cb 1.61 -0.23 0.02 0.00 1.12 0.00 0.00 29.99 32.50 3g9h n HIS 828 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 3g9h n SER 829 N -0.44 -5.23 0.00 0.41 7.64 0.12 -1.36 113.62 114.75 3g9h n SER 829 Ca 0.28 -0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.92 3g9h n SER 829 Cb 0.79 -4.28 0.00 0.00 -1.01 0.00 0.00 64.21 59.71 3g9h n SER 829 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3g9h n GLY 830 N -1.30 0.48 0.11 0.23 0.00 -1.26 -4.89 105.19 98.56 3g9h n GLY 830 Ca -0.10 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 3g9h n GLY 830 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3g9h h ALA 831 N 0.00 0.24 -3.00 4.61 0.00 -1.58 -3.45 119.26 116.07 3g9h h ALA 831 Ca 0.00 -1.05 0.00 0.00 0.00 0.00 0.00 54.91 53.86 3g9h h ALA 831 Cb 0.09 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3g9h h ALA 831 CO 0.00 1.11 0.00 0.41 0.00 0.00 0.00 179.25 180.77 3g9h n GLY 832 N 1.62 1.48 0.17 0.00 0.00 -1.26 -4.83 105.19 102.37 3g9h n GLY 832 Ca -0.14 -1.68 0.10 0.00 0.00 0.00 0.00 46.02 44.30 3g9h n GLY 832 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3g9h h SER 833 N 0.00 0.00 -0.97 1.61 4.64 -1.99 -3.48 113.55 113.35 3g9h h SER 833 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 3g9h h SER 833 Cb 0.00 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.01 3g9h h SER 833 CO 0.00 0.11 -0.27 0.61 -0.87 0.00 0.00 176.83 176.41 3g9h n GLY 834 N 1.16 0.98 3.75 -0.77 0.00 -1.26 -4.90 105.19 104.15 3g9h n GLY 834 Ca 0.02 -0.38 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 3g9h n GLY 834 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3g9h s ILE 835 N -2.54 3.77 0.04 -0.61 -4.36 -1.25 -4.69 121.20 111.55 3g9h s ILE 835 Ca 0.00 1.74 0.05 0.00 -0.26 0.00 0.00 60.65 62.18 3g9h s ILE 835 Cb 0.00 -4.11 -0.02 0.00 1.25 0.00 0.00 42.46 39.58 3g9h s ILE 835 CO 0.00 0.40 -0.14 -0.89 0.24 0.00 0.00 174.94 174.55 3g9h s THR 836 N -1.04 1.14 -0.11 8.37 2.01 -1.12 -4.93 115.64 119.96 3g9h s THR 836 Ca 0.44 -1.05 0.00 0.00 0.31 0.00 0.00 61.69 61.39 3g9h s THR 836 Cb -0.29 -1.04 -0.02 0.00 0.01 0.00 0.00 72.50 71.16 3g9h s THR 836 CO 0.37 -0.02 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.41 3g9h s LEU 837 N -1.22 2.89 0.01 4.42 1.43 -1.26 -0.99 118.68 123.96 3g9h s LEU 837 Ca 0.01 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 3g9h s LEU 837 Cb -0.08 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 3g9h s LEU 837 CO 0.01 0.23 -0.05 0.42 0.23 0.00 0.00 176.35 177.20 3g9h s THR 838 N -0.02 0.34 0.12 5.49 -4.23 -0.81 -0.92 115.64 115.61 3g9h s THR 838 Ca -0.02 -0.44 0.03 0.00 -1.18 0.00 0.00 61.69 60.08 3g9h s THR 838 Cb -0.14 -0.34 -0.04 0.00 1.34 0.00 0.00 72.50 73.32 3g9h s THR 838 CO 0.04 -0.07 -0.09 0.00 -0.54 0.00 0.00 174.62 173.96 3g9h s GLN 840 N -3.57 1.65 0.12 0.00 0.74 0.66 -0.68 119.66 118.58 3g9h s GLN 840 Ca 0.12 -0.35 -0.06 0.00 0.05 0.00 0.00 55.36 55.12 3g9h s GLN 840 Cb 0.02 -1.51 -0.06 0.00 1.10 0.00 0.00 33.01 32.57 3g9h s GLN 840 CO -0.02 -0.11 0.37 -1.21 -0.55 0.00 0.00 175.29 173.78 3g9h s GLU 841 N 1.13 3.65 -0.10 1.67 2.02 -1.26 0.06 118.70 125.87 3g9h s GLU 841 Ca -0.06 -0.02 0.01 0.00 0.02 0.00 0.00 54.97 54.93 3g9h s GLU 841 Cb -0.14 -2.90 -0.02 0.00 0.10 0.00 0.00 34.13 31.17 3g9h s GLU 841 CO -0.02 0.50 -0.14 -0.51 0.02 0.00 0.00 175.26 175.11 3g9h s LEU 842 N -2.41 2.67 0.00 1.80 1.43 0.38 -0.26 118.68 122.28 3g9h s LEU 842 Ca 0.38 -0.30 0.00 0.00 -1.03 0.00 0.00 54.13 53.18 3g9h s LEU 842 Cb -0.13 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.52 3g9h s LEU 842 CO 0.22 0.23 0.00 -0.90 0.23 0.00 0.00 176.35 176.13 3g9h n ASP 843 N 3.11 0.00 -0.29 2.29 5.68 0.30 -3.76 116.55 123.88 3g9h n ASP 843 Ca -0.18 -0.81 0.07 0.00 -0.50 0.00 0.00 54.79 53.37 3g9h n ASP 843 Cb 0.53 0.00 0.22 0.00 -1.14 0.00 0.00 41.12 40.72 3g9h n ASP 843 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3g9h h GLU 844 N 0.00 0.56 -0.23 0.11 3.07 -1.95 0.17 114.58 116.30 3g9h h GLU 844 Ca 0.00 -0.03 -0.14 0.00 -0.50 0.00 0.00 59.36 58.68 3g9h h GLU 844 Cb 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 27.78 3g9h h GLU 844 CO 0.00 0.37 -0.42 -0.91 -1.40 0.00 0.00 179.01 176.65 3g9h h ASN 845 N 0.58 0.77 -2.91 1.42 -0.26 -2.00 -3.39 115.58 109.79 3g9h h ASN 845 Ca 0.45 -0.54 -0.60 0.00 -0.56 0.00 0.00 56.30 55.05 3g9h h ASN 845 Cb 0.66 -0.22 -0.40 0.00 -1.06 0.00 0.00 38.32 37.30 3g9h h ASN 845 CO -0.37 1.16 -0.79 0.20 -1.06 0.00 0.00 177.43 176.56 3g9h s ASN 846 N -6.68 3.10 0.30 5.81 0.01 -0.54 -4.97 114.94 111.97 3g9h s ASN 846 Ca -0.12 -3.08 0.06 0.00 -0.71 0.00 0.00 52.86 49.01 3g9h s ASN 846 Cb 0.08 -0.93 0.78 0.00 0.41 0.00 0.00 41.25 41.59 3g9h s ASN 846 CO 0.84 -0.19 1.74 -0.65 -1.51 0.00 0.00 177.10 177.33 3g9h h PRO 847 N 6.00 0.57 -0.21 -0.60 0.11 -0.92 0.16 132.00 137.10 3g9h h PRO 847 Ca 0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.21 3g9h h PRO 847 Cb 0.88 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.86 3g9h h PRO 847 CO 0.49 0.38 0.00 1.19 -0.21 0.00 0.00 178.00 179.85 3g9h n PHE 848 N -4.89 0.26 0.00 0.65 0.99 -1.26 -4.37 117.46 108.83 3g9h n PHE 848 Ca 0.24 -0.13 0.00 0.00 -0.00 0.00 0.00 57.45 57.56 3g9h n PHE 848 Cb 0.65 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 39.13 3g9h n PHE 848 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3g9h n GLY 849 N 1.36 3.60 0.00 1.37 0.00 0.25 -4.92 105.19 106.85 3g9h n GLY 849 Ca 0.17 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.79 