#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oxj s MET 595 N 0.00 1.90 -0.14 -1.40 1.75 -1.26 -4.89 119.30 115.25 1oxj s MET 595 Ca 0.00 -1.14 -0.41 0.00 -1.25 0.00 0.00 55.69 52.90 1oxj s MET 595 Cb 0.00 -2.40 -0.18 0.00 2.84 0.00 0.00 34.83 35.09 1oxj s MET 595 CO 0.00 -1.25 1.40 0.28 -0.65 0.00 0.00 175.02 174.79 1oxj n VAL 596 N -2.67 0.06 -0.97 10.11 0.31 -1.26 -1.35 118.33 122.56 1oxj n VAL 596 Ca 0.14 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 1oxj n VAL 596 Cb 0.61 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.94 1oxj n VAL 596 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1oxj n GLY 597 N 2.86 0.78 0.35 2.92 0.00 -1.26 -4.22 105.19 106.63 1oxj n GLY 597 Ca 0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.28 1oxj n GLY 597 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1oxj n MET 598 N -2.18 2.17 0.28 1.61 2.00 -0.46 -3.61 117.12 116.94 1oxj n MET 598 Ca 0.00 -1.59 0.13 0.00 0.00 0.00 0.00 57.70 56.24 1oxj n MET 598 Cb 0.01 -1.15 0.81 0.00 0.00 0.00 0.00 33.22 32.89 1oxj n MET 598 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1oxj h SER 599 N 1.23 0.00 -0.64 7.83 4.64 -1.90 -2.23 113.55 122.48 1oxj h SER 599 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1oxj h SER 599 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1oxj h SER 599 CO 0.00 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 1oxj n GLY 600 N -1.06 2.65 0.30 -0.77 0.00 -1.26 -4.53 105.19 100.51 1oxj n GLY 600 Ca -0.02 -0.83 -0.03 0.00 0.00 0.00 0.00 46.02 45.14 1oxj n GLY 600 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1oxj h ILE 601 N 4.02 1.12 -0.21 -0.61 6.09 -1.73 -1.81 117.51 124.38 1oxj h ILE 601 Ca 0.00 -0.33 -0.00 0.00 -1.37 0.00 0.00 64.86 63.16 1oxj h ILE 601 Cb 1.45 0.08 -0.01 0.00 0.47 0.00 0.00 36.82 38.81 1oxj h ILE 601 CO 0.24 0.17 0.11 1.23 -3.07 0.00 0.00 178.15 176.84 1oxj h GLY 602 N 0.96 0.31 1.18 8.18 0.00 -1.83 -1.05 103.07 110.82 1oxj h GLY 602 Ca 0.31 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.44 1oxj h GLY 602 CO -0.11 0.14 0.22 -2.00 0.00 0.00 0.00 176.54 174.79 1oxj h LEU 603 N 0.22 0.95 0.05 3.11 7.12 -1.84 -1.13 115.31 123.79 1oxj h LEU 603 Ca 0.07 -0.16 -0.00 0.00 0.13 0.00 0.00 57.88 57.92 1oxj h LEU 603 Cb 0.07 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 39.96 1oxj h LEU 603 CO -0.01 0.88 -0.02 -0.25 -0.13 0.00 0.00 178.44 178.91 1oxj h TRP 604 N 0.99 -0.06 -0.81 1.25 7.01 -1.10 -1.79 115.95 121.44 1oxj h TRP 604 Ca 0.22 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.26 1oxj h TRP 604 Cb 0.27 0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.29 1oxj h TRP 604 CO 0.02 0.08 0.51 -0.07 -2.79 0.00 0.00 178.44 176.20 1oxj h LEU 605 N -0.19 0.83 -1.64 0.65 3.38 -0.97 -0.76 115.31 116.61 1oxj h LEU 605 Ca -0.01 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.00 1oxj h LEU 605 Cb 0.17 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1oxj h LEU 605 CO 0.01 0.56 0.29 0.11 0.09 0.00 0.00 178.44 179.50 1oxj h LYS 606 N 0.98 0.45 0.00 1.13 1.57 -0.98 -0.24 116.57 119.47 1oxj h LYS 606 Ca 0.34 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1oxj h LYS 606 Cb 0.06 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.27 1oxj h LYS 606 CO -0.13 0.30 0.00 0.66 -0.57 0.00 0.00 179.45 179.71 1oxj h SER 607 N 0.47 0.00 -0.20 0.86 4.64 -0.25 -2.85 113.55 116.22 1oxj h SER 607 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1oxj h SER 607 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 1oxj h SER 607 CO -0.04 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.10 1oxj n LEU 608 N -2.92 2.72 -3.25 5.97 4.77 -0.49 -4.97 117.00 118.83 1oxj n LEU 608 Ca 0.02 -1.36 -0.20 0.00 -0.03 0.00 0.00 56.01 54.43 1oxj n LEU 608 Cb 0.34 -0.12 0.07 0.00 -2.33 0.00 0.00 43.42 41.37 1oxj n LEU 608 CO 0.27 0.57 0.20 0.54 -1.33 0.00 0.00 177.39 177.65 1oxj n ARG 609 N 0.94 -6.94 -0.28 3.23 1.74 -0.73 -4.91 116.66 109.70 1oxj n ARG 609 Ca 0.12 0.74 0.04 0.00 -0.77 0.00 0.00 57.85 57.98 1oxj n ARG 609 Cb 0.44 -5.52 0.05 0.00 -1.02 0.00 0.00 32.46 26.41 1oxj n ARG 609 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1oxj n LEU 610 N -4.41 0.98 0.06 0.55 4.77 -0.22 -4.80 117.00 113.92 1oxj n LEU 610 Ca -0.04 -1.77 0.06 0.00 -0.03 0.00 0.00 56.01 54.23 1oxj n LEU 610 Cb 0.57 -0.16 0.28 0.00 -2.33 0.00 0.00 43.42 41.78 1oxj n LEU 610 CO 0.57 0.42 0.68 1.57 -1.33 0.00 0.00 177.39 179.30 1oxj n HIS 611 N -0.57 0.30 0.21 -1.77 -0.00 -1.19 -1.17 115.22 111.04 1oxj n HIS 611 Ca 0.06 0.14 0.14 0.00 0.46 0.00 0.00 57.72 58.52 1oxj n HIS 611 Cb 0.64 -0.73 0.77 0.00 -0.12 0.00 0.00 29.99 30.55 1oxj n HIS 611 CO 0.00 0.00 0.00 -0.22 0.46 0.00 0.00 176.34 176.58 1oxj h LYS 612 N 0.00 0.00 -0.61 1.57 3.64 -1.91 -1.77 116.57 117.48 1oxj h LYS 612 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1oxj h LYS 612 Cb 0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1oxj h LYS 612 CO 0.00 0.00 0.00 0.66 -2.27 0.00 0.00 179.45 177.84 1oxj n TYR 613 N -4.14 1.91 -0.33 1.91 4.02 -0.32 -4.60 117.16 115.60 1oxj n TYR 613 Ca 0.00 -0.67 0.08 0.00 -0.01 0.00 0.00 57.90 57.31 1oxj n TYR 613 Cb 0.23 -0.46 0.25 0.00 -0.02 0.00 0.00 39.34 39.34 1oxj n TYR 613 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 176.86 176.82 1oxj h ILE 614 N 3.77 0.81 0.00 -0.72 6.09 -1.49 -1.85 117.51 124.11 1oxj h ILE 614 Ca 0.00 -0.28 -0.01 0.00 -1.37 0.00 0.00 64.86 63.20 1oxj h ILE 614 Cb 1.84 -0.07 -0.00 0.00 0.47 0.00 0.00 36.82 39.06 1oxj h ILE 614 CO 0.44 0.15 -0.07 -0.33 -3.07 0.00 0.00 178.15 175.27 1oxj h GLU 615 N 0.81 0.00 -0.04 2.19 4.39 -1.85 -2.49 114.58 117.59 1oxj h GLU 615 Ca 0.50 0.00 0.01 0.00 0.34 0.00 0.00 59.36 60.21 1oxj h GLU 615 Cb 0.63 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1oxj h GLU 615 CO -0.32 0.07 0.03 1.25 -1.16 0.00 0.00 179.01 178.88 1oxj h LEU 616 N 0.00 0.02 -0.77 1.33 5.85 -1.69 -2.23 115.31 117.82 1oxj h LEU 616 Ca -0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1oxj h LEU 616 Cb 0.22 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1oxj h LEU 616 CO 0.01 0.01 -0.07 0.49 -0.34 0.00 0.00 178.44 178.54 1oxj n PHE 617 N -4.53 0.00 0.00 1.25 3.01 -0.94 -4.78 117.46 111.47 1oxj n PHE 617 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1oxj n PHE 617 Cb 0.12 -0.04 0.00 0.00 -0.01 0.00 0.00 39.48 39.54 1oxj n PHE 617 CO 0.00 0.00 0.00 1.17 1.01 0.00 0.00 176.76 178.94 1oxj n LYS 618 N -0.15 0.00 -0.50 -1.08 3.00 -0.84 -0.83 118.16 117.76 1oxj n LYS 618 Ca 0.17 0.00 0.04 0.00 -0.00 0.00 0.00 58.31 58.52 1oxj n LYS 618 Cb 0.34 0.00 0.21 0.00 0.00 0.00 0.00 35.03 35.58 1oxj n LYS 618 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1oxj n ASN 619 N -1.40 2.87 -4.75 3.14 3.02 -1.26 -4.73 115.26 112.14 1oxj n ASN 619 Ca 0.00 -3.38 -0.41 0.00 -0.03 0.00 0.00 54.58 50.76 1oxj n ASN 619 Cb 0.00 -0.55 -0.04 0.00 -0.61 0.00 0.00 39.78 38.58 1oxj n ASN 619 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 1oxj s MET 620 N -3.02 4.56 0.52 3.52 1.75 -0.01 -4.97 119.30 121.64 1oxj s MET 620 Ca 0.40 1.87 -0.03 0.00 -1.25 0.00 0.00 55.69 56.69 1oxj s MET 620 Cb 0.35 -3.19 -0.00 0.00 2.84 0.00 0.00 34.83 34.83 1oxj s MET 620 CO 0.03 0.07 0.79 0.95 -0.65 0.00 0.00 175.02 176.20 1oxj s THR 621 N -0.78 3.91 0.17 10.11 -4.23 -1.26 -4.62 115.64 118.93 1oxj s THR 621 Ca 0.48 -0.21 -0.15 0.00 -1.18 0.00 0.00 61.69 60.63 1oxj s THR 621 Cb -0.33 -3.50 0.05 0.00 1.34 0.00 0.00 72.50 70.06 1oxj s THR 621 CO 0.41 -0.44 1.76 0.22 -0.54 0.00 0.00 174.62 176.03 1oxj h TYR 622 N 0.12 0.30 -0.60 3.99 3.20 -1.92 -1.58 116.97 120.48 1oxj h TYR 622 Ca -0.46 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.40 1oxj h TYR 622 Cb 1.25 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 39.42 1oxj h TYR 622 CO 0.47 0.13 0.26 0.93 -1.64 0.00 0.00 178.16 178.31 1oxj h GLU 623 N 0.35 0.85 -0.63 1.82 3.07 -1.94 -2.28 114.58 115.82 1oxj h GLU 623 Ca 0.19 -0.12 -0.09 0.00 -0.50 0.00 0.00 59.36 58.84 1oxj h GLU 623 Cb 0.15 -0.16 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1oxj h GLU 623 CO -0.17 0.68 0.05 0.93 -1.40 0.00 0.00 179.01 179.10 1oxj h GLU 624 N 0.85 1.06 -0.82 2.33 5.08 -1.78 -2.68 114.58 118.62 1oxj h GLU 624 Ca 0.21 -0.31 0.09 0.00 -1.00 0.00 0.00 59.36 58.35 1oxj h GLU 624 Cb 0.13 -0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.19 1oxj h GLU 624 CO -0.02 1.01 0.47 1.98 -1.00 0.00 0.00 179.01 181.44 1oxj h MET 625 N 0.98 0.76 0.00 2.33 4.05 -0.74 -0.20 114.93 122.12 1oxj h MET 625 Ca 0.18 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.56 1oxj h MET 625 Cb 0.50 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 1oxj h MET 625 CO 0.02 0.50 0.00 1.28 0.23 0.00 0.00 176.91 178.95 1oxj n LEU 626 N -4.75 0.00 -0.58 3.39 4.77 -1.02 -2.15 117.00 116.66 1oxj n LEU 626 Ca 0.13 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.62 1oxj n LEU 626 Cb 0.27 -0.38 0.21 0.00 -2.33 0.00 0.00 43.42 41.19 1oxj n LEU 626 CO 0.27 -0.17 0.58 0.18 -1.33 0.00 0.00 177.39 176.92 1oxj n LEU 627 N -1.38 2.01 -4.73 2.23 4.77 -0.09 -4.96 117.00 114.85 1oxj n LEU 627 Ca 0.06 -0.68 -0.42 0.00 -0.03 0.00 0.00 56.01 54.95 1oxj n LEU 627 Cb 0.16 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.20 1oxj n LEU 627 CO 0.14 0.35 1.18 -0.63 -1.33 0.00 0.00 177.39 177.10 1oxj s ILE 628 N -2.25 2.64 0.21 -0.08 1.01 -0.91 -5.03 121.20 116.79 1oxj s ILE 628 Ca 0.26 0.49 0.09 0.00 0.00 0.00 0.00 60.65 61.49 1oxj s ILE 628 Cb 0.19 -3.31 -0.05 0.00 0.01 0.00 0.00 42.46 39.31 1oxj s ILE 628 CO 0.43 0.05 -0.16 0.42 0.00 0.00 0.00 174.94 175.69 1oxj s THR 629 N 0.72 1.87 0.35 2.92 -4.23 -1.26 -4.93 115.64 111.08 1oxj s THR 629 Ca 0.66 -2.19 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1oxj s THR 629 Cb -0.43 -2.05 0.28 0.00 1.34 0.00 0.00 72.50 71.65 1oxj s THR 629 CO 0.36 -0.51 1.96 -0.08 -0.54 0.00 0.00 174.62 175.81 1oxj h GLU 630 N 2.64 0.80 -0.50 3.99 4.81 -1.93 -1.89 114.58 122.51 1oxj h GLU 630 Ca -0.39 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 58.75 1oxj h GLU 630 Cb 1.22 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 1oxj h GLU 630 CO 0.60 0.53 0.17 0.22 -0.73 0.00 0.00 179.01 179.79 1oxj h ASP 631 N 0.82 0.72 -0.40 1.04 3.58 -1.96 -1.66 116.42 118.57 1oxj h ASP 631 Ca 0.31 -0.20 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 1oxj h ASP 631 Cb 0.17 -0.19 -0.02 0.00 1.72 0.00 0.00 39.33 41.01 1oxj h ASP 631 CO -0.10 0.73 0.18 0.15 -2.88 0.00 0.00 179.24 177.32 1oxj h PHE 632 N 0.68 0.60 -0.36 0.28 3.57 -1.78 -2.33 116.94 117.59 1oxj h PHE 632 Ca 0.16 -0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1oxj h PHE 632 Cb 0.26 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 1oxj h PHE 632 CO 0.01 0.51 0.20 -0.07 -2.23 0.00 0.00 178.31 176.74 1oxj h LEU 633 N 0.51 0.45 -1.35 0.59 3.38 -1.17 -2.22 115.31 115.50 1oxj h LEU 633 Ca 0.14 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.04 1oxj h LEU 633 Cb 0.15 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 1oxj h LEU 633 CO -0.01 0.40 0.45 1.56 0.09 0.00 0.00 178.44 180.92 1oxj h GLN 634 N 0.46 0.86 0.00 1.13 4.20 -1.23 -1.89 115.11 118.64 1oxj h GLN 634 Ca 0.13 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.75 1oxj h GLN 634 Cb 0.05 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 1oxj h GLN 634 CO -0.02 0.57 -0.20 0.77 -0.67 0.00 0.00 178.83 179.28 1oxj h SER 635 N 0.88 0.00 -0.55 1.46 0.02 -0.84 -3.08 113.55 111.44 1oxj h SER 635 Ca 0.25 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 61.04 1oxj h SER 635 Cb -0.06 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 62.38 1oxj h SER 635 CO -0.06 0.20 0.15 1.33 -1.14 0.00 0.00 176.83 177.31 1oxj n VAL 636 N -3.59 2.71 -0.22 2.27 0.24 -0.80 -4.95 118.33 113.99 1oxj n VAL 636 Ca -0.01 -1.93 0.00 0.00 -2.04 0.00 0.00 64.34 60.36 1oxj n VAL 636 Cb 0.34 -0.33 0.00 0.00 -1.47 0.00 0.00 33.84 32.38 1oxj n VAL 636 