#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qon s PHE 596 N 0.00 2.42 0.00 1.09 5.36 0.13 -5.05 117.98 121.94 2qon s PHE 596 Ca 0.00 0.66 0.00 0.00 -0.96 0.00 0.00 56.93 56.63 2qon s PHE 596 Cb 0.00 -3.77 0.00 0.00 -0.34 0.00 0.00 43.02 38.91 2qon s PHE 596 CO 0.00 -2.57 0.00 0.28 -1.46 0.00 0.00 175.22 171.47 2qon n VAL 597 N 5.72 0.00 -1.40 3.12 0.31 -1.26 -4.94 118.33 119.88 2qon n VAL 597 Ca 0.16 0.00 -0.39 0.00 -0.01 0.00 0.00 64.34 64.10 2qon n VAL 597 Cb 0.45 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.40 2qon n VAL 597 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2qon n THR 608 N 0.00 1.53 -3.80 2.52 -1.04 -1.26 -5.01 114.28 107.23 2qon n THR 608 Ca 0.00 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.05 61.22 2qon n THR 608 Cb 0.00 -0.46 -0.13 0.00 -1.82 0.00 0.00 70.33 67.92 2qon n THR 608 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2qon s VAL 609 N -1.79 1.98 -2.01 12.58 1.01 -1.26 -4.70 120.40 126.21 2qon s VAL 609 Ca 0.65 -3.12 0.10 0.00 0.00 0.00 0.00 61.98 59.60 2qon s VAL 609 Cb -0.47 -2.36 0.28 0.00 0.00 0.00 0.00 36.38 33.83 2qon s VAL 609 CO 0.58 -0.91 1.37 1.41 0.00 0.00 0.00 175.10 177.55 2qon n HIS 610 N 3.07 0.03 -0.07 5.22 8.25 -1.26 -3.75 115.22 126.70 2qon n HIS 610 Ca 0.11 -0.01 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 2qon n HIS 610 Cb 0.35 0.00 0.30 0.00 1.12 0.00 0.00 29.99 31.75 2qon n HIS 610 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2qon h GLU 611 N 0.16 0.67 0.00 -0.41 4.81 -1.99 -3.32 114.58 114.51 2qon h GLU 611 Ca 0.00 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2qon h GLU 611 Cb 0.04 -0.12 0.00 0.00 0.63 0.00 0.00 28.75 29.29 2qon h GLU 611 CO 0.00 0.56 -0.03 1.19 -0.73 0.00 0.00 179.01 180.00 2qon n PHE 612 N -4.35 0.00 -3.73 0.92 3.72 -1.25 -5.02 117.46 107.76 2qon n PHE 612 Ca 0.04 -0.52 -0.16 0.00 -0.05 0.00 0.00 57.45 56.76 2qon n PHE 612 Cb 0.16 -0.07 -0.16 0.00 -0.94 0.00 0.00 39.48 38.47 2qon n PHE 612 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2qon s ALA 613 N -1.25 -0.07 0.24 4.37 0.00 -1.25 -4.36 121.76 119.44 2qon s ALA 613 Ca 0.08 0.48 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 2qon s ALA 613 Cb 0.07 -0.49 -0.09 0.00 0.00 0.00 0.00 23.12 22.61 2qon s ALA 613 CO 0.01 -0.27 1.22 0.21 0.00 0.00 0.00 175.76 176.93 2qon s LYS 614 N 1.50 4.48 -0.29 0.00 2.20 -1.26 -4.57 119.74 121.80 2qon s LYS 614 Ca -0.05 1.96 -0.26 0.00 -0.36 0.00 0.00 55.97 57.26 2qon s LYS 614 Cb -0.12 -3.18 0.01 0.00 -1.51 0.00 0.00 37.83 33.02 2qon s LYS 614 CO -0.05 -0.06 0.93 -2.00 -0.36 0.00 0.00 175.35 173.82 2qon s GLU 615 N -0.84 4.06 0.21 4.03 2.56 -1.26 -0.33 118.70 127.13 2qon s GLU 615 Ca 0.51 0.91 -0.09 0.00 0.00 0.00 0.00 54.97 56.29 2qon s GLU 615 Cb -0.35 -3.71 -0.07 0.00 2.00 0.00 0.00 34.13 32.00 2qon s GLU 615 CO 0.41 -0.74 0.52 -0.51 -0.56 0.00 0.00 175.26 174.38 2qon s LEU 616 N 3.24 4.19 -0.22 2.70 1.43 0.56 -4.93 118.68 125.65 2qon s LEU 616 Ca 0.39 0.87 -0.25 0.00 -1.03 0.00 0.00 54.13 54.12 2qon s LEU 616 Cb -0.14 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.48 2qon s LEU 616 CO 0.12 -0.04 0.83 -0.62 0.23 0.00 0.00 176.35 176.87 2qon s ASP 617 N -2.33 6.86 0.65 2.29 -1.08 -1.26 -4.65 116.67 117.16 2qon s ASP 617 Ca 0.46 1.07 0.38 0.00 -0.52 0.00 0.00 52.55 53.94 2qon s ASP 617 Cb -0.12 -2.44 2.11 0.00 -1.46 0.00 0.00 42.92 41.02 2qon s ASP 617 CO 0.22 -0.49 2.23 0.00 0.52 0.00 0.00 175.17 177.65 2qon h ALA 618 N 7.59 1.22 0.00 3.66 0.00 -1.96 -0.26 119.26 129.50 2qon h ALA 618 Ca -0.25 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2qon h ALA 618 Cb 1.10 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2qon h ALA 618 CO 0.86 -0.11 -0.07 1.79 0.00 0.00 0.00 179.25 181.72 2qon h THR 619 N 0.00 0.31 -0.01 0.00 1.35 -2.02 -2.36 112.91 110.18 2qon h THR 619 Ca 0.01 -0.43 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 2qon h THR 619 Cb 0.22 1.32 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 2qon h THR 619 CO -0.00 0.07 -0.08 0.59 -0.25 0.00 0.00 175.52 175.85 2qon n ASN 620 N -3.38 0.98 -4.48 5.36 5.03 -0.11 -4.87 115.26 113.79 2qon n ASN 620 Ca -0.01 -1.11 -0.33 0.00 0.87 0.00 0.00 54.58 54.00 2qon n ASN 620 Cb 0.22 0.01 -0.13 0.00 -1.02 0.00 0.00 39.78 38.87 2qon n ASN 620 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2qon s ILE 621 N -2.21 3.53 -0.02 2.41 1.01 -0.89 -0.59 121.20 124.44 2qon s ILE 621 Ca 0.34 -0.51 0.02 0.00 0.00 0.00 0.00 60.65 60.51 2qon s ILE 621 Cb 0.21 -2.49 0.00 0.00 0.01 0.00 0.00 42.46 40.18 2qon s ILE 621 CO 0.41 0.53 -0.07 -0.94 0.00 0.00 0.00 174.94 174.87 2qon s SER 622 N 0.01 0.93 -0.23 3.58 1.04 -0.56 -4.99 113.70 113.48 2qon s SER 622 Ca -0.02 -0.14 -0.11 0.00 0.48 0.00 0.00 55.95 56.16 2qon s SER 622 Cb -0.14 -0.19 -0.05 0.00 0.10 0.00 0.00 66.02 65.74 2qon s SER 622 CO 0.03 0.06 0.20 -0.63 0.98 0.00 0.00 173.24 173.89 2qon s ILE 623 N 0.08 5.34 -0.02 -1.02 1.01 -1.26 -1.30 121.20 124.02 2qon s ILE 623 Ca -0.01 0.28 0.11 0.00 0.00 0.00 0.00 60.65 61.04 2qon s ILE 623 Cb -0.06 -3.54 -0.18 0.00 0.01 0.00 0.00 42.46 38.70 2qon s ILE 623 CO -0.00 0.34 0.24 0.47 0.00 0.00 0.00 174.94 175.99 2qon n ASP 624 N 4.23 2.35 -3.52 3.58 8.00 0.00 -4.96 116.55 126.24 2qon n ASP 624 Ca -0.14 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.36 2qon n ASP 624 Cb 0.52 1.47 -0.05 0.00 -0.02 0.00 0.00 41.12 43.04 2qon n ASP 624 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2qon s LYS 625 N -2.76 0.33 -0.13 -1.24 2.20 -1.09 -5.00 119.74 112.05 2qon s LYS 625 Ca -0.04 0.71 -0.20 0.00 -0.36 0.00 0.00 55.97 56.08 2qon s LYS 625 Cb 0.07 0.28 -0.04 0.00 -1.51 0.00 0.00 37.83 36.64 2qon s LYS 625 CO 0.48 -0.09 0.54 0.08 -0.36 0.00 0.00 175.35 176.00 2qon s VAL 626 N 1.96 5.13 -0.10 4.02 1.01 -1.26 -0.37 120.40 130.79 2qon s VAL 626 Ca -0.06 1.08 -0.05 0.00 0.00 0.00 0.00 61.98 62.95 2qon s VAL 626 Cb -0.05 -3.88 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 2qon s VAL 626 CO -0.16 0.27 -0.10 0.58 0.00 0.00 0.00 175.10 175.69 2qon h VAL 627 N 4.83 0.00 0.00 2.92 2.07 -1.39 -3.48 116.25 121.19 2qon h VAL 627 Ca -0.39 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.37 2qon h VAL 627 Cb 1.18 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2qon h VAL 627 CO 0.76 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.96 2qon n GLY 628 N 1.70 1.26 3.89 2.17 0.00 -1.04 -5.02 105.19 108.14 2qon n GLY 628 Ca -0.04 0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 2qon n GLY 628 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qon s ALA 629 N -1.00 3.79 0.43 4.61 0.00 -1.26 -0.68 121.76 127.65 2qon s ALA 629 Ca 0.00 -1.18 0.03 0.00 0.00 0.00 0.00 51.96 50.81 2qon s ALA 629 Cb 0.00 -1.58 -0.01 0.00 0.00 0.00 0.00 23.12 21.52 2qon s ALA 629 CO 0.00 0.43 0.12 0.41 0.00 0.00 0.00 175.76 176.72 2qon n GLY 630 N -0.76 3.29 0.35 0.00 0.00 0.16 -4.72 105.19 103.52 2qon n GLY 630 Ca -0.08 -2.17 0.05 0.00 0.00 0.00 0.00 46.02 43.82 2qon n GLY 630 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2qon h GLU 631 N 0.00 0.85 0.00 1.61 4.81 -1.97 -3.28 114.58 116.60 2qon h GLU 631 Ca -0.34 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.84 2qon h GLU 631 Cb 1.24 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.42 2qon h GLU 631 CO 0.55 0.57 -0.66 1.19 -0.73 0.00 0.00 179.01 179.93 2qon n PHE 632 N -4.47 0.00 0.00 0.92 3.72 -1.26 -5.06 117.46 111.31 2qon n PHE 632 Ca 0.11 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.51 2qon n PHE 632 Cb 0.18 -0.03 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 2qon n PHE 632 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2qon n GLY 633 N 1.33 -0.59 3.86 1.37 0.00 -1.19 -0.29 105.19 109.68 2qon n GLY 633 Ca 0.02 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.12 2qon n GLY 633 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2qon s GLU 634 N -1.42 3.87 -0.08 1.61 2.02 -1.22 0.41 118.70 123.87 2qon s GLU 634 Ca 0.00 0.63 0.04 0.00 0.02 0.00 0.00 54.97 55.66 2qon s GLU 634 Cb 0.00 -2.34 0.00 0.00 0.10 0.00 0.00 34.13 31.90 2qon s GLU 634 CO 0.00 -0.05 -0.21 0.14 0.02 0.00 0.00 175.26 175.15 2qon s VAL 635 N -2.36 1.85 0.32 2.63 -7.23 0.14 -1.55 120.40 114.21 2qon s VAL 635 Ca 0.54 -0.91 -0.02 0.00 -1.81 0.00 0.00 61.98 59.79 2qon s VAL 635 Cb -0.10 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.23 2qon s VAL 635 CO 0.28 0.51 0.42 0.00 -0.31 0.00 0.00 175.10 176.01 2qon s SER 637 N -3.24 1.19 0.00 0.00 1.04 0.51 -1.24 113.70 111.96 2qon s SER 637 Ca 0.32 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.64 2qon s SER 637 Cb 0.01 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.23 2qon s SER 637 CO 0.20 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.51 2qon n GLY 638 N -0.17 0.82 3.11 7.32 0.00 -0.65 -0.82 105.19 114.81 2qon n GLY 638 Ca -0.09 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.33 2qon n GLY 638 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2qon s ARG 639 N 1.45 0.71 -0.11 1.61 1.81 -0.42 -1.25 118.95 122.75 2qon s ARG 639 Ca 0.00 -0.77 0.02 0.00 -1.72 0.00 0.00 55.73 53.26 2qon s ARG 639 Cb 0.00 -0.64 0.01 0.00 -0.45 0.00 0.00 34.95 33.88 2qon s ARG 639 CO 0.00 0.14 -0.18 -1.17 -0.68 0.00 0.00 175.30 173.41 2qon s LEU 640 N -1.39 1.90 -0.34 2.53 2.96 0.05 -1.50 118.68 122.89 2qon s LEU 640 Ca -0.04 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.16 2qon s LEU 640 Cb -0.09 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 45.37 2qon s LEU 640 CO 0.01 0.06 0.69 -0.75 -1.32 0.00 0.00 176.35 175.04 2qon s LYS 641 N 0.81 3.78 0.73 1.98 2.20 0.24 -1.33 119.74 128.15 2qon s LYS 641 Ca -0.09 0.24 -0.11 0.00 -0.36 0.00 0.00 55.97 55.65 2qon s LYS 