3g9h n GLY 849 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3g9h n GLY 850 N 0.27 1.27 3.75 -0.02 0.00 0.63 -4.86 105.19 106.23 3g9h n GLY 850 Ca 0.00 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 43.97 3g9h n GLY 850 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3g9h s GLU 851 N 1.52 4.76 0.35 1.61 0.41 -1.26 -4.80 118.70 121.28 3g9h s GLU 851 Ca 0.00 1.42 -0.29 0.00 -0.41 0.00 0.00 54.97 55.69 3g9h s GLU 851 Cb 0.00 -3.31 -0.11 0.00 -1.78 0.00 0.00 34.13 28.93 3g9h s GLU 851 CO 0.00 0.42 1.47 -1.58 -0.49 0.00 0.00 175.26 175.08 3g9h s TRP 852 N -0.76 2.72 0.13 1.61 0.52 -1.26 -4.69 118.94 117.21 3g9h s TRP 852 Ca 0.42 1.13 0.04 0.00 0.02 0.00 0.00 56.10 57.71 3g9h s TRP 852 Cb -0.25 -3.96 -0.04 0.00 -1.15 0.00 0.00 33.47 28.07 3g9h s TRP 852 CO 0.30 -2.90 -0.11 -0.51 0.02 0.00 0.00 176.95 173.76 3g9h s LEU 853 N -1.64 2.47 0.27 2.99 1.43 0.14 -4.96 118.68 119.38 3g9h s LEU 853 Ca 0.54 -0.92 -0.24 0.00 -1.03 0.00 0.00 54.13 52.48 3g9h s LEU 853 Cb -0.45 -0.36 -0.09 0.00 0.03 0.00 0.00 46.19 45.31 3g9h s LEU 853 CO 0.57 -0.28 0.85 -1.81 0.23 0.00 0.00 176.35 175.92 3g9h s ASP 854 N -2.83 7.28 -0.17 2.29 1.01 -1.26 -0.60 116.67 122.39 3g9h s ASP 854 Ca 0.12 1.69 -0.17 0.00 0.71 0.00 0.00 52.55 54.89 3g9h s ASP 854 Cb -0.00 -2.52 -0.04 0.00 1.01 0.00 0.00 42.92 41.37 3g9h s ASP 854 CO 0.01 0.01 0.45 -0.69 0.21 0.00 0.00 175.17 175.16 3g9h s VAL 855 N -1.50 5.18 -0.04 -1.27 1.01 -0.10 -4.83 120.40 118.85 3g9h s VAL 855 Ca 0.46 0.85 -0.31 0.00 0.00 0.00 0.00 61.98 62.97 3g9h s VAL 855 Cb -0.19 -3.78 -0.09 0.00 0.00 0.00 0.00 36.38 32.31 3g9h s VAL 855 CO 0.24 0.27 1.99 -3.20 0.00 0.00 0.00 175.10 174.40 3g9h n ASN 856 N 4.16 3.79 -3.94 3.32 5.15 -1.21 -4.81 115.26 121.72 3g9h n ASN 856 Ca -0.07 0.82 -0.25 0.00 -0.60 0.00 0.00 54.58 54.48 3g9h n ASN 856 Cb 0.51 -1.48 -0.17 0.00 -0.53 0.00 0.00 39.78 38.12 3g9h n ASN 856 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3g9h s THR 857 N 4.91 1.01 -0.30 -0.44 2.01 -1.26 -0.25 115.64 121.31 3g9h s THR 857 Ca 0.92 -0.33 -0.11 0.00 0.31 0.00 0.00 61.69 62.48 3g9h s THR 857 Cb -0.51 -0.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.97 3g9h s THR 857 CO 0.44 0.35 0.20 -0.54 -0.69 0.00 0.00 174.62 174.39 3g9h s LYS 858 N 1.31 3.78 0.15 4.92 1.02 -0.79 -4.98 119.74 125.14 3g9h s LYS 858 Ca -0.03 -0.44 0.07 0.00 0.02 0.00 0.00 55.97 55.60 3g9h s LYS 858 Cb -0.14 -3.70 -0.04 0.00 -0.52 0.00 0.00 37.83 33.43 3g9h s LYS 858 CO -0.04 -0.27 -0.16 -0.98 -0.92 0.00 0.00 175.35 172.98 3g9h s ARG 859 N 1.74 1.16 0.00 1.68 1.70 -1.26 -0.90 118.95 123.07 3g9h s ARG 859 Ca 0.07 -1.33 -0.03 0.00 -0.47 0.00 0.00 55.73 53.97 3g9h s ARG 859 Cb -0.16 -1.13 -0.01 0.00 -0.57 0.00 0.00 