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1oxj n GLY 637 N -0.48 0.64 3.74 7.63 0.00 -1.16 -5.07 105.19 110.49 1oxj n GLY 637 Ca 0.35 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.97 1oxj n GLY 637 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oxj s VAL 638 N -2.41 4.43 0.75 1.61 1.01 -0.78 -5.02 120.40 119.99 1oxj s VAL 638 Ca 0.00 2.02 -0.15 0.00 0.00 0.00 0.00 61.98 63.85 1oxj s VAL 638 Cb 0.00 -4.30 0.03 0.00 0.00 0.00 0.00 36.38 32.12 1oxj s VAL 638 CO 0.00 0.37 1.11 0.35 0.00 0.00 0.00 175.10 176.93 1oxj n THR 639 N 2.47 2.87 -0.01 3.92 -2.24 -1.26 -4.19 114.28 115.83 1oxj n THR 639 Ca 0.01 -0.33 0.07 0.00 -2.27 0.00 0.00 64.05 61.53 1oxj n THR 639 Cb 0.49 -1.21 0.47 0.00 -2.10 0.00 0.00 70.33 67.98 1oxj n THR 639 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1oxj h LYS 640 N -0.38 0.45 0.12 -0.78 -0.00 -1.95 0.27 116.57 114.28 1oxj h LYS 640 Ca -0.48 -0.03 -0.01 0.00 -0.00 0.00 0.00 60.65 60.14 1oxj h LYS 640 Cb 1.32 -0.10 0.00 0.00 -0.00 0.00 0.00 32.23 33.45 1oxj h LYS 640 CO 0.47 0.30 -0.06 0.78 -0.00 0.00 0.00 179.45 180.95 1oxj h GLY 641 N 0.46 -0.16 1.99 0.07 0.00 -2.00 -2.13 103.07 101.30 1oxj h GLY 641 Ca 0.19 0.06 -0.09 0.00 0.00 0.00 0.00 47.33 47.49 1oxj h GLY 641 CO -0.05 -0.06 -0.40 0.00 0.00 0.00 0.00 176.54 176.03 1oxj h ALA 642 N 0.25 1.32 -0.15 3.60 0.00 -1.83 -1.42 119.26 121.03 1oxj h ALA 642 Ca -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1oxj h ALA 642 Cb 0.45 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1oxj h ALA 642 CO 0.03 0.51 0.07 0.77 0.00 0.00 0.00 179.25 180.62 1oxj h SER 643 N 0.01 0.20 -0.18 0.00 0.02 -0.44 0.13 113.55 113.30 1oxj h SER 643 Ca -0.00 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.79 1oxj h SER 643 Cb 0.72 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.20 1oxj h SER 643 CO 0.05 0.29 0.07 -0.74 -1.14 0.00 0.00 176.83 175.36 1oxj h HIS 644 N 0.10 0.27 -0.23 3.45 6.17 -1.14 -0.71 115.15 123.07 1oxj h HIS 644 Ca 0.05 -0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.10 1oxj h HIS 644 Cb 0.15 -0.08 -0.01 0.00 2.52 0.00 0.00 27.41 29.98 1oxj h HIS 644 CO -0.02 0.33 0.11 -0.22 0.71 0.00 0.00 177.93 178.84 1oxj h LYS 645 N 0.13 0.33 -0.53 5.26 3.64 -1.13 -0.89 116.57 123.39 1oxj h LYS 645 Ca 0.06 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.31 1oxj h LYS 645 Cb 0.18 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1oxj h LYS 645 CO -0.00 0.34 0.01 1.25 -2.27 0.00 0.00 179.45 178.77 1oxj h LEU 646 N 0.24 0.86 -0.88 5.20 5.85 -0.73 -0.81 115.31 125.04 1oxj h LEU 646 Ca 0.08 -0.22 -0.03 0.00 0.84 0.00 0.00 57.88 58.55 1oxj h LEU 646 Cb 0.11 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1oxj h LEU 646 CO -0.01 0.91 0.38 0.00 -0.34 0.00 0.00 178.44 179.38 1oxj h ALA 647 N 1.18 1.12 -0.63 1.25 0.00 -0.89 0.40 119.26 121.69 1oxj h ALA 647 Ca 0.16 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1oxj h ALA 647 Cb 0.48 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1oxj h ALA 647 CO 0.02 0.65 0.16 -0.07 0.00 0.00 0.00 179.25 180.01 1oxj h LEU 648 N 1.17 0.95 -0.68 0.00 3.38 -0.62 -0.91 115.31 118.60 1oxj h LEU 648 Ca 0.28 -0.23 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1oxj h LEU 648 Cb 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1oxj h LEU 648 CO -0.03 0.93 0.07 0.00 0.09 0.00 0.00 178.44 179.50 1oxj h ILE 650 N 1.01 1.26 -0.73 0.00 1.08 -0.71 -0.62 117.51 118.79 1oxj h ILE 650 Ca 0.19 -1.03 -0.03 0.00 -0.39 0.00 0.00 64.86 63.60 1oxj h ILE 650 Cb 0.48 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 34.88 1oxj h ILE 650 CO 0.02 0.38 0.34 0.44 -0.69 0.00 0.00 178.15 178.64 1oxj h ASP 651 N 0.97 0.97 0.20 1.72 3.32 -0.76 -1.45 116.42 121.40 1oxj h ASP 651 Ca 0.19 -0.14 -0.06 0.00 0.02 0.00 0.00 57.03 57.04 1oxj h ASP 651 Cb 0.44 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 1oxj h ASP 651 CO 0.01 0.84 -0.24 0.11 -1.72 0.00 0.00 179.24 178.25 1oxj h LYS 652 N 1.03 0.06 -0.81 3.56 1.57 -0.56 -1.37 116.57 120.05 1oxj h LYS 652 Ca 0.25 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.00 1oxj h LYS 652 Cb 0.14 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.41 1oxj h LYS 652 CO -0.03 0.30 0.45 -0.07 -0.57 0.00 0.00 179.45 179.53 1oxj h LEU 653 N 0.06 1.01 -2.00 2.94 3.38 -0.09 -1.60 115.31 119.02 1oxj h LEU 653 Ca 0.01 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1oxj h LEU 653 Cb 0.46 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1oxj h LEU 653 CO 0.03 0.82 -0.05 0.11 0.09 0.00 0.00 178.44 179.45 1oxj h LYS 654 N 1.13 0.00 -0.00 1.13 1.57 -0.65 -2.37 116.57 117.38 1oxj h LYS 654 Ca 0.29 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.07 1oxj h LYS 654 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1oxj h LYS 654 CO -0.05 0.05 -0.34 0.39 -0.57 0.00 0.00 179.45 178.93 1oxj n GLU 655 N -3.26 0.43 -0.22 3.15 -0.58 -0.62 -4.44 120.64 115.10 1oxj n GLU 655 Ca -0.01 -0.24 -0.00 0.00 -0.42 0.00 0.00 57.16 56.49 1oxj n GLU 655 Cb 0.23 -1.50 0.07 0.00 -0.57 0.00 0.00 31.44 29.67 1oxj n GLU 655 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1oxj h ARG 656 N 0.58 0.00 -0.73 3.49 3.08 -1.20 0.21 114.38 119.82 1oxj h ARG 656 Ca 0.00 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 1oxj h ARG 656 Cb 0.49 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.48 1oxj h ARG 656 CO 0.00 0.00 0.43 0.00 -1.07 0.00 0.00 179.97 179.33 1oxj h ALA 657 N 1.64 0.98 -0.34 0.04 0.00 -1.82 0.15 119.26 119.91 1oxj h ALA 657 Ca 0.31 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.14 1oxj h ALA 657 Cb 0.48 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1oxj h ALA 657 CO -0.66 0.14 -0.10 -0.91 0.00 0.00 0.00 179.25 177.72 1oxj h ASN 658 N 0.79 0.68 -0.07 0.00 2.35 -1.57 -0.36 115.58 117.41 1oxj h ASN 658 Ca 0.32 -0.37 0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1oxj h ASN 658 Cb 0.15 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1oxj h ASN 658 CO -0.17 0.90 0.04 