641 Cb -0.16 -3.78 0.03 0.00 -1.51 0.00 0.00 37.83 32.41 2qon s LYS 641 CO 0.00 -0.73 1.08 -0.51 -0.36 0.00 0.00 175.35 174.84 2qon s LEU 642 N 2.83 2.87 0.50 5.43 1.43 0.13 -4.84 118.68 127.01 2qon s LEU 642 Ca 0.27 1.31 0.20 0.00 -1.03 0.00 0.00 54.13 54.89 2qon s LEU 642 Cb -0.14 -4.09 1.25 0.00 0.03 0.00 0.00 46.19 43.24 2qon s LEU 642 CO 0.14 -1.53 2.01 -0.65 0.23 0.00 0.00 176.35 176.55 2qon h PRO 643 N -0.78 0.14 0.00 1.29 0.11 -1.97 0.21 132.00 131.00 2qon h PRO 643 Ca -0.45 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2qon h PRO 643 Cb 1.24 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2qon h PRO 643 CO 0.61 0.09 0.00 -1.13 -0.21 0.00 0.00 178.00 177.36 2qon n SER 644 N -4.43 0.00 0.00 -2.05 3.41 -1.26 -4.88 113.62 104.41 2qon n SER 644 Ca 0.08 -0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 2qon n SER 644 Cb 0.46 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.32 2qon n SER 644 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qon n LYS 645 N -1.09 0.00 -1.99 4.33 4.76 0.74 -5.02 118.16 119.89 2qon n LYS 645 Ca 0.13 0.00 -0.40 0.00 -2.87 0.00 0.00 58.31 55.16 2qon n LYS 645 Cb 0.09 -2.41 -0.01 0.00 -1.84 0.00 0.00 35.03 30.87 2qon n LYS 645 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2qon s LYS 646 N -0.05 4.15 -0.14 1.97 2.20 -1.26 -4.69 119.74 121.93 2qon s LYS 646 Ca 0.00 2.32 -0.03 0.00 -0.36 0.00 0.00 55.97 57.91 2qon s LYS 646 Cb 0.00 -2.95 -0.03 0.00 -1.51 0.00 0.00 37.83 33.35 2qon s LYS 646 CO 0.00 -0.40 -0.05 -1.21 -0.36 0.00 0.00 175.35 173.33 2qon s GLU 647 N -2.02 3.47 0.17 4.03 2.02 -1.26 0.17 118.70 125.27 2qon s GLU 647 Ca 0.53 -0.53 0.07 0.00 0.02 0.00 0.00 54.97 55.05 2qon s GLU 647 Cb -0.42 -2.83 -0.04 0.00 0.10 0.00 0.00 34.13 30.94 2qon s GLU 647 CO 0.55 0.33 -0.14 0.96 0.02 0.00 0.00 175.26 176.98 2qon s ILE 648 N 0.10 1.57 0.39 -1.63 -4.36 -0.44 -4.97 121.20 111.87 2qon s ILE 648 Ca -0.01 -2.05 -0.24 0.00 -0.26 0.00 0.00 60.65 58.09 2qon s ILE 648 Cb -0.14 -1.88 -0.10 0.00 1.25 0.00 0.00 42.46 41.60 2qon s ILE 648 CO 0.03 -0.55 1.00 -0.44 0.24 0.00 0.00 174.94 175.22 2qon s SER 649 N -3.03 6.92 0.04 4.36 0.01 -1.26 -0.77 113.70 119.98 2qon s SER 649 Ca 0.18 1.91 -0.04 0.00 1.31 0.00 0.00 55.95 59.31 2qon s SER 649 Cb -0.02 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.62 2qon s SER 649 CO 0.05 -0.37 0.06 0.68 0.41 0.00 0.00 173.24 174.07 2qon s VAL 650 N -1.77 0.15 -0.01 3.43 -7.23 -0.38 -4.86 120.40 109.73 2qon s VAL 650 Ca 0.57 -1.23 -0.15 0.00 -1.81 0.00 0.00 61.98 59.36 2qon s VAL 650 Cb -0.18 -0.98 -0.06 0.00 0.56 0.00 0.00 36.38 35.73 2qon s VAL 650 CO 0.23 -0.68 0.42 0.00 -0.31 0.00 0.00 175.10 174.76 2qon s ALA 651 N -2.83 3.67 -0.07 1.32 0.00 -0.05 -1.64 121.76 122.17 2qon s ALA 651 Ca -0.03 -0.21 0.02 0.00 0.00 0.00 0.00 51.96 51.74 2qon s ALA 651 Cb 0.00 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.72 2qon s ALA 651 CO -0.06 0.43 -0.11 0.42 0.00 0.00 0.00 175.76 176.44 2qon s ILE 652 N -0.92 1.08 -0.01 0.00 1.01 -0.38 -0.92 121.20 121.06 2qon s ILE 652 Ca 0.24 -0.44 0.08 0.00 0.00 0.00 0.00 60.65 60.53 2qon s ILE 652 Cb -0.17 -1.00 -0.02 0.00 0.01 0.00 0.00 42.46 41.28 2qon s ILE 652 CO 0.13 0.34 -0.25 -0.54 0.00 0.00 0.00 174.94 174.62 2qon s LYS 653 N 0.76 2.08 0.23 2.79 1.02 -0.15 -0.60 119.74 125.86 2qon s LYS 653 Ca -0.13 -0.95 0.11 0.00 0.02 0.00 0.00 55.97 55.02 2qon s LYS 653 Cb -0.15 -2.05 -0.05 0.00 -0.52 0.00 0.00 37.83 35.06 2qon s LYS 653 CO 0.03 0.55 -0.21 0.95 -0.92 0.00 0.00 175.35 175.75 2qon s THR 654 N -0.65 2.50 -0.20 2.17 -4.23 -0.59 -1.18 115.64 113.45 2qon s THR 654 Ca 0.10 -2.14 -0.18 0.00 -1.18 0.00 0.00 61.69 58.29 2qon s THR 654 Cb -0.10 -2.25 -0.03 0.00 1.34 0.00 0.00 72.50 71.46 2qon s THR 654 CO -0.00 -0.23 0.51 -0.22 -0.54 0.00 0.00 174.62 174.13 2qon s LEU 655 N -3.04 4.14 0.42 4.79 2.96 -0.67 -3.18 118.68 124.11 2qon s LEU 655 Ca 0.25 0.66 -0.22 0.00 -0.22 0.00 0.00 54.13 54.60 2qon s LEU 655 Cb -0.07 -2.69 -0.13 0.00 0.50 0.00 0.00 46.19 43.80 2qon s LEU 655 CO 0.13 -0.18 0.48 2.29 -1.32 0.00 0.00 176.35 177.75 2qon n LYS 656 N 4.79 0.48 -1.99 1.98 2.85 0.61 -4.51 118.16 122.36 2qon n LYS 656 Ca -0.05 0.18 -0.40 0.00 -1.05 0.00 0.00 58.31 56.98 2qon n LYS 656 Cb 0.50 -1.44 -0.01 0.00 -0.65 0.00 0.00 35.03 33.44 2qon n LYS 656 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2qon s VAL 657 N -1.51 2.46 -0.11 0.58 1.01 -1.26 -2.87 120.40 118.70 2qon s VAL 657 Ca 0.63 0.45 0.00 0.00 0.00 0.00 0.00 61.98 63.06 2qon s VAL 657 Cb -0.60 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 32.49 2qon s VAL 657 CO 0.59 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.39 2qon n GLY 658 N 0.66 0.44 3.68 4.51 0.00 -1.26 -5.01 105.19 108.21 2qon n GLY 658 Ca 0.01 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.66 2qon n GLY 658 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 2qon n TYR 659 N -3.15 1.36 -2.61 1.61 0.18 -1.14 -5.02 117.16 108.39 2qon n TYR 659 Ca -0.01 0.42 -0.27 0.00 1.88 0.00 0.00 57.90 59.92 2qon n TYR 659 Cb 0.12 -2.19 0.01 0.00 -0.38 0.00 0.00 39.34 36.90 2qon n TYR 659 CO 0.00 0.00 0.00 0.95 -2.08 0.00 0.00 176.86 175.73 2qon s THR 660 N -1.55 4.49 0.41 -3.48 -4.23 -1.26 -4.95 115.64 105.07 2qon s THR 660 Ca 0.79 0.08 0.12 0.00 -1.18 0.00 0.00 61.69 61.50 2qon s THR 660 Cb -0.37 -3.72 0.16 0.00 1.34 0.00 0.00 72.50 69.91 2qon s THR 660 CO 0.44 -0.70 1.94 -0.33 -0.54 0.00 0.00 174.62 175.44 2qon h GLU 661 N 0.13 0.09 -0.28 3.99 4.39 -1.99 -1.60 114.58 119.31 2qon h GLU 661 Ca -0.46 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.22 2qon h GLU 661 Cb 1.22 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.85 2qon h GLU 661 CO 0.61 0.28 0.19 -0.22 -1.16 0.00 0.00 179.01 178.70 2qon h LYS 662 N 0.09 0.37 -0.61 2.33 3.64 -1.99 0.61 116.57 121.01 2qon h LYS 662 Ca 0.02 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2qon h LYS 662 Cb 0.38 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 2qon h LYS 662 CO 0.03 0.25 0.39 1.96 -2.27 0.00 0.00 179.45 179.80 2qon h GLN 663 N 0.38 0.75 -0.27 1.90 4.20 -1.74 -0.57 115.11 119.75 2qon h GLN 663 Ca 0.10 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.75 2qon h GLN 663 Cb -0.04 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 2qon h GLN 663 CO -0.02 0.49 0.09 -0.09 -0.67 0.00 0.00 178.83 178.64 2qon h ARG 664 N 0.77 0.42 -0.70 1.46 2.43 -0.89 -0.45 114.38 117.42 2qon h ARG 664 Ca 0.24 -0.09 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2qon h ARG 664 Cb -0.01 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 2qon h ARG 664 CO -0.09 0.47 0.42 0.00 -1.51 0.00 0.00 179.97 179.27 2qon h ARG 665 N 0.28 0.95 -0.02 0.20 3.08 -0.59 -1.56 114.38 116.73 2qon h ARG 665 Ca 0.09 -0.09 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 2qon h ARG 665 Cb 0.22 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2qon h ARG 665 CO -0.00 0.68 -0.75 -0.44 -1.07 0.00 0.00 179.97 178.38 2qon h ASP 666 N 0.96 0.17 0.37 7.04 3.32 -0.96 -0.89 116.42 126.42 2qon h ASP 666 Ca 0.25 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 2qon h ASP 666 Cb -0.03 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.47 2qon h ASP 666 CO -0.05 0.86 -0.18 0.15 -1.72 0.00 0.00 179.24 178.31 2qon h PHE 667 N 0.09 -0.46 0.00 4.55 3.57 -0.86 -3.09 116.94 120.74 2qon h PHE 667 Ca -0.02 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.42 2qon h PHE 667 Cb 1.33 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 40.21 2qon h PHE 667 CO 0.02 -0.14 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.66 2qon h LEU 668 N -0.80 0.00 -0.41 0.59 3.38 -1.34 -3.22 115.31 113.51 2qon h LEU 668 Ca -0.05 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2qon h LEU 668 Cb 0.53 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2qon h LEU 668 CO 0.08 0.24 0.17 1.23 0.09 0.00 0.00 178.44 180.25 2qon h GLY 669 N 2.33 0.65 0.77 0.83 0.00 -1.18 -1.42 103.07 105.04 2qon h GLY 669 Ca -0.00 -0.35 0.07 0.00 0.00 0.00 0.00 47.33 47.05 2qon h GLY 669 CO 0.03 0.33 0.62 -2.09 0.00 0.00 0.00 176.54 175.43 2qon h GLU 670 N 0.51 1.06 -0.63 4.80 4.22 -1.54 -1.76 114.58 121.25 2qon h GLU 670 Ca 0.14 -0.06 -0.02 0.00 0.08 0.00 0.00 59.36 59.49 2qon h GLU 670 Cb 0.17 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.16 2qon h GLU 670 CO -0.01 0.70 0.32 0.00 -2.18 0.00 0.00 179.01 177.84 2qon h ALA 671 N 1.49 0.81 -0.54 2.92 0.00 -1.53 -2.13 119.26 120.28 2qon h ALA 671 Ca 0.42 -0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.28 2qon h ALA 671 Cb 0.21 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2qon h ALA 671 CO -0.17 0.36 0.37 0.66 0.00 0.00 0.00 179.25 180.47 2qon h SER 672 N 0.87 0.36 0.09 0.00 4.64 -0.42 0.22 113.55 119.31 2qon h SER 672 Ca 0.22 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2qon h SER 672 Cb 0.10 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2qon h SER 672 CO -0.03 0.23 -0.04 0.40 -0.87 0.00 0.00 176.83 176.51 2qon h ILE 673 N 0.41 1.07 -0.74 0.95 2.04 -1.24 -3.32 117.51 116.68 2qon h ILE 673 Ca 0.25 -1.40 0.03 0.00 1.00 0.00 0.00 64.86 64.73 2qon h ILE 673 Cb 0.44 1.