34.95 33.07 3g9h s ARG 859 CO 0.11 0.23 0.04 0.95 -1.08 0.00 0.00 175.30 175.54 3g9h s THR 860 N -2.10 0.07 -0.19 4.99 -4.23 -0.34 -4.96 115.64 108.88 3g9h s THR 860 Ca 0.13 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 60.03 3g9h s THR 860 Cb -0.05 -0.26 0.06 0.00 1.34 0.00 0.00 72.50 73.59 3g9h s THR 860 CO 0.05 -0.32 0.02 -0.22 -0.54 0.00 0.00 174.62 173.61 3g9h s LEU 861 N -1.00 1.37 0.26 4.79 2.96 -1.26 -1.88 118.68 123.92 3g9h s LEU 861 Ca -0.11 -0.84 0.04 0.00 -0.22 0.00 0.00 54.13 53.00 3g9h s LEU 861 Cb -0.07 -0.68 -0.06 0.00 0.50 0.00 0.00 46.19 45.89 3g9h s LEU 861 CO 0.00 -0.29 0.01 0.42 -1.32 0.00 0.00 176.35 175.17 3g9h s THR 862 N 1.79 1.13 0.25 3.68 -4.23 -0.90 -1.01 115.64 116.34 3g9h s THR 862 Ca -0.01 -2.04 -0.30 0.00 -1.18 0.00 0.00 61.69 58.16 3g9h s THR 862 Cb -0.17 -2.49 -0.09 0.00 1.34 0.00 0.00 72.50 71.09 3g9h s THR 862 CO -0.08 -0.22 1.08 0.42 -0.54 0.00 0.00 174.62 175.28 3g9h s THR 863 N -3.35 3.66 0.00 3.99 -4.23 -0.63 -0.69 115.64 114.38 3g9h s THR 863 Ca 0.31 1.59 0.00 0.00 -1.18 0.00 0.00 61.69 62.42 3g9h s THR 863 Cb 0.06 -4.02 0.00 0.00 1.34 0.00 0.00 72.50 69.89 3g9h s THR 863 CO 0.11 0.35 0.00 0.61 -0.54 0.00 0.00 174.62 175.15 3g9h n GLY 864 N 1.48 0.79 3.01 3.99 0.00 0.17 -4.67 105.19 109.96 3g9h n GLY 864 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3g9h n GLY 864 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3g9h s ASN 865 N -1.00 4.62 -0.19 1.61 0.01 -1.25 -4.97 114.94 113.77 3g9h s ASN 865 Ca 0.00 -1.92 0.01 0.00 -0.71 0.00 0.00 52.86 50.23 3g9h s ASN 865 Cb 0.00 -1.55 0.02 0.00 0.41 0.00 0.00 41.25 40.13 3g9h s ASN 865 CO 0.00 -0.33 -0.17 -0.47 -1.51 0.00 0.00 177.10 174.61 3g9h s TYR 866 N 1.01 2.85 0.17 2.20 5.04 -1.26 -0.91 117.35 126.44 3g9h s TYR 866 Ca 0.06 -1.64 -0.19 0.00 -2.44 0.00 0.00 57.07 52.86 3g9h s TYR 866 Cb -0.19 -1.94 0.04 0.00 0.35 0.00 0.00 41.96 40.22 3g9h s TYR 866 CO -0.08 -0.79 0.53 -3.38 -1.34 0.00 0.00 175.55 170.49 3g9h s HIS 867 N 1.29 -0.29 0.00 4.97 -3.43 -0.65 -1.54 115.29 115.64 3g9h s HIS 867 Ca 0.04 -0.00 0.02 0.00 -0.80 0.00 0.00 55.06 54.31 3g9h s HIS 867 Cb -0.14 0.43 -0.01 0.00 -1.43 0.00 0.00 32.58 31.44 3g9h s HIS 867 CO -0.11 -0.85 -0.05 0.20 -2.00 0.00 0.00 174.74 171.93 3g9h s GLY 868 N -2.81 0.27 0.28 -1.38 0.00 -0.73 -0.79 107.32 102.16 3g9h s GLY 868 Ca 0.05 -0.30 0.09 0.00 0.00 0.00 0.00 44.72 44.56 3g9h s GLY 868 CO -0.08 -0.28 0.01 1.08 0.00 0.00 0.00 173.10 173.82 3g9h s LEU 869 N -0.38 3.18 0.00 0.66 1.02 0.26 -1.85 118.68 121.58 3g9h s LEU 869 Ca -0.00 -0.69 0.32 0.00 0.02 0.00 0.00 54.13 53.78 3g9h s LEU 869 Cb -0.03 -1.68 1.88 0.00 0.02 0.00 0.00 46.19 46.37 3g9h s LEU 869 CO -0.00 -0.04 2.21 0.00 0.02 0.00 0.00 176.35 178.54