0.40 -1.65 0.00 0.00 177.43 176.95 1oxj h ILE 659 N 0.46 1.00 -0.78 2.81 2.04 -0.44 0.14 117.51 122.75 1oxj h ILE 659 Ca 0.09 -0.03 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 1oxj h ILE 659 Cb 0.61 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1oxj h ILE 659 CO 0.04 0.01 0.34 -0.07 0.00 0.00 0.00 178.15 178.48 1oxj h LEU 660 N 0.08 1.04 -0.35 1.44 3.38 -0.68 -0.36 115.31 119.87 1oxj h LEU 660 Ca 0.03 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.85 1oxj h LEU 660 Cb 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1oxj h LEU 660 CO -0.02 0.91 0.22 -1.13 0.09 0.00 0.00 178.44 178.51 1oxj h ASN 661 N 1.11 0.38 -0.23 -0.43 -1.24 -0.66 -0.20 115.58 114.31 1oxj h ASN 661 Ca 0.26 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.27 1oxj h ASN 661 Cb 0.17 -0.09 -0.01 0.00 0.73 0.00 0.00 38.32 39.11 1oxj h ASN 661 CO -0.03 0.28 0.14 -0.09 -1.29 0.00 0.00 177.43 176.44 1oxj h ARG 662 N 0.46 0.31 -0.51 6.67 2.43 -0.30 -1.34 114.38 122.10 1oxj h ARG 662 Ca 0.13 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1oxj h ARG 662 Cb -0.04 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1oxj h ARG 662 CO -0.04 0.23 0.30 0.28 -1.51 0.00 0.00 179.97 179.23 1oxj h VAL 663 N 0.29 1.16 -0.08 0.20 2.07 -0.82 0.63 116.25 119.69 1oxj h VAL 663 Ca 0.08 -0.37 0.04 0.00 0.82 0.00 0.00 66.70 67.27 1oxj h VAL 663 Cb 0.00 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 1oxj h VAL 663 CO -0.02 0.16 -0.18 -0.08 0.02 0.00 0.00 177.57 177.48 1oxj h GLU 664 N 0.68 -0.24 0.39 1.57 4.81 -0.81 -1.33 114.58 119.64 1oxj h GLU 664 Ca 0.18 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1oxj h GLU 664 Cb 0.00 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1oxj h GLU 664 CO -0.03 -0.16 -0.26 0.37 -0.73 0.00 0.00 179.01 178.20 1oxj h GLN 665 N -0.25 -0.60 0.00 1.92 4.15 -0.83 -2.08 115.11 117.41 1oxj h GLN 665 Ca 0.08 0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.54 1oxj h GLN 665 Cb 0.37 0.14 -0.00 0.00 0.21 0.00 0.00 27.48 28.19 1oxj h GLN 665 CO -0.23 -0.40 -0.03 0.93 -1.93 0.00 0.00 178.83 177.17 1oxj h GLU 666 N -0.63 0.00 0.24 1.69 5.08 -0.80 -1.36 114.58 118.81 1oxj h GLU 666 Ca -0.04 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 57.99 1oxj h GLU 666 Cb 0.52 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.81 1oxj h GLU 666 CO 0.03 0.03 -1.50 -0.07 -1.00 0.00 0.00 179.01 176.50 1oxj h LEU 667 N 0.00 0.78 -1.46 1.33 3.38 -1.09 0.13 115.31 118.38 1oxj h LEU 667 Ca -0.00 -0.87 -0.06 0.00 0.09 0.00 0.00 57.88 57.04 1oxj h LEU 667 Cb 0.33 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1oxj h LEU 667 CO 0.00 1.69 -0.27 -0.07 0.09 0.00 0.00 178.44 179.89 1oxj h LEU 668 N 0.14 0.00 0.00 1.67 3.38 -0.86 -2.47 115.31 117.17 1oxj h LEU 668 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1oxj h LEU 668 Cb 2.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.90 1oxj h LEU 668 CO 0.26 0.27 -0.61 -1.54 0.09 0.00 0.00 178.44 176.90 1oxj n SER 669 N -3.92 0.60 0.00 -0.43 3.41 -0.56 -4.94 113.62 107.79 1oxj n SER 669 Ca -0.02 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.55 1oxj n SER 669 Cb 0.35 0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.54 1oxj n SER 669 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1oxj n GLY 670 N 1.40 0.63 0.08 5.00 0.00 -0.93 -4.94 105.19 106.43 1oxj n GLY 670 Ca 0.04 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.01 1oxj n GLY 670 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1oxj h GLN 671 N 1.76 0.00 -5.83 1.61 1.08 -1.08 -3.46 115.11 109.19 1oxj h GLN 671 Ca 0.00 0.00 -0.67 0.00 -1.45 0.00 0.00 58.65 56.53 1oxj h GLN 671 Cb 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 27.48 27.28 1oxj h GLN 671 CO 0.00 0.87 -0.61 1.41 -0.95 0.00 0.00 178.83 179.55 1oxj s MET 672 N -2.82 3.17 0.50 1.46 1.75 -0.13 -5.01 119.30 118.22 1oxj s MET 672 Ca 0.01 -0.40 -0.18 0.00 -1.25 0.00 0.00 55.69 53.88 1oxj s MET 672 Cb 0.10 -2.86 -0.08 0.00 2.84 0.00 0.00 34.83 34.82 1oxj s MET 672 CO 0.80 0.62 1.00 -1.21 -0.65 0.00 0.00 175.02 175.58 1oxj s GLU 673 N -0.65 3.87 0.28 4.11 0.41 -1.26 -4.67 118.70 120.78 1oxj s GLU 673 Ca 0.11 1.12 -0.02 0.00 -0.41 0.00 0.00 54.97 55.76 1oxj s GLU 673 Cb -0.12 -2.12 0.39 0.00 -1.78 0.00 0.00 34.13 30.50 1oxj s GLU 673 CO 0.02 -0.35 1.86 -0.07 -0.49 0.00 0.00 175.26 176.23 1oxj h LEU 674 N 1.18 0.85 -1.05 1.80 3.38 -1.99 -1.82 115.31 117.66 1oxj h LEU 674 Ca -0.48 -0.11 0.04 0.00 0.09 0.00 0.00 57.88 57.41 1oxj h LEU 674 Cb 1.20 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.67 1oxj h LEU 674 CO 0.60 0.76 0.64 0.77 0.09 0.00 0.00 178.44 181.30 1oxj h SER 675 N 0.92 1.06 -0.16 -0.43 4.64 -1.96 0.23 113.55 117.85 1oxj h SER 675 Ca 0.22 -0.01 -0.03 0.00 -0.47 0.00 0.00 61.79 61.49 1oxj h SER 675 Cb 0.17 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.02 1oxj h SER 675 CO -0.02 0.72 -0.03 0.74 -0.87 0.00 0.00 176.83 177.38 1oxj h THR 676 N 1.23 1.28 -0.97 2.95 2.02 -1.77 -1.94 112.91 115.72 1oxj h THR 676 Ca 0.39 -0.95 0.03 0.00 0.77 0.00 0.00 66.41 66.64 1oxj h THR 676 Cb 0.00 1.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.95 1oxj h THR 676 CO -0.12 0.28 0.63 0.00 0.37 0.00 0.00 175.52 176.69 1oxj h ALA 677 N 0.73 1.26 -0.00 6.16 0.00 -0.85 -1.23 119.26 125.33 1oxj h ALA 677 Ca 0.04 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1oxj h ALA 677 Cb 0.44 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1oxj h ALA 677 CO 0.01 0.54 -0.54 0.28 0.00 0.00 0.00 179.25 179.55 1oxj h VAL 678 N 1.24 1.39 -0.29 0.00 2.07 -0.88 -1.60 116.25 118.18 1oxj h VAL 678 Ca 0.38 -1.