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 2qon h ILE 673 CO -0.06 0.30 0.49 -0.03 0.00 0.00 0.00 178.15 178.84 2qon h MET 674 N -0.85 0.90 0.00 2.37 4.05 -1.04 -1.39 114.93 118.96 2qon h MET 674 Ca -0.01 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.35 2qon h MET 674 Cb 0.58 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.18 2qon h MET 674 CO 0.02 0.60 0.00 0.78 0.23 0.00 0.00 176.91 178.54 2qon h GLY 675 N 0.93 0.00 2.00 1.39 0.00 -1.08 -1.40 103.07 104.91 2qon h GLY 675 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.62 2qon h GLY 675 CO -0.08 0.00 0.00 1.46 0.00 0.00 0.00 176.54 177.92 2qon h GLN 676 N 0.00 0.00 -5.29 4.80 4.20 -1.34 -3.45 115.11 114.03 2qon h GLN 676 Ca 0.00 0.00 -0.65 0.00 0.06 0.00 0.00 58.65 58.06 2qon h GLN 676 Cb 0.18 0.00 -0.26 0.00 0.30 0.00 0.00 27.48 27.69 2qon h GLN 676 CO 0.00 0.00 -0.75 -0.06 -0.67 0.00 0.00 178.83 177.35 2qon s PHE 677 N -3.29 2.84 -0.36 2.96 0.08 -0.53 -5.03 117.98 114.65 2qon s PHE 677 Ca 0.06 -0.65 0.02 0.00 0.12 0.00 0.00 56.93 56.47 2qon s PHE 677 Cb 0.10 -1.88 0.11 0.00 -0.57 0.00 0.00 43.02 40.78 2qon s PHE 677 CO 0.47 -0.23 0.12 0.34 -0.10 0.00 0.00 175.22 175.82 2qon s ASP 678 N 0.45 4.24 -0.19 1.36 -1.08 -1.26 -4.82 116.67 115.37 2qon s ASP 678 Ca -0.09 -2.13 -0.20 0.00 -0.52 0.00 0.00 52.55 49.62 2qon s ASP 678 Cb -0.16 -1.23 0.05 0.00 -1.46 0.00 0.00 42.92 40.13 2qon s ASP 678 CO 0.04 -0.36 0.55 -2.28 0.52 0.00 0.00 175.17 173.65 2qon s HIS 679 N 0.96 -0.59 0.59 -5.34 2.46 -1.26 -5.05 115.29 107.05 2qon s HIS 679 Ca 0.12 1.41 0.43 0.00 0.47 0.00 0.00 55.06 57.49 2qon s HIS 679 Cb -0.20 0.22 2.27 0.00 -0.13 0.00 0.00 32.58 34.74 2qon s HIS 679 CO -0.12 -0.32 2.32 -1.00 -2.47 0.00 0.00 174.74 173.14 2qon h PRO 680 N 5.03 0.00 -0.25 2.88 0.13 -1.98 -2.11 132.00 135.69 2qon h PRO 680 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2qon h PRO 680 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2qon h PRO 680 CO 0.18 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.04 2qon n ASN 681 N -3.11 3.54 -4.25 1.44 3.02 -1.26 -4.89 115.26 109.75 2qon n ASN 681 Ca -0.02 -2.82 -0.32 0.00 -0.03 0.00 0.00 54.58 51.39 2qon n ASN 681 Cb 0.11 -0.47 -0.17 0.00 -0.61 0.00 0.00 39.78 38.64 2qon n ASN 681 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qon s ILE 682 N -2.47 2.04 0.13 2.41 1.01 -0.80 -1.03 121.20 122.50 2qon s ILE 682 Ca 0.37 -1.04 -0.34 0.00 0.00 0.00 0.00 60.65 59.64 2qon s ILE 682 Cb 0.29 -1.74 -0.14 0.00 0.01 0.00 0.00 42.46 40.88 2qon s ILE 682 CO 0.09 0.56 1.62 -0.38 0.00 0.00 0.00 174.94 176.83 2qon n ILE 683 N 3.17 0.08 -2.67 2.92 2.08 -0.71 -4.55 119.36 119.69 2qon n ILE 683 Ca -0.18 -0.01 -0.42 0.00 0.56 0.00 0.00 62.75 62.69 2qon n ILE 683 Cb 0.52 -1.59 -0.03 0.00 -0.75 0.00 0.00 39.64 37.80 2qon n ILE 683 CO 0.00 0.00 0.00 -0.60 0.56 0.00 0.00 176.55 176.51 2qon s ARG 684 N 1.34 4.45 -0.33 0.38 3.52 -1.26 -4.93 118.95 122.12 2qon s ARG 684 Ca 0.81 1.43 -0.28 0.00 -0.13 0.00 0.00 55.73 57.56 2qon s ARG 684 Cb -0.68 -3.52 0.01 0.00 -1.56 0.00 0.00 34.95 29.21 2qon s ARG 684 CO 0.40 -0.25 1.01 -1.17 -0.81 0.00 0.00 175.30 174.47 2qon s LEU 685 N 1.74 3.96 0.06 -0.88 2.96 -1.26 -1.03 118.68 124.22 2qon s LEU 685 Ca 0.50 0.90 -0.10 0.00 -0.22 0.00 0.00 54.13 55.21 2qon s LEU 685 Cb -0.20 -3.43 -0.30 0.00 0.50 0.00 0.00 46.19 42.77 2qon s LEU 685 CO 0.21 -0.85 1.10 -0.33 -1.32 0.00 0.00 176.35 175.16 2qon h GLU 686 N 8.19 0.45 0.00 1.98 4.39 -1.18 -3.48 114.58 124.93 2qon h GLU 686 Ca -0.22 -0.70 0.00 0.00 0.34 0.00 0.00 59.36 58.78 2qon h GLU 686 Cb 1.07 0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 2qon h GLU 686 CO 1.01 1.32 0.00 0.41 -1.16 0.00 0.00 179.01 180.59 2qon n GLY 687 N 1.52 -2.37 3.33 -3.84 0.00 -1.04 -4.59 105.19 98.21 2qon n GLY 687 Ca -0.12 -1.26 -0.19 0.00 0.00 0.00 0.00 46.02 44.44 2qon n GLY 687 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qon s VAL 688 N -2.26 1.71 -0.29 1.61 -7.23 0.55 -1.11 120.40 113.37 2qon s VAL 688 Ca 0.00 -2.08 -0.01 0.00 -1.81 0.00 0.00 61.98 58.07 2qon s VAL 688 Cb 0.00 -1.93 0.05 0.00 0.56 0.00 0.00 36.38 35.06 2qon s VAL 688 CO 0.00 -0.51 -0.01 -0.69 -0.31 0.00 0.00 175.10 173.58 2qon s VAL 689 N -2.64 2.93 -0.03 1.32 1.01 -0.15 -0.32 120.40 122.51 2qon s VAL 689 Ca 0.19 -1.38 0.03 0.00 0.00 0.00 0.00 61.98 60.81 2qon s VAL 689 Cb -0.02 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 2qon s VAL 689 CO 0.06 -0.09 0.07 0.35 0.00 0.00 0.00 175.10 175.49 2qon n THR 690 N 4.61 0.00 1.41 3.92 -2.24 -1.26 -1.40 114.28 119.31 2qon n THR 690 Ca -0.13 -0.15 0.14 0.00 -2.27 0.00 0.00 64.05 61.64 2qon n THR 690 Cb 0.43 0.57 0.48 0.00 -2.10 0.00 0.00 70.33 69.71 2qon n THR 690 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qon n LYS 691 N -1.47 1.28 -4.16 -0.78 5.02 -1.26 -4.80 118.16 111.99 2qon n LYS 691 Ca -0.00 -0.72 -0.10 0.00 -2.02 0.00 0.00 58.31 55.46 2qon n LYS 691 Cb 0.06 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.49 2qon n LYS 691 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2qon s SER 692 N -2.22 0.28 0.00 4.39 1.04 -1.26 -5.17 113.70 110.77 2qon s SER 692 Ca 0.32 -1.23 0.04 0.00 0.48 0.00 0.00 55.95 55.56 2qon s SER 692 Cb 0.20 0.31 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 2qon s SER 692 CO 0.41 -0.75 -0.12 -0.54 0.98 0.00 0.00 173.24 173.23 2qon s LYS 693 N -4.06 0.89 0.33 4.02 1.02 -1.26 -3.89 119.74 116.78 2qon s LYS 693 Ca 0.26 -0.49 -0.29 0.00 0.02 0.00 0.00 55.97 55.48 2qon s LYS 693 Cb 0.07 -0.86 -0.11 0.00 -0.52 0.00 0.00 37.83 36.42 2qon s LYS 693 CO 0.03 0.23 1.45 -2.14 -0.92 0.00 0.00 175.35 174.01 2qon s PRO 694 N -0.51 4.20 0.40 -1.68 0.02 -1.26 -5.14 135.00 131.04 2qon s PRO 694 Ca 0.03 2.44 -0.27 0.00 0.02 0.00 0.00 61.00 63.23 2qon s PRO 694 Cb -0.05 -3.02 -0.09 0.00 0.02 0.00 0.00 34.50 31.35 2qon s PRO 694 CO -0.00 -0.45 1.39 0.08 -0.33 0.00 0.00 177.00 177.69 2qon s VAL 695 N -0.76 2.30 0.02 3.83 1.01 -1.25 -4.88 120.40 120.67 2qon s VAL 695 Ca 0.55 0.28 0.02 0.00 0.00 0.00 0.00 61.98 62.83 2qon s VAL 695 Cb -0.44 -3.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 2qon s VAL 695 CO 0.55 0.05 -0.07 -0.04 0.00 0.00 0.00 175.10 175.59 2qon s MET 696 N -2.21 0.50 -0.16 2.72 -1.94 -0.50 -1.67 119.30 116.04 2qon s MET 696 Ca 0.56 -0.50 0.01 0.00 -1.71 0.00 0.00 55.69 54.05 2qon s MET 696 Cb -0.42 -0.37 0.01 0.00 2.01 0.00 0.00 34.83 36.06 2qon s MET 696 CO 0.56 0.08 -0.19 0.42 -0.01 0.00 0.00 175.02 175.88 2qon s ILE 697 N -0.80 2.28 -0.19 2.53 1.01 -0.32 -0.98 121.20 124.73 2qon s ILE 697 Ca -0.04 -0.89 -0.02 0.00 0.00 0.00 0.00 60.65 59.70 2qon s ILE 697 Cb -0.06 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.46 2qon s ILE 697 CO 0.00 0.53 -0.10 -0.69 0.00 0.00 0.00 174.94 174.68 2qon s VAL 698 N 1.00 2.95 0.32 2.92 1.01 -0.27 -0.98 120.40 127.36 2qon s VAL 698 Ca -0.02 -0.65 0.03 0.00 0.00 0.00 0.00 61.98 61.34 2qon s VAL 698 Cb -0.15 -2.30 -0.06 0.00 0.00 0.00 0.00 36.38 33.88 2qon s VAL 698 CO -0.05 0.47 0.08 0.42 0.00 0.00 0.00 175.10 176.02 2qon s THR 699 N 1.21 0.99 0.00 3.92 -4.23 -0.10 -0.61 115.64 116.82 2qon s THR 699 Ca 0.02 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.53 2qon s THR 699 Cb -0.14 -2.70 0.00 0.00 1.34 0.00 0.00 72.50 70.99 2qon s THR 699 CO -0.04 0.00 0.00 1.21 -0.54 0.00 0.00 174.62 175.25 2qon n GLU 700 N -0.68 2.78 0.00 3.99 2.13 -0.20 -0.87 120.64 127.79 2qon n GLU 700 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 2qon n GLU 700 Cb 0.66 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.37 2qon n GLU 700 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 2qon n MET 702 N 0.00 0.00 0.08 5.31 0.00 -1.26 -4.23 117.12 117.02 2qon n MET 702 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 57.70 57.73 2qon n MET 702 Cb 0.00 0.00 0.40 0.00 0.00 0.00 0.00 33.22 33.62 2qon n MET 702 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 2qon h GLU 703 N 0.00 0.34 -0.18 0.03 4.81 -1.84 -2.74 114.58 115.00 2qon h GLU 703 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 2qon h GLU 703 Cb 0.00 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.32 2qon h GLU 703 CO 0.00 0.37 0.00 0.09 -0.73 0.00 0.00 179.01 178.74 2qon n ASN 704 N -4.35 2.64 0.00 1.04 5.03 -0.52 -4.97 115.26 114.13 2qon n ASN 704 Ca 0.00 -1.86 0.00 0.00 0.87 0.00 0.00 54.58 53.59 2qon n ASN 704 Cb 0.20 -0.11 0.00 0.00 -1.02 0.00 0.00 39.78 38.85 2qon n ASN 704 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2qon n GLY 705 N 1.33 -0.03 3.77 7.41 0.00 -1.03 -4.56 105.19 112.08 2qon n GLY 705 Ca 0.17 -0.97 -0.40 0.00 0.00 0.00 0.00 46.02 44.82 2qon n GLY 705 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2qon s SER 706 N -4.00 6.65 0.25 1.61 1.04 -1.26 -0.97 113.70 117.02 2qon s SER 706 Ca 0.00 2.63 -0.01 0.00 0.48 0.00 0.00 55.95 59.05 2qon s SER 706 Cb 0.00 -2.64 0.30 0.00 0.10 0.00 0.00 66.02 63.78 2qon s SER 706 CO 0.00 -0.61 1.68 0.25 0.98 0.00 0.00 173.24 175.54 2qon h LEU 707 N 3.15 0.63 0.03 2.42 5.85 -1.02 -1.40 115.31 124.97 2qon h LEU 707 Ca -0.49 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.01 2qon h LEU 707 Cb 1.23 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.09 2qon h LEU 707 CO 0.64 0.85 -0.01 -2.24 -0.34 0.00 0.00 178.44 177.34 2qon h ASP 708 N 0.55 -0.03 -0.53 1.25 2.03 -1.82 -1.04 116.42 116.84 2qon h ASP 708 Ca 0.08 -0.34 0.04 0.00 -0.73 0.00 0.00 57.03 56.08 2qon h ASP 708 Cb 0.69 0.01 -0.04 0.00 -0.83 0.00 0.00 39.33 39.15 2qon h ASP 708 CO 0.05 0.32 0.28 0.77 -1.03 0.00 0.00 179.24 179.64 2qon h SER 709 N -0.39 0.42 -0.35 4.15 4.64 -1.89 -1.65 113.55 118.48 2qon h SER 709 Ca -0.00 0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2qon h SER 709 Cb 0.37 -0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 2qon h SER 709 CO 0.01 0.29 0.20 0.15 -0.87 0.00 0.00 176.83 176.61 2qon h PHE 710 N 0.55 0.47 -0.33 4.77 3.57 -1.16 -2.71 116.94 122.10 2qon h PHE 710 Ca 0.23 -0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.63 2qon h PHE 710 Cb 0.11 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.68 2qon h PHE 710 CO -0.09 0.35 -0.17 -0.07 -2.23 0.00 0.00 178.31 176.10 2qon h LEU 711 N 0.45 0.58 -2.21 0.59 3.38 -1.03 -2.09 115.31 114.99 2qon h LEU 711 Ca 0.13 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2qon