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.00 1oxj h VAL 678 Cb -0.04 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1oxj h VAL 678 CO -0.11 0.53 -0.06 -0.08 0.02 0.00 0.00 177.57 177.86 1oxj h GLU 679 N 0.00 0.55 -0.11 1.57 4.81 -0.51 -1.57 114.58 119.31 1oxj h GLU 679 Ca -0.01 -0.21 0.02 0.00 -0.13 0.00 0.00 59.36 59.03 1oxj h GLU 679 Cb 0.95 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 1oxj h GLU 679 CO 0.07 0.74 0.01 0.93 -0.73 0.00 0.00 179.01 180.04 1oxj h GLU 680 N 0.31 0.06 -0.75 1.92 4.39 -1.03 -2.47 114.58 117.00 1oxj h GLU 680 Ca 0.07 -0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.85 1oxj h GLU 680 Cb 0.54 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.13 1oxj h GLU 680 CO 0.03 0.04 0.49 -0.07 -1.16 0.00 0.00 179.01 178.33 1oxj h LEU 681 N 0.06 0.63 -1.53 1.33 3.38 -1.14 -1.74 115.31 116.29 1oxj h LEU 681 Ca 0.05 0.01 0.14 0.00 0.09 0.00 0.00 57.88 58.17 1oxj h LEU 681 Cb 0.05 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.63 1oxj h LEU 681 CO -0.08 0.39 0.50 0.74 0.09 0.00 0.00 178.44 180.08 1oxj h THR 682 N 0.70 0.83 -0.26 0.22 2.02 -0.80 0.48 112.91 116.10 1oxj h THR 682 Ca 0.34 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.35 1oxj h THR 682 Cb 0.39 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1oxj h THR 682 CO -0.12 0.09 0.00 0.59 0.37 0.00 0.00 175.52 176.45 1oxj n ASN 683 N -4.49 1.75 0.00 4.18 3.02 -0.66 -4.08 115.26 114.99 1oxj n ASN 683 Ca 0.14 -1.85 0.00 0.00 -0.03 0.00 0.00 54.58 52.84 1oxj n ASN 683 Cb 0.48 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1oxj n ASN 683 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1oxj n ILE 684 N 0.41 0.00 -0.13 2.41 5.41 -0.02 -4.76 119.36 122.69 1oxj n ILE 684 Ca 0.14 0.00 0.22 0.00 1.00 0.00 0.00 62.75 64.10 1oxj n ILE 684 Cb 0.31 -0.81 0.63 0.00 -0.71 0.00 0.00 39.64 39.06 1oxj n ILE 684 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 176.55 178.17 1oxj h VAL 685 N 0.00 0.68 -0.01 1.39 3.04 -1.21 -0.99 116.25 119.15 1oxj h VAL 685 Ca 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1oxj h VAL 685 Cb 0.90 0.51 0.00 0.00 -2.01 0.00 0.00 31.29 30.69 1oxj h VAL 685 CO 0.00 0.03 -0.35 0.18 -1.01 0.00 0.00 177.57 176.42 1oxj n LEU 686 N -4.39 1.57 -4.79 3.16 4.77 -1.26 -4.84 117.00 111.22 1oxj n LEU 686 Ca 0.15 -0.53 -0.33 0.00 -0.03 0.00 0.00 56.01 55.27 1oxj n LEU 686 Cb 0.71 -0.06 0.01 0.00 -2.33 0.00 0.00 43.42 41.76 1oxj n LEU 686 CO 0.36 0.29 0.74 0.42 -1.33 0.00 0.00 177.39 177.86 1oxj s THR 687 N -2.46 3.52 0.05 -5.08 -4.23 -0.38 -4.12 115.64 102.95 1oxj s THR 687 Ca 0.22 0.79 -0.30 0.00 -1.18 0.00 0.00 61.69 61.22 1oxj s THR 687 Cb 0.19 -3.30 -0.09 0.00 1.34 0.00 0.00 72.50 70.65 1oxj s THR 687 CO 0.53 -0.36 1.80 -2.84 -0.54 0.00 0.00 174.62 173.22 1oxj s PRO 688 N -3.80 4.16 -0.04 3.99 0.02 -1.26 -4.99 135.00 133.09 1oxj s PRO 688 Ca 0.67 2.47 0.03 0.00 0.02 0.00 0.00 61.00 64.19 1oxj s PRO 688 Cb -0.19 -3.84 0.00 0.00 0.02 0.00 0.00 34.50 30.49 1oxj s PRO 688 CO 0.34 -0.85 -0.13 -1.64 -0.33 0.00 0.00 177.00 174.39 1oxj s MET 689 N 3.49 1.40 0.74 5.54 -1.94 -1.24 -5.03 119.30 122.26 1oxj s MET 689 Ca 0.80 -0.44 -0.11 0.00 -1.71 0.00 0.00 55.69 54.24 1oxj s MET 689 Cb -0.41 -1.23 0.04 0.00 2.01 0.00 0.00 34.83 35.23 1oxj s MET 689 CO 0.36 0.15 1.08 0.15 -0.01 0.00 0.00 175.02 176.74 1oxj s LYS 690 N 0.22 2.54 0.76 2.03 1.02 -1.26 -4.43 119.74 120.63 1oxj s LYS 690 Ca -0.05 0.88 -0.15 0.00 0.02 0.00 0.00 55.97 56.67 1oxj s LYS 690 Cb -0.11 -1.95 0.03 0.00 -0.52 0.00 0.00 37.83 35.28 1oxj s LYS 690 CO 0.02 -1.36 1.03 -2.30 -0.92 0.00 0.00 175.35 171.82 1oxj n PRO 691 N -3.29 0.37 0.10 -1.68 -0.02 -1.26 -4.60 135.00 124.62 1oxj n PRO 691 Ca 0.08 0.19 0.04 0.00 -2.02 0.00 0.00 63.50 61.79 1oxj n PRO 691 Cb 0.54 -2.29 0.45 0.00 -0.02 0.00 0.00 33.50 32.19 1oxj n PRO 691 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1oxj h LEU 692 N -0.53 0.28 -1.81 2.45 3.38 -1.94 -2.71 115.31 114.42 1oxj h LEU 692 Ca -0.47 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1oxj h LEU 692 Cb 1.32 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1oxj h LEU 692 CO 0.46 0.29 0.00 -0.62 0.09 0.00 0.00 178.44 178.66 1oxj n GLU 693 N -4.41 0.74 -3.29 1.13 4.71 -1.26 -4.76 120.64 113.49 1oxj n GLU 693 Ca 0.00 0.00 -0.43 0.00 -0.01 0.00 0.00 57.16 56.73 1oxj n GLU 693 Cb 0.15 -1.18 -0.08 0.00 -1.01 0.00 0.00 31.44 29.32 1oxj n GLU 693 CO 0.00 0.00 0.00 -1.12 0.09 0.00 0.00 177.13 176.10 1oxj s SER 694 N 0.76 6.22 0.37 1.62 0.01 -1.03 -5.04 113.70 116.61 1oxj s SER 694 Ca 0.00 -0.53 -0.26 0.00 1.31 0.00 0.00 55.95 56.47 1oxj s SER 694 Cb 0.00 -2.24 -0.12 0.00 0.21 0.00 0.00 66.02 63.87 1oxj s SER 694 CO 0.00 -0.57 1.06 -2.65 0.41 0.00 0.00 173.24 171.48 1oxj n PRO 695 N 5.68 1.49 0.00 12.44 -0.02 -1.26 -4.92 135.00 148.41 1oxj n PRO 695 Ca -0.06 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 1oxj n PRO 695 Cb 0.48 -2.03 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1oxj n PRO 695 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1oxj n GLY 696 N 1.12 2.22 3.68 -1.23 0.00 -1.26 -5.08 105.19 104.64 1oxj n GLY 696 Ca 0.09 -1.52 -0.48 0.00 0.00 0.00 0.00 46.02 44.10 1oxj n GLY 696 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1oxj n PRO 697 N -1.59 2.16 -0.06 1.61 -0.02 -1.26 -4.81 135.00 131.02 1oxj n PRO 697 Ca 0.00 0.79 0.25 0.00 -2.02 0.00 0.00 63.50 62.51 1oxj n PRO 697 Cb 0.00 -2.65 0.72 0.00 -0.02 0.00 0.00 33.50 31.55 1oxj n PRO 697 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1oxj h PRO 698 N 9.33 0.00 0.00 0.52 0.11 -1.96 0.20 132.00 140.21 1oxj h PRO 698 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1oxj h PRO 698 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1oxj h PRO 698 CO 0.95 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.79 1oxj h GLU 699 N 0.00 0.00 -0.11 1.05 9.09 -2.02 -2.39 114.58 120.19 1oxj h GLU 699 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.73 1oxj h GLU 699 Cb 1.45 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.55 1oxj h GLU 699 CO -0.00 0.00 0.00 0.39 0.05 0.00 0.00 179.01 179.45 1oxj n GLU 700 N -2.83 1.41 -2.58 1.06 -0.58 0.71 -4.88 120.64 112.95 1oxj n GLU 700 Ca 0.00 -1.55 -0.41 0.00 -0.42 0.00 0.00 57.16 54.78 1oxj n GLU 700 Cb 0.23 -1.29 -0.03 0.00 -0.57 0.00 0.00 31.44 29.77 1oxj n GLU 700 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1oxj s ASN 701 N -1.17 6.18 0.20 1.62 3.84 -0.90 -4.90 114.94 119.81 1oxj s ASN 701 Ca 0.20 -0.55 -0.11 0.00 0.21 0.00 0.00 52.86 52.61 1oxj s ASN 701 Cb 0.13 -2.55 0.23 0.00 -0.55 0.00 0.00 41.25 38.51 1oxj s ASN 701 CO 0.19 -1.79 1.73 0.40 -2.79 0.00 0.00 177.10 174.84 1oxj h ILE 702 N 6.06 0.74 -0.71 -5.21 1.08 -1.90 -0.87 117.51 116.71 1oxj h ILE 702 Ca -0.25 -0.11 -0.01 0.00 -0.39 0.00 0.00 64.86 64.10 1oxj h ILE 702 Cb 1.05 0.40 -0.03 0.00 -3.07 0.00 0.00 36.82 35.17 1oxj h ILE 702 CO 1.28 0.06 0.40 1.23 -0.69 0.00 0.00 178.15 180.43 1oxj h GLY 703 N 0.31 1.04 0.93 5.37 0.00 -1.91 -0.33 103.07 108.49 1oxj h GLY 703 Ca 0.28 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 1oxj h GLY 703 CO -0.32 0.44 0.06 -2.00 0.00 0.00 0.00 176.54 174.73 1oxj h LEU 704 N 0.97 0.60 -0.89 3.11 5.85 -1.75 -1.32 115.31 121.87 1oxj h LEU 704 Ca 0.25 -0.26 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 1oxj h LEU 704 Cb 0.01 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1oxj h LEU 704 CO -0.04 0.70 0.03 0.03 -0.34 0.00 0.00 178.44 178.82 1oxj h ARG 705 N 0.47 0.85 -0.29 1.25 2.47 -0.98 -1.05 114.38 117.10 1oxj h ARG 705 Ca 0.12 -0.22 -0.02 0.00 -1.26 0.00 0.00 59.98 58.59 1oxj h ARG 705 Cb 0.36 -0.10 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 1oxj h ARG 705 CO 0.01 0.83 0.10 0.35 0.56 0.00 0.00 179.97 181.82 1oxj h PHE 706 N 0.80 0.46 -0.11 3.04 3.57 -0.86 -1.50 116.94 122.34 1oxj h PHE 706 Ca 0.16 -0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.54 1oxj h PHE 706 Cb 0.43 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 1oxj h PHE 706 CO 0.02 0.47 -0.29 -0.07 -2.23 0.00 0.00 178.31 176.22 1oxj h LEU 707 N 0.32 0.21 -0.35 0.59 3.38 -1.06 -1.48 115.31 116.92 1oxj h LEU 707 Ca 0.10 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 1oxj h LEU 707 Cb 0.22 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1oxj h LEU 707 CO -0.01 0.50 0.07 0.11 0.09 0.00 0.00 178.44 179.20 1oxj h LYS 708 N 0.19 0.57 -0.67 1.13 1.57 -0.86 -1.98 116.57 116.52 1oxj h LYS 708 Ca 0.03 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.60 1oxj h LYS 708 Cb 0.61 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1oxj h LYS 708 CO 0.04 0.64 0.17 0.28 -0.57 0.00 0.00 179.45 180.01 1oxj h VAL 709 N 0.41 1.26 -0.89 0.50 2.07 -1.02 -2.04 116.25 116.54 1oxj h VAL 709 Ca 0.11 -0.94 0.03 0.00 0.82 0.00 0.00 66.70 66.72 1oxj h VAL 709 Cb 0.34 0.56 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1oxj h VAL 709 CO 0.00 0.36 0.58 0.40 0.02 0.00 0.00 177.57 178.93 1oxj h ILE 710 N 1.02 1.17 -0.38 4.57 1.08 -1.04 0.17 117.51 124.09 1oxj h ILE 710 Ca 0.21 -0.39 -0.02 0.00 -0.39 0.00 0.00 64.86 64.27 1oxj h ILE 710 Cb 0.35 -0.07 -0.02 0.00 -3.07 0.00 0.00 36.82 34.02 1oxj h ILE 710 CO 0.00 0.21 0.16 0.44 -0.69 0.00 0.00 178.15 178.27 1oxj h ASP 711 N 1.13 0.52 -0.38 1.72 3.32 -0.86 -0.20 116.42 121.68 1oxj h ASP 711 Ca 0.35 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 57.22 1oxj h ASP 711 Cb -0.03 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1oxj h ASP 711 CO -0.11 0.54 0.15 0.40 -1.72 0.00 0.00 179.24 178.50 1oxj h ILE 712 N 0.48 1.19 0.56 0.35 2.04 -0.85 -0.68 117.51 120.61 1oxj h ILE 712 Ca 0.13 -0.60 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1oxj h ILE 712 Cb 0.17 0.88 0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1oxj h ILE 712 CO -0.01 0.22 -0.27 0.58 0.00 0.00 0.00 178.15 178.66 1oxj h VAL 713 N 0.47 0.44 0.00 1.67 2.07 -0.50 0.25 116.25 120.65 1oxj h VAL 713 Ca 0.13 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.59 1oxj h VAL 713 Cb 0.19 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 1oxj h VAL 713 CO -0.01 0.01 -0.09 0.71 0.02 0.00 0.00 177.57 178.20 1oxj h THR 714 N -0.78 0.96 0.03 2.57 1.35 -1.03 0.20 112.91 116.21 1oxj h THR 714 Ca -0.08 -0.32 -0.24 0.00 -0.55 0.00 0.00 66.41 65.21 1oxj h THR 714 Cb 0.59 1.18 0.02 0.00 -1.73 0.00 0.00 68.15 68.21 1oxj h THR 714 CO 0.13 0.09 -0.97 0.78 -0.25 0.00 0.00 175.52 175.29 1oxj h ASN 715 N 0.00 0.80 -0.54 5.36 -0.26 -0.80 -2.53 115.58 117.62 1oxj h ASN 715 Ca -0.00 -0.77 -0.07 0.00 -0.56 0.00 0.00 56.30 54.90 1oxj h ASN 715 Cb 0.17 -0.25 -0.03 0.00 -1.06 0.00 0.00 38.32 37.16 1oxj h ASN 715 CO 0.01 1.47 0.10 0.74 -1.06 0.00 0.00 177.43 178.69 1oxj h THR 716 N 0.22 1.25 0.52 2.81 2.02 -0.04 -2.95 112.91 116.74 1oxj h THR 716 Ca -0.13 -0.95 -0.02 0.00 0.77 0.00 0.00 66.41 66.08 1oxj h THR 716 Cb 1.65 0.70 -0.00 0.00 -1.74 0.00 0.00 68.15 68.75 1oxj h THR 716 CO 0.19 0.35 -0.34 0.25 0.37 0.00 0.00 175.52 176.34 1oxj h LEU 717 N 0.89 -0.87 -1.67 2.58 5.85 -0.97 -2.37 115.31 118.74 1oxj h LEU 717 Ca 0.18 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.95 1oxj h LEU 717 Cb 0.39 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.68 1oxj h LEU 717 CO 0.01 -0.51 0.30 1.56 -0.34 0.00 0.00 178.44 179.46 1oxj h GLN 718 N -0.81 0.00 -0.01 1.25 4.20 -1.43 0.44 115.11 118.74 1oxj h GLN 718 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1oxj h GLN 718 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1oxj h GLN 718 CO 0.06 0.00 -0.38 1.04 -0.67 0.00 0.00 178.83 178.87 1oxj n GLN 719 N -2.62 1.13 -3.11 1.46 6.02 -0.95 -4.84 117.38 114.47 1oxj n GLN 719 Ca -0.02 -0.86 -0.42 0.00 -0.01 0.00 0.00 57.00 55.70 1oxj n GLN 719 Cb 0.34 -1.48 -0.06 0.00 1.02 0.00 0.00 30.24 30.05 1oxj n GLN 719 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1oxj s ASP 720 N -2.46 6.46 0.49 1.08 -1.08 0.15 -4.94 116.67 116.36 1oxj s ASP 720 Ca 0.21 0.25 0.23 0.00 -0.52 0.00 0.00 52.55 52.73 1oxj s ASP 720 Cb 0.19 -2.33 1.29 0.00 -1.46 0.00 0.00 42.92 40.60 1oxj s ASP 720 CO 0.54 -0.56 1.94 -0.65 0.52 0.00 0.00 175.17 176.97 1oxj h PRO 721 N 8.36 0.15 -0.25 4.34 0.11 -1.88 -1.06 132.00 141.77 1oxj h PRO 721 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1oxj h PRO 