h LEU 711 Cb 0.02 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.62 2qon h LEU 711 CO -0.02 0.77 -0.05 0.03 0.09 0.00 0.00 178.44 179.25 2qon h ARG 712 N 0.53 0.00 0.00 1.13 3.08 -1.00 -1.07 114.38 117.05 2qon h ARG 712 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2qon h ARG 712 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.65 2qon h ARG 712 CO 0.04 0.05 0.00 1.63 -1.07 0.00 0.00 179.97 180.62 2qon n LYS 713 N -3.82 0.07 -2.50 0.04 5.02 -0.79 -4.18 118.16 111.99 2qon n LYS 713 Ca -0.03 0.07 -0.05 0.00 -2.02 0.00 0.00 58.31 56.28 2qon n LYS 713 Cb 0.15 -1.59 0.05 0.00 -0.02 0.00 0.00 35.03 33.62 2qon n LYS 713 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2qon n HIS 714 N -1.71 1.46 -1.67 2.13 8.25 -0.42 -5.09 115.22 118.17 2qon n HIS 714 Ca 0.07 -2.02 -0.50 0.00 -0.26 0.00 0.00 57.72 55.01 2qon n HIS 714 Cb 0.36 -0.25 -0.05 0.00 1.12 0.00 0.00 29.99 31.17 2qon n HIS 714 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2qon n ASP 715 N -0.55 2.90 -1.40 0.41 2.03 -1.13 -1.02 116.55 117.78 2qon n ASP 715 Ca 0.15 1.04 -0.18 0.00 0.52 0.00 0.00 54.79 56.32 2qon n ASP 715 Cb 0.86 -1.32 -0.08 0.00 -0.72 0.00 0.00 41.12 39.87 2qon n ASP 715 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qon n ALA 716 N 4.94 -0.28 1.03 -1.67 0.00 -1.26 -4.88 120.51 118.38 2qon n ALA 716 Ca 0.21 0.30 0.11 0.00 0.00 0.00 0.00 53.44 54.06 2qon n ALA 716 Cb 0.25 -1.95 0.01 0.00 0.00 0.00 0.00 19.45 17.76 2qon n ALA 716 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2qon n GLN 717 N -2.13 0.76 -4.10 0.00 6.02 -0.19 -4.93 117.38 112.81 2qon n GLN 717 Ca -0.18 -0.61 -0.22 0.00 -0.01 0.00 0.00 57.00 55.98 2qon n GLN 717 Cb 0.64 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 30.37 2qon n GLN 717 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2qon s PHE 718 N -2.66 2.94 0.51 1.08 0.08 -1.26 -5.12 117.98 113.55 2qon s PHE 718 Ca 0.16 -0.20 -0.14 0.00 0.12 0.00 0.00 56.93 56.87 2qon s PHE 718 Cb 0.18 -1.45 -0.07 0.00 -0.57 0.00 0.00 43.02 41.11 2qon s PHE 718 CO 0.66 0.47 0.94 0.95 -0.10 0.00 0.00 175.22 178.14 2qon s THR 719 N -2.24 4.62 0.28 0.64 -4.23 -1.26 -4.92 115.64 108.52 2qon s THR 719 Ca 0.34 1.03 0.01 0.00 -1.18 0.00 0.00 61.69 61.89 2qon s THR 719 Cb -0.07 -3.75 0.28 0.00 1.34 0.00 0.00 72.50 70.30 2qon s THR 719 CO 0.24 -0.72 1.82 1.62 -0.54 0.00 0.00 174.62 177.04 2qon h VAL 720 N 0.77 0.89 -0.24 2.29 3.04 -1.99 -1.42 116.25 119.58 2qon h VAL 720 Ca -0.46 -0.32 -0.09 0.00 -1.01 0.00 0.00 66.70 64.81 2qon h VAL 720 Cb 1.19 -0.13 -0.01 0.00 -2.01 0.00 0.00 31.29 30.33 2qon h VAL 720 CO 0.62 0.17 -0.25 0.40 -1.01 0.00 0.00 177.57 177.50 2qon h ILE 721 N 0.93 1.26 -0.39 3.17 1.08 -1.97 0.30 117.51 121.89 2qon h ILE 721 Ca 0.49 -1.25 -0.02 0.00 -0.39 0.00 0.00 64.86 63.70 2qon h ILE 721 Cb 0.52 1.35 -0.02 0.00 -3.07 0.00 0.00 36.82 35.61 2qon h ILE 721 CO -0.28 0.40 0.18 1.56 -0.69 0.00 0.00 178.15 179.31 2qon h GLN 722 N 0.41 0.57 -0.40 2.37 4.20 -1.67 -1.09 115.11 119.50 2qon h GLN 722 Ca 0.06 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.68 2qon h GLN 722 Cb 0.66 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 2qon h GLN 722 CO 0.05 0.52 0.23 -0.07 -0.67 0.00 0.00 178.83 178.88 2qon h LEU 723 N 0.49 0.49 -0.88 1.46 3.38 -1.03 -2.52 115.31 116.69 2qon h LEU 723 Ca 0.13 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2qon h LEU 723 Cb 0.14 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.73 2qon h LEU 723 CO -0.01 0.41 0.54 0.58 0.09 0.00 0.00 178.44 180.05 2qon h VAL 724 N 0.52 1.24 -0.92 1.22 2.07 -0.83 -1.64 116.25 117.91 2qon h VAL 724 Ca 0.14 -0.50 0.09 0.00 0.82 0.00 0.00 66.70 67.25 2qon h VAL 724 Cb 0.03 -0.01 -0.07 0.00 -1.52 0.00 0.00 31.29 29.71 2qon h VAL 724 CO -0.02 0.25 0.56 1.23 0.02 0.00 0.00 177.57 179.60 2qon h GLY 725 N 1.21 1.44 0.95 2.17 0.00 -1.02 0.41 103.07 108.23 2qon h GLY 725 Ca 0.32 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 2qon h GLY 725 CO -0.06 0.19 0.18 -0.33 0.00 0.00 0.00 176.54 176.52 2qon h MET 726 N 0.94 0.59 -0.36 4.80 2.07 -0.97 -2.22 114.93 119.79 2qon h MET 726 Ca 0.43 -0.09 -0.12 0.00 -2.07 0.00 0.00 59.70 57.85 2qon h MET 726 Cb 0.35 -0.10 -0.01 0.00 -1.87 0.00 0.00 31.60 29.96 2qon h MET 726 CO -0.23 0.53 -0.25 -0.07 1.07 0.00 0.00 176.91 177.96 2qon h LEU 727 N 0.51 0.74 -0.60 1.22 3.38 -0.83 -2.18 115.31 117.56 2qon h LEU 727 Ca 0.14 -0.27 -0.08 0.00 0.09 0.00 0.00 57.88 57.75 2qon h LEU 727 Cb 0.15 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2qon h LEU 727 CO -0.02 0.96 0.06 -0.09 0.09 0.00 0.00 178.44 179.44 2qon h ARG 728 N 0.63 1.02 -0.38 1.13 1.12 -0.83 -0.94 114.38 116.14 2qon h ARG 728 Ca 0.08 -0.30 0.00 0.00 -1.11 0.00 0.00 59.98 58.66 2qon h ARG 728 Cb 0.75 -0.11 -0.02 0.00 -0.01 0.00 0.00 29.97 30.58 2qon h ARG 728 CO 0.06 0.98 0.25 0.78 -3.11 0.00 0.00 179.97 178.93 2qon h GLY 729 N 0.92 0.54 0.73 2.80 0.00 -1.12 0.29 103.07 107.22 2qon h GLY 729 Ca 0.18 -0.20 0.03 0.00 0.00 0.00 0.00 47.33 47.33 2qon h GLY 729 CO 0.02 0.20 -0.01 -2.22 0.00 0.00 0.00 176.54 174.53 2qon h ILE 730 N 0.52 0.87 -0.69 2.60 2.04 -1.24 -1.77 117.51 119.84 2qon h ILE 730 Ca 0.14 -0.02 -0.00 0.00 1.00 0.00 0.00 64.86 65.98 2qon h ILE 730 Cb -0.06 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 36.81 2qon h ILE 730 CO -0.03 0.01 0.41 0.00 0.00 0.00 0.00 178.15 178.54 2qon h ALA 731 N 1.15 1.43 -0.29 1.87 0.00 -0.85 -1.15 119.26 121.42 2qon h ALA 731 Ca 0.08 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 2qon h ALA 731 Cb 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qon h ALA 731 CO -0.14 0.49 -0.12 0.77 0.00 0.00 0.00 179.25 180.25 2qon h SER 732 N 0.95 0.61 -0.50 0.00 0.02 -0.45 0.64 113.55 114.81 2qon h SER 732 Ca 0.25 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.83 2qon h SER 732 Cb -0.04 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 2qon h SER 732 CO -0.05 0.87 0.29 1.23 -1.14 0.00 0.00 176.83 178.02 2qon h GLY 733 N 0.35 0.71 1.27 -3.77 0.00 -1.11 -2.35 103.07 98.17 2qon h GLY 733 Ca 0.07 -0.21 -0.06 0.00 0.00 0.00 0.00 47.33 47.13 2qon h GLY 733 CO 0.04 0.17 0.12 -0.33 0.00 0.00 0.00 176.54 176.53 2qon h MET 734 N 0.56 0.91 -0.47 4.80 2.86 -1.05 -1.41 114.93 121.14 2qon h MET 734 Ca 0.21 -0.20 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 2qon h MET 734 Cb 0.05 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.54 2qon h MET 734 CO -0.11 0.83 0.19 -0.22 1.06 0.00 0.00 176.91 178.66 2qon h LYS 735 N 0.86 0.37 -0.46 1.72 3.11 -0.64 -0.16 116.57 121.38 2qon h LYS 735 Ca 0.18 -0.02 -0.03 0.00 -2.81 0.00 0.00 60.65 57.97 2qon h LYS 735 Cb 0.35 -0.08 -0.02 0.00 -1.00 0.00 0.00 32.23 31.47 2qon h LYS 735 CO 0.00 0.25 0.16 -0.92 -2.81 0.00 0.00 179.45 176.13 2qon h TYR 736 N 0.38 0.72 -0.49 1.91 3.20 -0.99 0.59 116.97 122.29 2qon h TYR 736 Ca 0.22 -0.07 0.10 0.00 3.14 0.00 0.00 58.73 62.12 2qon h TYR 736 Cb 0.19 -0.21 -0.09 0.00 1.54 0.00 0.00 36.73 38.16 2qon h TYR 736 CO -0.14 0.63 -0.05 -0.07 -1.64 0.00 0.00 178.16 176.89 2qon h LEU 737 N 0.60 -0.32 -0.62 2.82 4.07 -0.97 -1.34 115.31 119.56 2qon h LEU 737 Ca 0.15 0.13 -0.14 0.00 0.08 0.00 0.00 57.88 58.10 2qon h LEU 737 Cb 0.24 0.25 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 2qon h LEU 737 CO -0.01 -0.11 -0.43 0.77 -1.08 0.00 0.00 178.44 177.58 2qon h SER 738 N 0.06 0.63 -0.50 -0.43 4.64 -0.76 -1.34 113.55 115.86 2qon h SER 738 Ca 0.24 -0.29 0.10 0.00 -0.47 0.00 0.00 61.79 61.37 2qon h SER 738 Cb 0.37 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.26 2qon h SER 738 CO -0.45 0.98 0.34 0.44 -0.87 0.00 0.00 176.83 177.27 2qon h ASP 739 N 0.48 0.21 0.03 4.97 3.32 -0.35 -1.64 116.42 123.45 2qon h ASP 739 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 2qon h ASP 739 Cb 0.95 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2qon h ASP 739 CO 0.08 0.13 -0.04 0.23 -1.72 0.00 0.00 179.24 177.92 2qon n MET 740 N -4.45 1.48 -1.64 3.56 2.81 -0.55 -4.20 117.12 114.14 2qon n MET 740 Ca 0.08 -0.83 -0.04 0.00 -1.81 0.00 0.00 57.70 55.09 2qon n MET 740 Cb 0.40 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.42 2qon n MET 740 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2qon n GLY 741 N 1.20 0.44 3.90 3.03 0.00 -0.62 0.17 105.19 113.31 2qon n GLY 741 Ca 0.18 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 45.11 2qon n GLY 741 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qon s ALA 742 N -2.20 3.85 -0.13 4.61 0.00 -0.55 -4.85 121.76 122.48 2qon s ALA 742 Ca 0.00 -0.62 0.02 0.00 0.00 0.00 0.00 51.96 51.36 2qon s ALA 742 Cb 0.00 -2.06 0.01 0.00 0.00 0.00 0.00 23.12 21.07 2qon s ALA 742 CO 0.00 0.70 -0.21 0.54 0.00 0.00 0.00 175.76 176.79 2qon s VAL 743 N -1.59 2.18 -0.02 0.00 0.11 0.08 -4.24 120.40 116.92 2qon s VAL 743 Ca 0.38 -0.95 -0.24 0.00 -2.93 0.00 0.00 61.98 58.24 2qon s VAL 743 Cb -0.12 -1.87 -0.20 0.00 -1.53 0.00 0.00 36.38 32.66 2qon s VAL 743 CO 0.25 0.55 1.19 -0.74 -3.33 0.00 0.00 175.10 173.01 2qon h HIS 744 N 7.18 0.21 0.00 1.54 6.17 -1.92 -1.75 115.15 126.58 2qon h HIS 744 Ca -0.29 -0.08 0.00 0.00 0.71 0.00 0.00 60.37 60.70 2qon h HIS 744 Cb 1.20 -0.04 0.00 0.00 2.52 0.00 0.00 27.41 31.09 2qon h HIS 744 CO 0.48 0.74 0.00 0.54 0.71 0.00 0.00 177.93 180.39 2qon n ARG 745 N -4.64 0.00 -2.44 5.26 1.74 -1.26 -3.14 116.66 112.18 2qon n ARG 745 Ca -0.08 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.99 2qon n ARG 745 Cb 0.38 -1.97 0.04 0.00 -1.02 0.00 0.00 32.46 29.89 2qon n ARG 745 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2qon n ASP 746 N 0.00 1.68 -4.64 0.55 2.03 -1.26 -4.79 116.55 110.11 2qon n ASP 746 Ca 0.00 -2.18 -0.43 0.00 0.52 0.00 0.00 54.79 52.71 2qon n ASP 746 Cb 0.00 -0.43 -0.02 0.00 -0.72 0.00 0.00 41.12 39.94 2qon n ASP 746 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 2qon s LEU 747 N -2.96 4.05 0.07 -2.67 2.96 -1.26 -4.79 118.68 114.08 2qon s LEU 747 Ca 0.30 1.64 -0.19 0.00 -0.22 0.00 0.00 54.13 55.66 2qon s LEU 747 Cb 0.34 -3.54 0.04 0.00 0.50 0.00 0.00 46.19 43.54 2qon s LEU 747 CO -0.06 -1.00 0.46 0.00 -1.32 0.00 0.00 176.35 174.43 2qon s ALA 748 N 4.26 -1.14 0.54 5.97 0.00 -1.26 -4.74 121.76 125.39 2qon s ALA 748 Ca 0.63 0.35 0.22 0.00 0.00 0.00 0.00 51.96 53.16 2qon s ALA 748 Cb -0.23 0.46 1.39 0.00 0.00 0.00 0.00 23.12 24.75 2qon s ALA 748 CO 0.23 -0.53 2.07 0.00 0.00 0.00 0.00 175.76 177.53 2qon h ALA 749 N 2.73 2.20 0.00 0.00 0.00 -1.92 -0.51 119.26 121.76 2qon h ALA 749 Ca -0.32 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2qon h ALA 749 Cb 1.22 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 2qon h ALA 749 CO 0.43 -0.35 -0.07 0.07 0.00 0.00 0.00 179.25 179.33 2qon h ARG 750 N 0.00 0.00 -0.60 0.00 0.11 -1.95 -2.57 114.38 109.37 2qon h ARG 750 Ca 0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.21 2qon h ARG 750 Cb 0.55 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.63 2qon h ARG 750 CO -0.00 0.07 0.00 0.09 0.10 0.00 0.00 179.97 180.23 2qon n ASN 751 N -3.22 4.83 -4.45 0.08 3.02 -0.21 -4.69 115.26 110.62 2qon n ASN 751 Ca -0.00 -2.55 -0.33 0.00 -0.03 0.00 0.00 54.58 51.67 2qon n ASN 751 Cb 0.31 -0.58 -0.13 0.00 -0.61 0.00 0.00 39.78 38.77 2qon n ASN 751 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2qon s ILE 752 N -2.03 3.27 0.13 2.41 -1.09 -0.98 -1.19 121.20 121.72 2qon s ILE 752 Ca 0.50 -0.61 0.06 0.00 -2.23 0.00 0.00 60.65 58.38 2qon s ILE 752 Cb 0.34 -2.35 -0.04 0.00 -1.58 0.00 0.00 42.46 38.83 2qon s ILE 752 CO 0.22 0.55 -0.01 -0.76 -1.23 0.00 0.00 174.94 173.71 2qon s LEU 753 N -0.11 3.33 -0.04 2.97 1.43 -0.02 -1.04 118.68 125.20 2qon s LEU 753 Ca -0.01 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 2qon s LEU 753 Cb -0.14 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.06 2qon s LEU 753 CO 0.03 0.13 -0.10 -0.51 0.23 0.00 0.00 176.35 176.14 2qon s ILE 754 N -1.50 0.89 0.28 -0.59 2.07 -0.14 -0.90 121.20 121.30 2qon s ILE 754 Ca 0.26 -0.38 0.02 0.00 -1.41 0.00 0.00 60.65 59.14 2qon s ILE 754 Cb -0.10 -0.81 0.05 0.00 0.13 0.00 0.00 42.46 41.73 2qon s ILE 754 CO 0.18 0.28 0.38 -0.46 -1.91 0.00 0.00 174.94 173.41 2qon n ASN 755 N 3.54 0.78 0.26 4.50 0.23 -0.72 -1.44 115.26 122.41 2qon n ASN 755 Ca -0.21 -1.59 0.10 0.00 -0.53 0.00 0.00 54.58 52.35 2qon n ASN 755 Cb 0.53 -0.22 0.69 0.00 -2.08 0.00 0.00 39.78 38.70 2qon n ASN 755 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2qon h SER 756 N -0.08 0.00 -0.61 0.53 4.64 -1.92 -1.73 113.55 114.39 2qon h SER 756 Ca -0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.19 2qon h SER 756 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2qon h SER 756 CO 0.16 0.08 0.00 0.59 -0.87 0.00 0.00 176.83 176.79 2qon n ASN 757 N -4.10 4.86 -0.99 4.97 5.03 -1.26 -4.93 115.26 118.84 2qon n ASN 757 Ca -0.03 -2.56 -0.13 0.00 0.87 0.00 0.00 54.58 52.74 2qon n ASN 757 Cb 0.16 -0.60 -0.06 0.00 -1.02 0.00 0.00 39.78 38.27 2qon n ASN 757 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2qon n LEU 758 N 0.95 -0.92 -4.70 3.41 4.77 -0.65 -5.00 117.00 114.86 2qon n LEU 758 Ca 0.25 0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 56.13 2qon n LEU 758 Cb 0.94 -1.98 -0.03 0.00 -2.33 0.00 0.00 43.42 40.02 2qon n LEU 758 CO 0.25 -0.69 0.70 -0.69 -1.33 0.00 0.00 177.39 175.63 2qon s VAL 759 N -2.47 4.85 -0.07 4.08 1.01 -1.26 -4.68 120.40 121.86 2qon s VAL 759 Ca 0.00 2.00 -0.04 0.00 0.00 0.00 0.00 61.98 63.95 2qon s VAL 759 Cb 0.00 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 2qon s VAL 759 CO 0.00 0.11 0.09 0.00 0.00 0.00 0.00 175.10 175.30 2qon s LYS 761 N -1.23 0.03 0.10 0.00 1.02 -0.08 -4.32 119.74 115.26 2qon s LYS 761 Ca 0.17 0.04 -0.30 0.00 0.02 0.00 0.00 55.97 55.90 2qon s LYS 761 Cb -0.12 0.01 -0.06 0.00 -0.52 0.00 0.00 37.83 37.14 2qon s LYS 761 CO 0.07 -0.01 1.18 0.08 -0.92 0.00 0.00 175.35 175.75 2qon s VAL 762 N 0.03 3.93 0.26 3.17 1.01 -0.20 -0.84 120.40 127.76 2qon s VAL 762 Ca -0.00 1.47 0.04 0.00 0.00 0.00 0.00 61.98 63.49 2qon s VAL 762 Cb -0.00 -3.94 -0.02 0.00 0.00 0.00 0.00 36.38 32.42 2qon s VAL 762 CO -0.00 0.16 0.15 -1.54 0.00 0.00 0.00 175.10 173.87 2qon n SER 763 N 3.40 0.32 -2.92 3.32 3.41 -0.33 -1.74 113.62 119.09 2qon n SER 763 Ca 0.07 -2.54 -0.04 0.00 -0.26 0.00 0.00 58.87 56.10 2qon n SER 763 Cb 0.46 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.37 2qon n SER 763 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2qon n ASP 764 N -1.88 -7.70 -1.68 4.04 -0.08 -1.26 -4.81 116.55 103.18 2qon n ASP 764 Ca 0.01 0.20 -0.05 0.00 -1.51 0.00 0.00 54.79 53.44 2qon n ASP 764 Cb 0.43 -5.23 0.22 0.00 2.34 0.00 0.00 41.12 38.89 2qon n ASP 764 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2qon n PHE 765 N -1.10 1.83 -0.29 -0.67 3.72 -1.26 -4.53 117.46 115.17 2qon n PHE 765 Ca 0.05 -0.94 0.02 0.00 -0.05 0.00 0.00 57.45 56.53 2qon n PHE 765 Cb 0.48 -0.56 0.22 0.00 -0.94 0.00 0.00 39.48 38.67 2qon n PHE 765 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2qon h GLY 766 N 3.22 1.25 -0.96 1.37 0.00 -1.91 -2.23 103.07 103.81 2qon h GLY 766 Ca 0.20 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2qon h GLY 766 CO 0.56 0.37 -0.21 1.04 0.00 0.00 0.00 176.54 178.30 2qon n LEU 767 N -4.44 2.05 -4.82 3.11 4.77 -1.26 -4.97 117.00 111.43 2qon n LEU 767 Ca 0.12 -0.70 -0.33 0.00 -0.03 0.00 0.00 56.01 55.07 2qon n LEU 767 Cb 0.11 -0.02 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 2qon n LEU 767 CO 0.35 0.36 0.68 -0.55 -1.33 0.00 0.00 177.39 176.90 2qon s SER 768 N -2.26 6.52 0.00 -1.43 0.15 -0.84 -4.72 113.70 111.13 2qon s SER 768 Ca 0.26 1.70 0.00 0.00 0.70 0.00 0.00 55.95 58.61 2qon s SER 768 Cb 0.19 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.97 2qon s SER 768 CO 0.44 -0.65 0.00 0.54 1.20 0.00 0.00 173.24 174.76 2qon n ARG 769 N -1.31 0.28 -3.78 5.44 1.74 -0.66 -5.02 116.66 113.34 2qon n ARG 769 Ca 0.07 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.87 2qon n ARG 769 Cb 0.54 -0.69 -0.16 0.00 -1.02 0.00 0.00 32.46 31.13 2qon n ARG 769 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 2qon s ILE 786 N -1.38 0.82 -0.87 0.55 -4.36 -1.26 -0.74 121.20 113.96 2qon s ILE 786 Ca 0.00 -0.84 -0.25 0.00 -0.26 0.00 0.00 60.65 59.30 2qon s ILE 786 Cb 0.00 -1.31 -0.09 0.00 1.25 0.00 0.00 42.46 42.31 2qon s ILE 786 CO 0.00 -0.25 2.12 -2.16 0.24 0.00 0.00 174.94 174.89 2qon s PRO 787 N 1.71 2.18 0.26 0.37 0.04 -1.26 -4.80 135.00 133.49 2qon s PRO 787 Ca -0.01 -0.04 -0.01 0.00 0.04 0.00 0.00 61.00 60.98 2qon s PRO 787 Cb -0.18 -4.97 0.52 0.00 0.04 0.00 0.00 34.50 29.92 2qon s PRO 787 CO -0.10 -3.83 1.77 0.82 0.04 0.00 0.00 177.00 175.69 2qon h ILE 788 N 7.37 0.75 0.00 0.56 1.08 -2.00 -1.06 117.51 124.22 2qon h ILE 788 Ca 0.06 -0.22 -0.01 0.00 -0.39 0.00 0.00 64.86 64.31 2qon h ILE 788 Cb 1.00 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 34.80 2qon h ILE 788 CO 1.13 0.12 -0.04 0.03 -0.69 0.00 0.00 178.15 178.70 2qon h ARG 789 N 0.64 0.00 -0.02 2.37 3.08 -1.93 -2.72 114.38 115.80 2qon h ARG 789 Ca 0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.51 2qon h ARG 789 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.67 2qon h ARG 789 CO -0.35 0.04 -0.29 0.91 -1.07 0.00 0.00 179.97 179.21 2qon n TRP 790 N -3.42 0.00 -3.69 3.04 8.01 -0.42 -4.97 117.44 115.99 2qon n TRP 790 Ca -0.02 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.80 2qon n TRP 790 Cb 0.15 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.39 2qon n TRP 790 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.69 177.67 2qon s THR 791 N -1.97 5.32 0.68 -0.99 2.01 -1.03 -3.87 115.64 115.78 2qon s THR 791 Ca 0.17 0.46 -0.15 0.00 0.31 0.00 0.00 61.69 62.47 2qon s THR 791 Cb 0.15 -3.54 0.01 0.00 0.01 0.00 0.00 72.50 69.13 2qon s THR 791 CO 0.41 0.54 1.15 -0.94 -0.69 0.00 0.00 174.62 175.09 2qon s SER 792 N -0.58 4.79 0.27 3.53 1.04 -1.26 -4.78 113.70 116.71 2qon s SER 792 Ca 0.17 2.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.73 2qon s SER 792 Cb -0.13 -2.57 0.44 0.00 0.10 0.00 0.00 66.02 63.86 2qon s SER 792 CO 0.06 -1.85 1.87 -0.65 0.98 0.00 0.00 173.24 173.65 2qon h PRO 793 N -0.02 1.08 -0.06 4.02 0.11 -1.96 -1.35 132.00 133.82 2qon h PRO 793 Ca -0.47 -0.07 -0.09 0.00 0.11 0.00 0.00 66.00 65.48 2qon h PRO 793 Cb 1.27 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2qon h PRO 793 CO 0.53 0.72 -0.38 1.05 -0.21 0.00 0.00 178.00 179.70 2qon h GLU 794 N 1.11 0.12 -0.30 1.05 9.09 -1.91 -0.42 114.58 123.33 2qon h GLU 794 Ca 0.45 -0.05 -0.18 0.00 0.05 0.00 0.00 59.36 59.63 2qon h GLU 794 Cb 0.25 -0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.35 2qon h GLU 794 CO -0.20 0.49 -0.52 0.00 0.05 0.00 0.00 179.01 178.83 2qon h ALA 795 N 1.51 0.52 -0.32 1.06 0.00 -1.47 -1.70 119.26 118.85 2qon h ALA 795 Ca 0.01 -0.50 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2qon h ALA 795 Cb 0.73 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2qon h ALA 795 CO 0.05 0.68 0.00 0.82 0.00 0.00 0.00 179.25 180.81 2qon h ILE 796 N 0.66 1.26 -0.21 0.00 2.04 -1.10 -1.06 117.51 119.10 2qon h ILE 796 Ca 0.02 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 64.91 2qon h ILE 796 Cb 1.12 1.24 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 2qon h ILE 796 CO 0.12 0.31 0.02 0.00 0.00 0.00 0.00 178.15 178.60 2qon h ALA 797 N 0.85 0.28 -0.05 1.87 0.00 -1.00 -3.39 119.26 117.82 2qon h ALA 797 Ca 0.09 -0.19 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 2qon h ALA 797 Cb 0.44 -0.08 -0.28 0.00 0.00 0.00 0.00 17.79 17.88 2qon h ALA 797 CO 0.02 -0.03 -0.71 2.48 0.00 0.00 0.00 179.25 181.00 2qon n TYR 798 N -4.72 -0.05 -3.27 0.00 0.18 -0.66 -5.02 117.16 103.62 2qon n TYR 798 Ca -0.04 -0.81 -0.23 0.00 1.88 0.00 0.00 57.90 58.70 2qon n TYR 798 Cb 0.21 0.24 0.06 0.00 -0.38 0.00 0.00 39.34 39.46 2qon n TYR 798 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2qon n ARG 799 N -0.00 -6.26 -2.86 -3.48 1.74 -0.40 -4.91 116.66 100.48 2qon n ARG 799 Ca -0.08 0.87 -0.43 0.00 -0.77 0.00 0.00 57.85 57.43 2qon n ARG 799 Cb 0.92 -5.80 -0.02 0.00 -1.02 0.00 0.00 32.46 26.54 2qon n ARG 799 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2qon s LYS 800 N -5.97 3.65 -0.30 5.56 2.47 -1.09 -4.91 119.74 119.14 2qon s LYS 800 Ca 0.43 -1.74 -0.11 0.00 -1.56 0.00 0.00 55.97 52.99 2qon s LYS 800 Cb -0.19 -5.01 -0.03 0.00 -1.46 0.00 0.00 37.83 31.14 2qon s LYS 800 CO 0.53 -1.85 0.19 -0.06 0.16 0.00 0.00 175.35 174.32 2qon s PHE 801 N 2.97 3.20 0.31 4.03 0.08 -1.26 -3.65 117.98 123.66 2qon s PHE 801 Ca 0.36 -0.18 0.03 0.00 0.12 0.00 0.00 56.93 57.25 2qon s PHE 801 Cb -0.04 -2.39 -0.02 0.00 -0.57 0.00 0.00 43.02 40.00 2qon s PHE 801 CO -0.08 -0.31 0.31 0.95 -0.10 0.00 0.00 175.22 175.99 2qon s THR 802 N 1.70 0.00 0.36 0.64 -4.23 -1.26 -5.00 115.64 107.85 2qon s THR 802 Ca 0.06 -1.87 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 2qon s THR 802 Cb -0.17 -2.53 0.28 0.00 1.34 0.00 0.00 72.50 71.42 2qon s THR 802 CO 0.09 0.00 1.99 0.77 -0.54 0.00 0.00 174.62 176.93 2qon h SER 803 N 2.22 0.70 0.53 3.99 4.64 -1.97 -1.37 113.55 122.29 2qon h SER 803 Ca -0.28 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.01 2qon h SER 803 Cb 1.24 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2qon h SER 803 CO 0.40 0.49 -0.11 0.00 -0.87 0.00 0.00 176.83 176.74 2qon h ALA 804 N 1.61 1.16 0.03 5.18 0.00 -1.93 0.90 119.26 126.21 2qon h ALA 804 Ca 0.27 -0.10 -0.22 0.00 0.00 0.00 0.00 54.91 54.86 2qon h ALA 804 Cb 0.05 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2qon h ALA 804 CO -0.07 0.13 -1.04 0.66 0.00 0.00 0.00 179.25 178.93 2qon h SER 805 N 0.00 0.14 -0.06 0.00 4.64 -1.59 -2.38 113.55 114.29 2qon h SER 805 Ca -0.00 -0.14 -0.11 0.00 -0.47 0.00 0.00 61.79 61.06 2qon h SER 805 Cb 0.40 -0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 2qon h SER 805 CO 0.01 1.08 -0.32 0.44 -0.87 0.00 0.00 176.83 177.18 2qon h ASP 806 N 0.03 0.56 -0.71 4.97 3.32 -0.71 -2.31 116.42 121.56 2qon h ASP 806 Ca -0.05 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.76 2qon h ASP 806 Cb 1.78 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 41.14 2qon h ASP 806 CO 0.15 0.84 0.34 0.58 -1.72 0.00 0.00 179.24 179.43 2qon h VAL 807 N 0.46 1.24 -0.42 -1.35 2.07 -0.73 0.30 116.25 117.82 2qon h VAL 807 Ca 0.06 -0.67 0.08 0.00 0.82 0.00 0.00 66.70 66.99 2qon h VAL 807 Cb 0.78 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.83 2qon h VAL 807 CO 0.06 0.28 -0.05 -0.25 0.02 0.00 0.00 177.57 177.63 2qon h TRP 808 N 1.00 -0.12 -0.69 1.57 2.91 -1.21 -0.67 115.95 118.74 2qon h TRP 808 Ca 0.24 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 60.22 2qon h TRP 808 Cb 0.13 0.12 -0.03 0.00 -0.51 0.00 0.00 29.16 28.87 2qon h TRP 808 CO 0.01 -0.13 0.13 0.77 -1.03 0.00 0.00 178.44 178.18 2qon h SER 809 N 0.05 1.07 -0.94 2.65 0.02 -0.84 -1.11 113.55 114.46 2qon h SER 809 Ca 0.20 -0.25 0.07 0.00 -0.84 0.00 0.00 61.79 60.97 2qon h SER 809 Cb 0.30 -0.28 -0.07 0.00 0.14 0.00 0.00 62.40 62.49 2qon h SER 809 CO -0.39 1.05 0.60 0.22 -1.14 0.00 0.00 176.83 177.17 2qon h TYR 810 N 1.05 1.11 -0.80 3.45 3.20 -0.38 0.06 116.97 124.66 2qon h TYR 810 Ca 0.21 0.03 0.08 0.00 3.14 0.00 0.00 58.73 62.19 2qon h TYR 810 Cb 0.42 -0.36 -0.07 0.00 1.54 0.00 0.00 36.73 38.26 2qon h TYR 810 CO 0.03 0.57 0.47 0.78 -1.64 0.00 0.00 178.16 178.37 2qon h GLY 811 N 1.08 1.22 0.92 1.82 0.00 0.14 0.21 103.07 108.47 2qon h GLY 811 Ca 0.41 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2qon h GLY 811 CO -0.18 0.18 0.06 -2.22 0.00 0.00 0.00 176.54 174.38 2qon h ILE 812 N 0.83 1.24 -0.92 2.60 1.08 -0.85 -2.16 117.51 119.33 2qon h ILE 812 Ca 0.37 -0.83 0.06 0.00 -0.39 0.00 0.00 64.86 64.07 2qon h ILE 812 Cb 0.27 1.09 -0.06 0.00 -3.07 0.00 0.00 36.82 35.04 2qon h ILE 812 CO -0.21 0.28 0.58 0.58 -0.69 0.00 0.00 178.15 178.69 2qon h VAL 813 N 0.43 1.07 -0.46 1.67 2.07 -0.20 0.12 116.25 120.95 2qon h VAL 813 Ca 0.11 -0.36 0.04 0.00 0.82 0.00 0.00 66.70 67.31 2qon h VAL 813 Cb 0.35 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 2qon h VAL 813 CO 0.01 0.19 0.22 0.25 0.02 0.00 0.00 177.57 178.26 2qon h LEU 814 N 1.06 0.31 -0.79 2.57 5.85 -0.36 0.76 115.31 124.71 2qon h LEU 814 Ca 0.40 0.03 -0.03 0.00 0.84 0.00 0.00 57.88 59.11 2qon h LEU 814 Cb 0.16 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 2qon h LEU 814 CO -0.17 0.22 0.36 -0.25 -0.34 0.00 0.00 178.44 178.26 2qon h TRP 815 N 0.44 1.17 -0.48 1.25 7.01 -0.70 -1.19 115.95 123.45 2qon h TRP 815 Ca 0.20 -0.07 -0.02 0.00 2.11 0.00 0.00 58.89 61.12 2qon h TRP 815 Cb 0.12 -0.36 -0.02 0.00 -2.10 0.00 0.00 29.16 26.80 2qon h TRP 815 CO -0.11 0.86 0.24 0.93 -2.79 0.00 0.00 178.44 177.57 2qon h GLU 816 N 1.13 0.68 0.11 2.65 5.08 -0.22 -1.03 114.58 122.98 2qon h GLU 816 Ca 0.27 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.53 2qon h GLU 816 Cb 0.15 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2qon h GLU 816 CO -0.03 0.56 -0.05 0.28 -1.00 0.00 0.00 179.01 178.77 2qon h VAL 817 N 0.63 1.04 0.00 3.13 2.07 -0.73 0.15 116.25 122.54 2qon h VAL 817 Ca 0.17 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2qon h VAL 817 Cb 0.10 1.42 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2qon h VAL 817 CO -0.02 0.14 0.00 0.24 0.02 0.00 0.00 177.57 177.95 2qon h MET 818 N -0.42 0.00 -0.57 1.57 2.86 -1.13 -1.77 114.93 115.47 2qon h MET 818 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2qon h MET 818 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 2qon h MET 818 CO 0.02 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 176.86 2qon n SER 819 N -2.59 3.68 -3.63 1.22 3.41 -0.40 -4.72 113.62 110.60 2qon n SER 819 Ca 0.00 -1.99 -0.23 0.00 -0.26 0.00 0.00 58.87 56.39 2qon n SER 819 Cb 0.18 -0.38 0.07 0.00 -0.26 0.00 0.00 64.21 63.82 2qon n SER 819 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2qon n TYR 820 N 1.49 -2.50 -0.85 7.33 4.01 -0.66 -3.09 117.16 122.89 2qon n TYR 820 Ca 0.21 0.96 0.00 0.00 -0.16 0.00 0.00 57.90 58.91 2qon n TYR 820 Cb 0.60 -4.79 0.00 0.00 -0.31 0.00 0.00 39.34 34.84 2qon n TYR 820 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2qon n GLY 821 N -1.68 0.54 3.58 2.72 0.00 0.47 -3.08 105.19 107.74 2qon n GLY 821 Ca -0.10 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.22 2qon n GLY 821 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2qon n GLU 822 N -2.85 0.91 -2.52 1.61 1.02 -1.18 -4.88 120.64 112.75 2qon n GLU 822 Ca 0.00 0.34 -0.42 0.00 -0.02 0.00 0.00 57.16 57.06 2qon n GLU 822 Cb 0.00 -2.03 -0.03 0.00 -0.02 0.00 0.00 31.44 29.36 2qon n GLU 822 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2qon s ARG 823 N -2.43 4.36 -0.01 3.49 3.52 -1.26 -4.76 118.95 121.86 2qon s ARG 823 Ca 0.71 1.59 -0.37 0.00 -0.13 0.00 0.00 55.73 57.54 2qon s ARG 823 Cb -0.45 -3.56 -0.15 0.00 -1.56 0.00 0.00 34.95 29.22 2qon s ARG 823 CO 0.51 -0.43 1.56 -2.30 -0.81 0.00 0.00 175.30 173.83 2qon n PRO 824 N 5.24 1.49 -1.35 5.12 -0.02 -1.26 -1.06 135.00 143.16 2qon n PRO 824 Ca 0.11 0.54 -0.12 0.00 -2.02 0.00 0.00 63.50 62.00 2qon n PRO 824 Cb 0.47 -2.24 -0.05 0.00 -0.02 0.00 0.00 33.50 31.65 2qon n PRO 824 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2qon n TYR 825 N 3.93 0.00 0.00 6.00 4.01 -1.26 -4.80 117.16 125.04 2qon n TYR 825 Ca 0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.95 2qon n TYR 825 Cb 0.21 -2.66 0.00 0.00 -0.31 0.00 0.00 39.34 36.58 2qon n TYR 825 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2qon n TRP 826 N -2.35 0.00 -1.27 -0.72 8.01 -0.22 -1.55 117.44 119.34 2qon n TRP 826 Ca -0.12 0.00 -0.02 0.00 -1.31 0.00 0.00 57.50 56.05 2qon n TRP 826 Cb 0.55 0.00 0.22 0.00 -2.01 0.00 0.00 31.31 30.07 2qon n TRP 826 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.69 177.07 2qon n GLU 827 N 14.00 2.28 -1.54 -0.99 -0.58 -1.26 -4.94 120.64 127.61 2qon n GLU 827 Ca 0.00 -3.06 -0.41 0.00 -0.42 0.00 0.00 57.16 53.27 2qon n GLU 827 Cb 0.00 -1.87 0.02 0.00 -0.57 0.00 0.00 31.44 29.02 2qon n GLU 827 CO 0.00 0.00 0.00 -1.33 -0.48 0.00 0.00 177.13 175.32 2qon n MET 828 N -0.90 0.93 -1.65 3.49 2.81 -0.60 -4.89 117.12 116.32 2qon n MET 828 Ca 0.32 0.34 -0.41 0.00 -1.81 0.00 0.00 57.70 56.14 2qon n MET 828 Cb 1.06 -1.82 0.02 0.00 -0.71 0.00 0.00 33.22 31.76 2qon n MET 828 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 2qon n SER 829 N 0.66 1.75 -0.10 7.83 7.64 -1.26 -4.79 113.62 125.35 2qon n SER 829 Ca 0.11 1.04 0.04 0.00 1.01 0.00 0.00 58.87 61.06 2qon n SER 829 Cb 0.41 -1.42 0.36 0.00 -1.01 0.00 0.00 64.21 62.55 2qon n SER 829 CO 0.00 0.00 0.00 0.78 -3.01 0.00 0.00 175.04 172.81 2qon h ASN 830 N 1.63 0.62 0.48 6.43 -0.26 -2.00 -0.21 115.58 122.26 2qon h ASN 830 Ca -0.46 -0.01 -0.09 0.00 -0.56 0.00 0.00 56.30 55.18 2qon h ASN 830 Cb 1.32 -0.15 -0.01 0.00 -1.06 0.00 0.00 38.32 38.42 2qon h ASN 830 CO 0.57 0.43 -0.42 0.06 -1.06 0.00 0.00 177.43 177.02 2qon h GLN 831 N 0.72 0.00 0.01 0.81 3.07 -2.00 -1.44 115.11 116.29 2qon h GLN 831 Ca 0.23 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.77 2qon h GLN 831 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.55 2qon h GLN 831 CO -0.06 0.42 -0.92 -0.44 0.09 0.00 0.00 178.83 177.92 2qon h ASP 832 N 0.00 0.05 -0.41 0.06 3.32 -1.44 -2.05 116.42 115.95 2qon h ASP 832 Ca -0.00 -0.05 -0.06 0.00 0.02 0.00 0.00 57.03 56.94 2qon h ASP 832 Cb 0.77 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.29 2qon h ASP 832 CO 0.05 0.94 0.01 0.58 -1.72 0.00 0.00 179.24 179.11 2qon h VAL 833 N 0.02 1.26 -0.34 -1.35 2.07 -0.60 -0.28 116.25 117.02 2qon h VAL 833 Ca -0.02 -0.99 -0.02 0.00 0.82 0.00 0.00 66.70 66.49 2qon h VAL 833 Cb 1.62 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 2qon h VAL 833 CO 0.12 0.34 0.13 0.40 0.02 0.00 0.00 177.57 178.58 2qon h ILE 834 N 0.55 1.19 -0.09 4.57 2.04 -1.27 -2.63 117.51 121.87 2qon h ILE 834 Ca 0.12 -0.60 -0.17 0.00 1.00 0.00 0.00 64.86 65.21 2qon h ILE 834 Cb 0.46 0.95 0.01 0.00 -0.74 0.00 0.00 36.82 37.50 2qon h ILE 834 CO 0.02 0.21 -0.60 0.50 0.00 0.00 0.00 178.15 178.28 2qon h LYS 835 N 0.40 0.57 -0.38 2.37 1.63 -1.32 -2.03 116.57 117.81 2qon h LYS 835 Ca 0.11 -0.49 -0.00 0.00 -0.85 0.00 0.00 60.65 59.42 2qon h LYS 835 Cb 0.20 0.11 -0.02 0.00 -0.60 0.00 0.00 32.23 31.92 2qon h LYS 835 CO -0.01 1.11 0.23 0.00 -3.45 0.00 0.00 179.45 177.33 2qon h ALA 836 N 0.46 0.48 -0.45 5.00 0.00 -1.07 -0.29 119.26 123.39 2qon h ALA 836 Ca -0.05 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 2qon h ALA 836 Cb 1.25 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2qon h ALA 836 CO 0.12 -0.03 -0.12 0.28 0.00 0.00 0.00 179.25 179.51 2qon h VAL 837 N 0.49 1.26 -0.83 0.00 2.07 -1.51 -1.18 116.25 116.55 2qon h VAL 837 Ca 0.14 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 2qon h VAL 837 Cb 0.00 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 2qon h VAL 837 CO -0.03 0.41 0.45 -0.78 0.02 0.00 0.00 177.57 177.64 2qon h ASP 838 N 0.74 1.05 0.42 0.57 3.58 -0.85 -2.42 116.42 119.51 2qon h ASP 838 Ca 0.12 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2qon h ASP 838 Cb 0.61 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.39 2qon h ASP 838 CO 0.04 0.86 0.00 -0.62 -2.88 0.00 0.00 179.24 176.64 2qon n GLU 839 N -4.37 0.11 0.00 0.28 1.02 -0.16 -4.86 120.64 112.65 2qon n GLU 839 Ca 0.08 0.18 0.00 0.00 -0.02 0.00 0.00 57.16 57.40 2qon n GLU 839 Cb 0.10 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.02 2qon n GLU 839 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qon n GLY 840 N 0.10 0.74 3.77 0.62 0.00 -0.91 -4.90 105.19 104.61 2qon n GLY 840 Ca 0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 2qon n GLY 840 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qon s TYR 841 N -2.00 3.01 0.08 1.61 2.02 -0.48 0.68 117.35 122.26 2qon s TYR 841 Ca 0.00 1.57 -0.00 0.00 -0.37 0.00 0.00 57.07 58.27 2qon s TYR 841 Cb 0.00 -3.29 -0.04 0.00 -0.40 0.00 0.00 41.96 38.23 2qon s TYR 841 CO 0.00 -1.20 -0.03 1.03 -1.57 0.00 0.00 175.55 173.78 2qon s ARG 842 N -2.63 0.72 0.32 -0.62 1.81 0.61 -4.17 118.95 114.99 2qon s ARG 842 Ca 0.62 -1.28 -0.29 0.00 -1.72 0.00 0.00 55.73 53.05 2qon s ARG 842 Cb -0.26 0.08 -0.13 0.00 -0.45 0.00 0.00 34.95 34.19 2qon s ARG 842 CO 0.32 -0.10 1.33 1.28 -0.68 0.00 0.00 175.30 177.46 2qon n LEU 843 N 0.04 3.49 -4.86 2.53 4.77 -1.26 -0.62 117.00 121.09 2qon n LEU 843 Ca -0.12 1.19 -0.30 0.00 -0.03 0.00 0.00 56.01 56.74 2qon n LEU 843 Cb 0.61 -1.48 0.06 0.00 -2.33 0.00 0.00 43.42 40.28 2qon n LEU 843 CO 0.29 -0.45 0.74 -2.16 -1.33 0.00 0.00 177.39 174.48 2qon s PRO 844 N -1.46 2.68 0.25 3.23 0.04 -1.26 -4.72 135.00 133.75 2qon s PRO 844 Ca 0.59 0.56 -0.30 0.00 0.04 0.00 0.00 61.00 61.88 2qon s PRO 844 Cb -0.58 -1.99 -0.10 0.00 0.04 0.00 0.00 34.50 31.86 2qon s PRO 844 CO 0.59 -1.18 1.50 -1.25 0.04 0.00 0.00 177.00 176.69 2qon s PRO 845 N -5.27 4.22 0.81 0.56 0.04 -1.26 -4.98 135.00 129.13 2qon s PRO 845 Ca 0.59 2.38 -0.13 0.00 0.04 0.00 0.00 61.00 63.88 2qon s PRO 845 Cb -0.12 -3.09 0.09 0.00 0.04 0.00 0.00 34.50 31.41 2qon s PRO 845 CO 0.53 -0.50 1.19 -2.14 0.04 0.00 0.00 177.00 176.12 2qon s PRO 846 N -0.19 1.61 0.15 0.56 0.02 -1.26 -4.92 135.00 130.98 2qon s PRO 846 Ca 0.62 1.69 -0.34 0.00 0.02 0.00 0.00 61.00 62.99 2qon s PRO 846 Cb -0.44 -1.78 -0.14 0.00 0.02 0.00 0.00 34.50 32.16 2qon s PRO 846 CO 0.43 -2.22 1.53 -0.12 -0.33 0.00 0.00 177.00 176.28 2qon n MET 847 N -3.40 1.96 -1.43 5.54 0.00 -1.26 -1.69 117.12 116.84 2qon n MET 847 Ca 0.13 0.71 -0.15 0.00 -0.00 0.00 0.00 57.70 58.39 2qon n MET 847 Cb 0.51 -2.45 -0.06 0.00 0.00 0.00 0.00 33.22 31.22 2qon n MET 847 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 2qon n ASP 848 N 3.20 -4.91 -4.67 6.12 8.00 -1.26 -4.95 116.55 118.07 2qon n ASP 848 Ca 0.17 0.36 -0.42 0.00 0.71 0.00 0.00 54.79 55.61 2qon n ASP 848 Cb 0.27 -3.71 -0.03 0.00 -0.02 0.00 0.00 41.12 37.63 2qon n ASP 848 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qon n PRO 850 N 6.25 1.47 -0.36 0.00 -0.02 -1.26 -0.84 135.00 140.24 2qon n PRO 850 Ca 0.15 0.52 0.01 0.00 -2.02 0.00 0.00 63.50 62.15 2qon n PRO 850 Cb 0.44 -1.93 0.15 0.00 -0.02 0.00 0.00 33.50 32.13 2qon n PRO 850 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qon h ALA 851 N 2.27 1.32 -0.69 3.55 0.00 -1.14 -1.55 119.26 123.01 2qon h ALA 851 Ca -0.41 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.48 2qon h ALA 851 Cb 1.33 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 2qon h ALA 851 CO 0.62 0.47 0.46 0.00 0.00 0.00 0.00 179.25 180.80 2qon h ALA 852 N 1.42 1.52 0.17 0.00 0.00 -1.89 -0.22 119.26 120.26 2qon h ALA 852 Ca 0.40 -0.05 -0.29 0.00 0.00 0.00 0.00 54.91 54.97 2qon h ALA 852 Cb 0.08 -0.27 0.01 0.00 0.00 0.00 0.00 17.79 17.61 2qon h ALA 852 CO -0.15 0.44 -1.32 -0.07 0.00 0.00 0.00 179.25 178.15 2qon h LEU 853 N 0.92 0.55 -0.57 0.00 3.38 -1.70 -2.14 115.31 115.75 2qon h LEU 853 Ca 0.26 -0.59 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 2qon h LEU 853 Cb -0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 2qon h LEU 853 CO -0.06 1.46 0.06 0.22 0.09 0.00 0.00 178.44 180.22 2qon h TYR 854 N 0.10 1.03 -0.92 1.13 3.20 -1.07 -1.78 116.97 118.65 2qon h TYR 854 Ca -0.17 -0.15 0.04 0.00 3.14 0.00 0.00 58.73 61.58 2qon h TYR 854 Cb 2.03 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 39.97 2qon h TYR 854 CO 0.08 0.91 0.60 0.37 -1.64 0.00 0.00 178.16 178.48 2qon h GLN 855 N 0.85 1.12 -0.53 1.82 5.75 -1.07 -0.91 115.11 122.14 2qon h GLN 855 Ca 0.17 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.59 2qon h GLN 855 Cb 0.46 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 28.73 2qon h GLN 855 CO 0.02 0.74 0.29 1.25 -2.65 0.00 0.00 178.83 178.48 2qon h LEU 856 N 1.16 0.66 -0.31 -2.39 5.85 -1.03 -0.91 115.31 118.35 2qon h LEU 856 Ca 0.37 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.06 2qon h LEU 856 Cb 0.01 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.81 2qon h LEU 856 CO -0.12 0.57 -0.11 0.24 -0.34 0.00 0.00 178.44 178.67 2qon h MET 857 N 0.71 -0.05 -0.61 1.25 2.86 -0.79 -0.59 114.93 117.71 2qon h MET 857 Ca 0.19 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2qon h MET 857 Cb 0.05 0.01 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 2qon h MET 857 CO -0.03 -0.03 0.40 -0.07 1.06 0.00 0.00 176.91 178.24 2qon h LEU 858 N -0.05 0.70 -0.31 1.22 3.38 -0.65 -0.76 115.31 118.85 2qon h LEU 858 Ca 0.15 -0.02 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 2qon h LEU 858 Cb 0.28 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.85 2qon h LEU 858 CO -0.34 0.51 -0.42 0.44 0.09 0.00 0.00 178.44 178.71 2qon h ASP 859 N 0.82 0.90 0.08 -0.43 3.32 -0.72 -2.62 116.42 117.78 2qon h ASP 859 Ca 0.22 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.76 2qon h ASP 859 Cb -0.09 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.20 2qon h ASP 859 CO -0.05 1.23 -0.06 0.00 -1.72 0.00 0.00 179.24 178.64 2qon n TRP 861 N -4.29 2.51 -1.91 0.00 8.01 -0.37 -3.67 117.44 117.72 2qon n TRP 861 Ca -0.03 -1.24 -0.41 0.00 -1.31 0.00 0.00 57.50 54.51 2qon n TRP 861 Cb 0.15 -0.71 -0.01 0.00 -2.01 0.00 0.00 31.31 28.72 2qon n TRP 861 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.69 176.03 2qon s GLN 862 N -2.96 4.20 0.14 -0.99 -1.52 -1.09 -4.91 119.66 112.53 2qon s GLN 862 Ca 0.55 2.44 -0.18 0.00 -1.95 0.00 0.00 55.36 56.21 2qon s GLN 862 Cb 0.44 -3.04 0.03 0.00 -0.22 0.00 0.00 33.01 30.22 2qon s GLN 862 CO 0.13 -0.46 1.71 -0.22 -0.25 0.00 0.00 175.29 176.20 2qon h LYS 863 N 4.00 0.07 -6.35 2.91 3.64 -1.93 -3.38 116.57 115.53 2qon h LYS 863 Ca -0.48 -0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.31 2qon h LYS 863 Cb 1.23 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.95 2qon h LYS 863 CO 0.71 0.05 0.75 0.34 -2.27 0.00 0.00 179.45 179.03 2qon s ASP 864 N -5.25 6.67 0.46 4.20 2.15 -1.26 -4.92 116.67 118.73 2qon s ASP 864 Ca -0.13 0.53 0.18 0.00 0.43 0.00 0.00 52.55 53.56 2qon s ASP 864 Cb 0.12 -2.50 1.16 0.00 -0.30 0.00 0.00 42.92 41.39 2qon s ASP 864 CO 0.70 -1.04 1.95 0.08 -0.17 0.00 0.00 175.17 176.69 2qon h ARG 865 N 8.79 0.28 0.00 4.34 0.11 -1.96 0.12 114.38 126.06 2qon h ARG 865 Ca -0.23 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.84 2qon h ARG 865 Cb 1.07 -0.06 0.00 0.00 1.11 0.00 0.00 29.97 32.09 2qon h ARG 865 CO 1.05 0.18 0.00 -0.91 0.10 0.00 0.00 179.97 180.39 2qon h ASN 866 N 0.29 0.00 0.10 0.08 -0.26 -1.93 -2.92 115.58 110.93 2qon h ASN 866 Ca 0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.06 2qon h ASN 866 Cb 0.86 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.12 2qon h ASN 866 CO -0.08 0.00 -0.16 0.59 -1.06 0.00 0.00 177.43 176.72 2qon n ASN 867 N -3.01 1.44 -4.80 5.81 3.02 0.43 -4.92 115.26 113.22 2qon n ASN 867 Ca -0.01 -1.26 -0.33 0.00 -0.03 0.00 0.00 54.58 52.96 2qon n ASN 867 Cb 0.21 0.10 -0.00 0.00 -0.61 0.00 0.00 39.78 39.49 2qon n ASN 867 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2qon s ARG 868 N -2.27 3.48 0.71 3.52 0.52 -1.11 -4.97 118.95 118.83 2qon s ARG 868 Ca 0.29 1.22 -0.13 0.00 -0.52 0.00 0.00 55.73 56.59 2qon s ARG 868 Cb 0.20 -2.05 0.03 0.00 0.52 0.00 0.00 34.95 33.64 2qon s ARG 868 CO 0.44 -0.68 1.11 -1.25 0.02 0.00 0.00 175.30 174.94 2qon s PRO 869 N -3.88 2.51 0.48 3.54 0.04 -1.26 -5.03 135.00 131.40 2qon s PRO 869 Ca 0.64 1.34 -0.09 0.00 0.04 0.00 0.00 61.00 62.93 2qon s PRO 869 Cb -0.16 -1.92 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 2qon s PRO 869 CO 0.33 -1.47 0.83 0.15 0.04 0.00 0.00 177.00 176.88 2qon s LYS 870 N -4.39 3.66 0.32 4.56 -0.14 -1.26 -4.94 119.74 117.56 2qon s LYS 870 Ca 0.65 0.43 0.04 0.00 -1.36 0.00 0.00 55.97 55.74 2qon s LYS 870 Cb -0.20 -2.32 0.66 0.00 -1.68 0.00 0.00 37.83 34.29 2qon s LYS 870 CO 0.47 -0.21 1.88 0.74 -0.76 0.00 0.00 175.35 177.47 2qon h PHE 871 N 0.53 0.97 -0.94 3.18 0.04 -1.94 -1.03 116.94 117.75 2qon h PHE 871 Ca -0.46 0.03 0.04 0.00 2.80 0.00 0.00 57.97 60.38 2qon h PHE 871 Cb 1.19 -0.31 -0.06 0.00 2.20 0.00 0.00 35.95 38.98 2qon h PHE 871 CO 0.61 0.42 0.61 1.49 -0.60 0.00 0.00 178.31 180.84 2qon h GLU 872 N 0.88 1.11 -0.31 1.51 4.81 -1.93 -0.85 114.58 119.80 2qon h GLU 872 Ca 0.43 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.44 2qon h GLU 872 Cb 0.47 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 2qon h GLU 872 CO -0.20 0.74 -0.41 1.96 -0.73 0.00 0.00 179.01 180.37 2qon h GLN 873 N 1.15 0.77 -0.37 1.92 4.20 -1.61 -2.32 115.11 118.86 2qon h GLN 873 Ca 0.38 -0.41 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 2qon h GLN 873 Cb 0.06 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 2qon h GLN 873 CO -0.13 1.04 0.21 0.82 -0.67 0.00 0.00 178.83 180.10 2qon h ILE 874 N 0.63 1.14 -0.63 2.54 2.04 -0.91 0.66 117.51 122.98 2qon h ILE 874 Ca 0.05 -0.35 0.05 0.00 1.00 0.00 0.00 64.86 65.61 2qon h ILE 874 Cb 0.97 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 37.70 2qon h ILE 874 CO 0.09 0.14 0.35 0.58 0.00 0.00 0.00 178.15 179.31 2qon h VAL 875 N 0.47 0.98 -0.22 1.67 2.07 -1.06 -1.63 116.25 118.53 2qon h VAL 875 Ca 0.13 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.42 2qon h VAL 875 Cb 0.05 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 2qon h VAL 875 CO -0.02 0.12 0.12 -1.28 0.02 0.00 0.00 177.57 176.53 2qon h SER 876 N 0.66 0.27 -0.32 0.57 0.87 -0.97 0.16 113.55 114.80 2qon h SER 876 Ca 0.28 -0.08 0.06 0.00 -1.23 0.00 0.00 61.79 60.81 2qon h SER 876 Cb 0.15 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 61.99 2qon h SER 876 CO -0.17 0.28 -0.03 0.40 -0.53 0.00 0.00 176.83 176.79 2qon h ILE 877 N 0.25 0.73 -0.44 2.23 2.04 -0.62 -1.33 117.51 120.38 2qon h ILE 877 Ca 0.08 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.79 2qon h ILE 877 Cb 0.07 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 2qon h ILE 877 CO -0.01 0.01 -0.22 -0.07 0.00 0.00 0.00 178.15 177.86 2qon h LEU 878 N 0.06 0.90 -1.23 1.44 3.38 -1.04 -2.23 115.31 116.59 2qon h LEU 878 Ca 0.16 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.83 2qon h LEU 878 Cb 0.22 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 2qon h LEU 878 CO -0.29 1.08 0.53 0.44 0.09 0.00 0.00 178.44 180.30 2qon h ASP 879 N 0.76 0.86 -0.72 -0.43 3.32 -0.40 -0.39 116.42 119.42 2qon h ASP 879 Ca 0.10 -0.01 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 2qon h ASP 879 Cb 0.76 -0.20 -0.03 0.00 0.22 0.00 0.00 39.33 40.08 2qon h ASP 879 CO 0.06 0.59 0.19 0.11 -1.72 0.00 0.00 179.24 178.48 2qon h LYS 880 N 1.00 1.15 -0.36 3.56 1.57 -0.98 -0.29 116.57 122.22 2qon h LYS 880 Ca 0.32 -0.27 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 2qon h LYS 880 Cb 0.04 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2qon h LYS 880 CO -0.09 1.00 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.55 2qon h LEU 881 N 1.09 0.64 -0.72 2.94 3.38 -0.88 -1.56 115.31 120.20 2qon h LEU 881 Ca 0.23 -0.20 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 2qon h LEU 881 Cb 0.35 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2qon h LEU 881 CO -0.00 0.82 -0.09 0.40 0.09 0.00 0.00 178.44 179.66 2qon h ILE 882 N 0.59 1.26 -0.11 1.22 2.04 -0.89 -2.90 117.51 118.72 2qon h ILE 882 Ca 0.10 -1.19 -0.12 0.00 1.00 0.00 0.00 64.86 64.65 2qon h ILE 882 Cb 0.61 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.65 2qon h ILE 882 CO 0.04 0.41 -0.49 -0.09 0.00 0.00 0.00 178.15 178.03 2qon h ARG 883 N 0.81 0.27 -2.33 2.37 2.43 -0.85 -3.36 114.38 113.72 2qon h ARG 883 Ca 0.14 -0.15 -0.59 0.00 -0.81 0.00 0.00 59.98 58.56 2qon h ARG 883 Cb 0.60 0.01 -0.41 0.00 -0.42 0.00 0.00 29.97 29.75 2qon h ARG 883 CO 0.04 0.70 -0.78 -1.71 -1.51 0.00 0.00 179.97 176.71 2qon n ASN 884 N -3.97 2.10 0.31 -3.80 5.15 -0.60 -4.98 115.26 109.48 2qon n ASN 884 Ca -0.02 -3.06 0.18 0.00 -0.60 0.00 0.00 54.58 51.09 2qon n ASN 884 Cb 0.54 -0.66 1.00 0.00 -0.53 0.00 0.00 39.78 40.12 2qon n ASN 884 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 2qon h PRO 885 N 4.53 0.00 -0.43 1.20 0.13 -1.67 -0.86 132.00 134.90 2qon h PRO 885 Ca 0.16 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.34 2qon h PRO 885 Cb 0.77 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.88 2qon h PRO 885 CO 0.65 0.02 0.29 0.78 -0.23 0.00 0.00 178.00 179.52 2qon h GLY 886 N 0.39 0.46 -0.55 1.56 0.00 -1.93 -1.95 103.07 101.04 2qon h GLY 886 Ca -0.00 -0.15 0.27 0.00 0.00 0.00 0.00 47.33 47.44 2qon h GLY 886 CO 0.00 0.13 0.29 1.76 0.00 0.00 0.00 176.54 178.72 2qon h SER 887 N 0.39 0.06 0.37 0.19 0.02 -1.48 -0.77 113.55 112.32 2qon h SER 887 Ca 0.18 0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2qon h SER 887 Cb 0.24 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.05 2qon h SER 887 CO -0.04 -0.19 0.00 0.18 -1.14 0.00 0.00 176.83 175.63 2qon n LEU 888 N -5.23 0.00 0.15 5.07 4.77 -0.73 -2.96 117.00 118.08 2qon n LEU 888 Ca 0.24 0.42 0.13 0.00 -0.03 0.00 0.00 56.01 56.77 2qon n LEU 888 Cb 0.78 -0.42 0.28 0.00 -2.33 0.00 0.00 43.42 41.74 2qon n LEU 888 CO 0.05 -0.23 0.81 0.11 -1.33 0.00 0.00 177.39 176.80 2qon h LYS 889 N 0.00 0.00 -6.47 3.23 1.57 -1.26 -3.42 116.57 110.23 2qon h LYS 889 Ca 0.00 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 58.21 2qon h LYS 889 Cb 0.18 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.44 2qon h LYS 889 CO 0.00 0.00 1.03 0.42 -0.57 0.00 0.00 179.45 180.33 2qon s ILE 890 N -3.16 3.99 0.09 1.86 1.01 -1.15 -5.01 121.20 118.83 2qon s ILE 890 Ca 0.09 1.05 0.05 0.00 0.00 0.00 0.00 60.65 61.84 2qon s ILE 890 Cb 0.09 -4.18 -0.04 0.00 0.01 0.00 0.00 42.46 38.34 2qon s ILE 890 CO 0.64 -0.65 0.00 -0.63 0.00 0.00 0.00 174.94 174.30 2qon s ILE 891 N 5.03 4.03 0.38 2.92 -1.09 -1.26 -0.65 121.20 130.56 2qon s ILE 891 Ca 0.59 -0.99 -0.24 0.00 -2.23 0.00 0.00 60.65 57.78 2qon s ILE 891 Cb -0.15 -2.93 -0.09 0.00 -1.58 0.00 0.00 42.46 37.71 2qon s ILE 891 CO 0.29 0.11 1.02 -0.89 -1.23 0.00 0.00 174.94 174.24 2qon s THR 892 N -1.33 3.90 0.36 2.92 2.01 -0.02 -4.63 115.64 118.85 2qon s THR 892 Ca 0.26 1.46 -0.28 0.00 0.31 0.00 0.00 61.69 63.44 2qon s THR 892 Cb -0.12 -3.76 -0.10 0.00 0.01 0.00 0.00 72.50 68.53 2qon s THR 892 CO 0.18 0.01 1.38 -0.94 -0.69 0.00 0.00 174.62 174.57 2qon s SER 893 N -1.63 6.55 0.85 3.53 1.04 -1.26 -4.67 113.70 118.11 2qon s SER 893 Ca 0.56 2.84 0.00 0.00 0.48 0.00 0.00 55.95 59.83 2qon s SER 893 Cb -0.20 -2.66 0.00 0.00 0.10 0.00 0.00 66.02 63.26 2qon s SER 893 CO 0.25 -0.71 0.00 0.00 0.98 0.00 0.00 173.24 173.77 2qon n ALA 894 N 0.60 0.00 -1.66 5.32 0.00 -1.26 -5.03 120.51 118.47 2qon n ALA 894 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.44 2qon n ALA 894 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2qon n ALA 894 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2qon n PRO 898 N 1.99 -0.17 -2.25 0.00 -0.02 -1.26 -4.98 135.00 128.31 2qon n PRO 898 Ca 0.00 0.37 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 2qon n PRO 898 Cb 0.00 -1.92 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 2qon n PRO 898 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2qon s SER 899 N -2.52 5.66 0.10 2.55 0.01 -1.26 -4.96 113.70 113.28 2qon s SER 899 Ca 0.02 -1.87 0.03 0.00 1.31 0.00 0.00 55.95 55.44 2qon s SER 899 Cb -0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 2qon s SER 899 CO 0.07 -2.41 -0.08 0.54 0.41 0.00 0.00 173.24 171.77 2qon s ASN 900 N 5.78 1.35 0.37 2.44 4.22 -1.26 -5.08 114.94 122.76 2qon s ASN 900 Ca 0.63 -0.92 -0.13 0.00 -2.14 0.00 0.00 52.86 50.31 2qon s ASN 900 Cb 0.01 0.04 -0.08 0.00 1.28 0.00 0.00 41.25 42.50 2qon s ASN 900 CO 0.10 -0.36 0.76 -0.76 -2.04 0.00 0.00 177.10 174.81 2qon s LEU 901 N -2.79 3.93 -0.12 3.54 1.43 -1.26 -4.35 118.68 119.05 2qon s LEU 901 Ca 0.09 1.22 -0.03 0.00 -1.03 0.00 0.00 54.13 54.38 2qon s LEU 901 Cb 0.01 -4.07 -0.03 0.00 0.03 0.00 0.00 46.19 42.13 2qon s LEU 901 CO -0.02 -0.32 -0.01 -0.76 0.23 0.00 0.00 176.35 175.47 2qon s LEU 902 N -3.46 3.43 -0.15 1.79 1.43 0.21 -4.86 118.68 117.07 2qon s LEU 902 Ca 0.53 0.01 -0.29 0.00 -1.03 0.00 0.00 54.13 53.34 2qon s LEU 902 Cb -0.10 -1.81 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 2qon s LEU 902 CO 0.25 0.27 1.40 -0.22 0.23 0.00 0.00 176.35 178.27 2qon s LEU 903 N -0.22 4.18 0.00 1.79 0.20 -1.26 -0.28 118.68 123.09 2qon s LEU 903 Ca 0.05 1.80 0.00 0.00 0.69 0.00 0.00 54.13 56.67 2qon s LEU 903 Cb -0.13 -3.54 0.00 0.00 -0.43 0.00 0.00 46.19 42.10 2qon s LEU 903 CO 0.02 -0.87 0.00 0.47 -0.29 0.00 0.00 176.35 175.69 2qon n ASP 904 N 6.96 0.00 0.00 3.68 8.00 0.21 -4.94 116.55 130.47 2qon n ASP 904 Ca 0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.65 2qon n ASP 904 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.54 2qon n ASP 904 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81