721 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1oxj h PRO 721 CO 0.83 0.10 0.00 0.66 -0.21 0.00 0.00 178.00 179.38 1oxj n TYR 722 N -4.40 0.31 -0.26 0.65 4.02 -1.26 -4.60 117.16 111.62 1oxj n TYR 722 Ca 0.13 -0.19 0.02 0.00 -0.01 0.00 0.00 57.90 57.85 1oxj n TYR 722 Cb 0.66 -0.00 0.09 0.00 -0.02 0.00 0.00 39.34 40.06 1oxj n TYR 722 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1oxj h ALA 723 N 3.76 0.50 -0.16 -0.72 0.00 -1.44 0.47 119.26 121.67 1oxj h ALA 723 Ca 0.00 0.30 0.05 0.00 0.00 0.00 0.00 54.91 55.25 1oxj h ALA 723 Cb 0.86 0.58 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1oxj h ALA 723 CO 0.00 -0.41 0.14 -0.39 0.00 0.00 0.00 179.25 178.59 1oxj h VAL 724 N 0.00 0.72 0.00 0.00 -1.51 -1.81 -1.94 116.25 111.71 1oxj h VAL 724 Ca 0.37 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.84 1oxj h VAL 724 Cb 0.56 0.90 0.00 0.00 -2.13 0.00 0.00 31.29 30.62 1oxj h VAL 724 CO -0.78 0.00 0.00 1.56 -1.23 0.00 0.00 177.57 177.12 1oxj h GLN 725 N 0.00 0.00 -5.03 5.19 1.08 -0.37 -3.38 115.11 112.59 1oxj h GLN 725 Ca 0.08 0.00 -0.71 0.00 -1.45 0.00 0.00 58.65 56.56 1oxj h GLN 725 Cb 0.35 0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 27.62 1oxj h GLN 725 CO -0.00 0.00 1.37 0.34 -0.95 0.00 0.00 178.83 179.59 1oxj s ASP 726 N -5.70 6.92 0.27 1.46 -1.08 -0.73 -4.83 116.67 112.97 1oxj s ASP 726 Ca 0.04 -2.65 -0.04 0.00 -0.52 0.00 0.00 52.55 49.39 1oxj s ASP 726 Cb 0.08 -2.43 0.34 0.00 -1.46 0.00 0.00 42.92 39.44 1oxj s ASP 726 CO 0.59 -0.91 1.91 -0.78 0.52 0.00 0.00 175.17 176.50 1oxj h ASP 727 N 7.69 1.03 0.49 -0.34 -0.00 -1.84 -1.96 116.42 121.48 1oxj h ASP 727 Ca 0.30 -0.06 -0.02 0.00 -0.00 0.00 0.00 57.03 57.24 1oxj h ASP 727 Cb 0.91 -0.26 0.00 0.00 -0.00 0.00 0.00 39.33 39.99 1oxj h ASP 727 CO 1.26 0.79 -0.23 -0.08 -0.00 0.00 0.00 179.24 180.97 1oxj h GLU 728 N 1.18 -0.63 -0.27 0.28 4.81 -1.97 -1.27 114.58 116.72 1oxj h GLU 728 Ca 0.31 0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.62 1oxj h GLU 728 Cb -0.05 0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.44 1oxj h GLU 728 CO -0.06 -0.34 0.04 1.15 -0.73 0.00 0.00 179.01 179.07 1oxj h THR 729 N -0.87 0.85 -0.83 0.32 2.02 -1.96 -1.26 112.91 111.19 1oxj h THR 729 Ca -0.07 -0.04 0.01 0.00 0.77 0.00 0.00 66.41 67.08 1oxj h THR 729 Cb 0.58 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 1oxj h THR 729 CO 0.11 0.02 0.55 0.25 0.37 0.00 0.00 175.52 176.82 1oxj h LEU 730 N 0.13 0.94 -0.54 2.58 5.85 -1.39 -1.29 115.31 121.60 1oxj h LEU 730 Ca 0.12 -0.02 -0.07 0.00 0.84 0.00 0.00 57.88 58.76 1oxj h LEU 730 Cb 0.14 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 1oxj h LEU 730 CO -0.18 0.68 0.08 1.23 -0.34 0.00 0.00 178.44 179.91 1oxj h GLY 731 N 1.11 0.97 0.94 3.75 0.00 -0.43 -1.60 103.07 107.80 1oxj h GLY 731 Ca 0.31 -0.65 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 1oxj h GLY 731 CO -0.07 0.60 0.05 -2.08 0.00 0.00 0.00 176.54 175.04 1oxj h VAL 732 N 0.78 1.25 -0.86 4.60 2.07 -0.73 -2.48 116.25 120.89 1oxj h VAL 732 Ca 0.16 -0.91 0.05 0.00 0.82 0.00 0.00 66.70 66.82 1oxj h VAL 732 Cb 0.42 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1oxj h VAL 732 CO 0.01 0.31 0.55 0.25 0.02 0.00 0.00 177.57 178.71 1oxj h LEU 733 N 0.52 0.89 -0.93 2.57 5.85 -1.10 0.11 115.31 123.22 1oxj h LEU 733 Ca 0.12 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 1oxj h LEU 733 Cb 0.40 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1oxj h LEU 733 CO 0.01 0.59 0.17 0.24 -0.34 0.00 0.00 178.44 179.12 1oxj h MET 734 N 1.03 0.96 -0.66 1.25 2.86 -1.13 -0.14 114.93 119.11 1oxj h MET 734 Ca 0.36 -0.20 -0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1oxj h MET 734 Cb 0.08 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.57 1oxj h MET 734 CO -0.14 0.84 0.10 2.35 1.06 0.00 0.00 176.91 181.12 1oxj h TRP 735 N 0.93 1.16 -0.10 -0.22 7.01 -0.84 -0.39 115.95 123.49 1oxj h TRP 735 Ca 0.20 -0.16 -0.00 0.00 2.11 0.00 0.00 58.89 61.04 1oxj h TRP 735 Cb 0.30 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 27.03 1oxj h TRP 735 CO 0.02 0.98 0.06 0.82 -2.79 0.00 0.00 178.44 177.53 1oxj h ILE 736 N 1.01 1.06 -0.98 2.65 2.04 -0.21 -0.13 117.51 122.96 1oxj h ILE 736 Ca 0.20 -0.17 0.03 0.00 1.00 0.00 0.00 64.86 65.92 1oxj h ILE 736 Cb 0.45 0.99 -0.06 0.00 -0.74 0.00 0.00 36.82 37.46 1oxj h ILE 736 CO 0.01 0.06 0.64 -0.07 0.00 0.00 0.00 178.15 178.79 1oxj h LEU 737 N 0.10 1.07 -0.08 1.44 3.38 -0.88 0.74 115.31 121.08 1oxj h LEU 737 Ca 0.04 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1oxj h LEU 737 Cb 0.04 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1oxj h LEU 737 CO -0.01 0.74 -0.13 -0.78 0.09 0.00 0.00 178.44 178.36 1oxj h ASP 738 N 1.25 -0.38 0.36 -0.43 3.58 -0.38 0.88 116.42 121.29 1oxj h ASP 738 Ca 0.38 0.07 -0.11 0.00 0.42 0.00 0.00 57.03 57.79 1oxj h ASP 738 Cb -0.02 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1oxj h ASP 738 CO -0.11 -0.17 -0.48 0.03 -2.88 0.00 0.00 179.24 175.63 1oxj h ARG 739 N -0.17 0.15 -0.27 0.28 2.47 -0.50 -3.06 114.38 113.27 1oxj h ARG 739 Ca 0.07 -0.08 -0.14 0.00 -1.26 0.00 0.00 59.98 58.58 1oxj h ARG 739 Cb 0.28 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.59 1oxj h ARG 739 CO -0.18 0.59 -0.40 0.77 0.56 0.00 0.00 179.97 181.31 1oxj h SER 740 N 0.12 0.67 0.05 7.04 0.02 -0.25 -2.76 113.55 118.45 1oxj h SER 740 Ca 0.01 -0.30 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 1oxj h SER 740 Cb 0.89 -0.19 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 1oxj h SER 740 CO 0.07 1.00 -0.04 0.40 -1.14 0.00 0.00 176.83 177.12 1oxj h ILE 741 N 0.52 0.87 -0.58 3.27 2.04 -0.74 -1.90 117.51 120.99 1oxj h ILE 741 Ca 0.04 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1oxj h ILE 741 Cb 0.92 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 38.08 1oxj h ILE 741 CO 0.08 0.04 0.00 1.41 0.00 0.00 0.00 178.15 179.68 1oxj n HIS 742 N -4.27 1.15 -3.01 1.37 8.25 -1.06 -4.79 115.22 112.85 1oxj n HIS 742 Ca -0.03 -0.59 -0.42 0.00 -0.26 0.00 0.00 57.72 56.42 1oxj n HIS 742 Cb 0.12 -0.16 -0.06 0.00 1.12 0.00 0.00 29.99 31.01 1oxj n HIS 742 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1oxj s ASN 743 N -1.04 6.55 0.55 0.41 3.84 -0.72 -4.92 114.94 119.61 1oxj s ASN 743 Ca 0.45 0.41 0.31 0.00 0.21 0.00 0.00 52.86 54.24 1oxj s ASN 743 Cb 0.28 -2.37 1.47 0.00 -0.55 0.00 0.00 41.25 40.07 1oxj s ASN 743 CO 0.24 -0.63 1.89 -0.33 -2.79 0.00 0.00 177.10 175.48 1oxj h GLU 744 N 8.32 0.00 0.00 0.43 5.08 -1.90 0.37 114.58 126.88 1oxj h GLU 744 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1oxj h GLU 744 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1oxj h GLU 744 CO 0.87 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.88 1oxj h ALA 745 N 1.52 1.00 -0.44 3.43 0.00 -1.88 -2.05 119.26 120.85 1oxj h ALA 745 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1oxj h ALA 745 Cb 1.58 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1oxj h ALA 745 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 1oxj n PHE 746 N -2.90 1.07 -0.35 0.00 3.72 0.13 -3.52 117.46 115.61 1oxj n PHE 746 Ca -0.00 -0.67 0.05 0.00 -0.05 0.00 0.00 57.45 56.77 1oxj n PHE 746 Cb 0.23 -0.22 0.12 0.00 -0.94 0.00 0.00 39.48 38.67 1oxj n PHE 746 CO 0.00 0.00 0.00 -0.12 -0.05 0.00 0.00 176.76 176.59 1oxj n MET 747 N 0.42 -0.11 -0.11 -1.08 0.00 -0.77 0.29 117.12 115.76 1oxj n MET 747 Ca 0.21 1.48 0.02 0.00 -0.00 0.00 0.00 57.70 59.41 1oxj n MET 747 Cb 0.78 -2.21 0.06 0.00 0.00 0.00 0.00 33.22 31.85 1oxj n MET 747 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1oxj n ASN 748 N -5.53 1.23 0.00 6.12 3.02 -1.26 -3.08 115.26 115.76 1oxj n ASN 748 Ca 0.14 -2.08 0.00 0.00 -0.03 0.00 0.00 54.58 52.62 1oxj n ASN 748 Cb 0.46 -0.29 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 1oxj n ASN 748 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1oxj n HIS 749 N -0.01 0.00 -0.32 3.10 8.25 0.15 -4.81 115.22 121.58 1oxj n HIS 749 Ca 0.05 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.64 1oxj n HIS 749 Cb 0.25 0.00 0.31 0.00 1.12 0.00 0.00 29.99 31.68 1oxj n HIS 749 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1oxj h ALA 750 N 0.00 1.52 -0.21 -1.41 0.00 -1.14 -0.29 119.26 117.74 1oxj h ALA 750 Ca 0.00 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1oxj h ALA 750 Cb 0.15 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1oxj h ALA 750 CO 0.00 -0.25 0.10 1.03 0.00 0.00 0.00 179.25 180.13 1oxj h SER 751 N 0.53 0.27 -0.09 0.00 0.87 -1.87 -0.49 113.55 112.77 1oxj h SER 751 Ca 0.57 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.94 1oxj h SER 751 Cb 1.01 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.89 1oxj h SER 751 CO -0.47 0.33 -0.09 1.56 -0.53 0.00 0.00 176.83 177.63 1oxj h GLN 752 N 0.20 0.38 -0.26 2.24 7.50 -1.57 -1.88 115.11 121.72 1oxj h GLN 752 Ca 0.07 -0.09 -0.13 0.00 0.50 0.00 0.00 58.65 59.00 1oxj h GLN 752 Cb 0.13 -0.05 -0.00 0.00 0.05 0.00 0.00 27.48 27.61 1oxj h GLN 752 CO -0.01 0.48 -0.34 -0.07 -1.50 0.00 0.00 178.83 177.40 1oxj h LEU 753 N 0.36 0.75 -0.84 1.46 3.38 -0.73 -1.24 115.31 118.46 1oxj h LEU 753 Ca 0.07 -0.50 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 1oxj h LEU 753 Cb 0.38 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1oxj h LEU 753 CO 0.02 1.10 0.38 0.11 0.09 0.00 0.00 178.44 180.14 1oxj h LYS 754 N 0.43 1.22 0.29 1.13 1.57 -0.85 0.05 116.57 120.40 1oxj h LYS 754 Ca 0.03 -0.19 -0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1oxj h LYS 754 Cb 0.92 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.02 1oxj h LYS 754 CO 0.08 0.95 -0.14 -0.44 -0.57 0.00 0.00 179.45 179.33 1oxj h ASP 755 N 1.20 -0.33 -0.28 0.86 3.45 -1.23 -0.22 116.42 119.86 1oxj h ASP 755 Ca 0.28 -0.02 0.06 0.00 0.43 0.00 0.00 57.03 57.78 1oxj h ASP 755 Cb 0.15 0.09 -0.05 0.00 -0.56 0.00 0.00 39.33 38.96 1oxj h ASP 755 CO -0.03 -0.20 -0.07 0.25 -1.57 0.00 0.00 179.24 177.62 1oxj h LEU 756 N -0.44 -0.26 -1.54 1.55 6.46 -0.92 0.93 115.31 121.10 1oxj h LEU 756 Ca -0.04 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 57.80 1oxj h LEU 756 Cb 0.33 0.17 -0.02 0.00 -0.73 0.00 0.00 40.66 40.41 1oxj h LEU 756 CO 0.07 -0.09 0.28 0.50 -0.62 0.00 0.00 178.44 178.57 1oxj h LYS 757 N -0.00 0.59 -0.23 1.25 3.64 -0.88 -1.66 116.57 119.27 1oxj h LYS 757 Ca 0.13 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.40 1oxj h LYS 757 Cb 0.21 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1oxj h LYS 757 CO -0.29 0.40 -0.13 0.35 -2.27 0.00 0.00 179.45 177.51 1oxj h PHE 758 N 0.60 0.58 -0.56 1.91 3.57 0.55 -1.63 116.94 121.96 1oxj h PHE 758 Ca 0.16 -0.15 0.04 0.00 3.53 0.00 0.00 57.97 61.55 1oxj h PHE 758 Cb -0.04 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 1oxj h PHE 758 CO 0.00 0.78 0.31 0.87 -2.23 0.00 0.00 178.31 178.04 1oxj h LYS 759 N 0.21 0.57 -0.40 1.11 6.56 -0.28 -2.54 116.57 121.80 1oxj h LYS 759 Ca 0.05 -0.03 -0.10 0.00 -1.06 0.00 0.00 60.65 59.51 1oxj h LYS 759 Cb 0.64 -0.13 -0.02 0.00 -0.57 0.00 0.00 32.23 32.15 1oxj h LYS 759 CO 0.04 0.38 -0.14 -0.07 -2.06 0.00 0.00 179.45 177.59 1oxj h LEU 760 N 0.59 0.72 -1.44 2.94 3.38 -1.26 -2.67 115.31 117.58 1oxj h LEU 760 Ca 0.24 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1oxj h LEU 760 Cb 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1oxj h LEU 760 CO -0.14 0.88 0.00 0.77 0.09 0.00 0.00 178.44 180.04 1oxj h SER 761 N 0.65 0.00 -0.30 -0.43 4.64 -0.86 -2.45 113.55 114.81 1oxj h SER 761 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1oxj h SER 761 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1oxj h SER 761 CO 0.04 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.29 1oxj n LYS 762 N -2.45 2.23 0.00 4.77 4.76 -1.01 -5.10 118.16 121.36 1oxj n LYS 762 Ca -0.00 -2.05 0.08 0.00 -2.87 0.00 0.00 58.31 53.46 1oxj n LYS 762 Cb 0.13 -1.43 0.45 0.00 -1.84 0.00 0.00 35.03 32.34 1oxj n LYS 762 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70