#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wnv h LEU 608 N 0.00 0.21 -0.71 0.99 5.85 -1.85 -0.85 115.31 118.95 1wnv h LEU 608 Ca 0.00 0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.89 1wnv h LEU 608 Cb 0.00 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.03 1wnv h LEU 608 CO 0.00 0.12 0.37 0.00 -0.34 0.00 0.00 178.44 178.59 1wnv h ALA 609 N 1.43 0.97 -0.27 1.25 0.00 -1.83 0.25 119.26 121.05 1wnv h ALA 609 Ca 0.31 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.18 1wnv h ALA 609 Cb 0.40 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1wnv h ALA 609 CO -0.32 -0.00 -0.16 0.28 0.00 0.00 0.00 179.25 179.05 1wnv h VAL 610 N 0.65 1.30 -0.20 0.00 2.07 -1.76 -2.03 116.25 116.28 1wnv h VAL 610 Ca 0.34 -1.27 -0.11 0.00 0.82 0.00 0.00 66.70 66.48 1wnv h VAL 610 Cb 0.31 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1wnv h VAL 610 CO -0.24 0.40 -0.33 -0.08 0.02 0.00 0.00 177.57 177.34 1wnv h GLU 611 N 0.32 0.41 -0.32 1.57 4.81 -0.70 0.08 114.58 120.75 1wnv h GLU 611 Ca 0.06 -0.18 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1wnv h GLU 611 Cb 0.69 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.04 1wnv h GLU 611 CO 0.05 0.70 0.19 -0.07 -0.73 0.00 0.00 179.01 179.14 1wnv h LEU 612 N 0.35 0.40 0.12 1.64 3.38 -0.45 0.23 115.31 120.98 1wnv h LEU 612 Ca 0.04 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1wnv h LEU 612 Cb 0.76 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1wnv h LEU 612 CO 0.06 0.35 -0.06 0.50 0.09 0.00 0.00 178.44 179.38 1wnv h LYS 613 N 0.41 -0.15 -0.44 1.13 3.64 -1.07 -2.32 116.57 117.77 1wnv h LYS 613 Ca 0.12 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1wnv h LYS 613 Cb 0.03 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 1wnv h LYS 613 CO -0.02 -0.02 0.20 0.37 -2.27 0.00 0.00 179.45 177.71 1wnv h GLN 614 N -0.25 0.64 0.00 1.90 -0.00 -0.91 -2.21 115.11 114.28 1wnv h GLN 614 Ca -0.02 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.53 1wnv h GLN 614 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 27.48 27.57 1wnv h GLN 614 CO 0.03 0.57 0.00 -1.13 0.00 0.00 0.00 178.83 178.29 1wnv n SER 615 N -4.64 0.68 -0.53 -0.69 3.41 0.06 -2.77 113.62 109.14 1wnv n SER 615 Ca 0.01 0.61 0.05 0.00 -0.26 0.00 0.00 58.87 59.28 1wnv n SER 615 Cb 0.13 -0.78 0.12 0.00 -0.26 0.00 0.00 64.21 63.42 1wnv n SER 615 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1wnv n THR 616 N -2.19 0.90 -0.06 6.66 -2.24 -0.88 -4.77 114.28 111.70 1wnv n THR 616 Ca 0.04 -0.95 -0.06 0.00 -2.27 0.00 0.00 64.05 60.81 1wnv n THR 616 Cb 0.32 0.57 0.13 0.00 -2.10 0.00 0.00 70.33 69.26 1wnv n THR 616 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wnv h ALA 617 N 1.74 0.98 -0.47 6.98 0.00 -1.21 0.34 119.26 127.61 1wnv h ALA 617 Ca 0.00 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1wnv h ALA 617 Cb 0.67 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1wnv h ALA 617 CO 0.00 0.60 0.19 0.37 0.00 0.00 0.00 179.25 180.40 1wnv h GLN 618 N 0.60 0.71 -0.64 0.00 4.15 -1.86 -1.74 115.11 116.33 1wnv h GLN 618 Ca 0.09 -0.13 -0.06 0.00 0.77 0.00 0.00 58.65 59.31 1wnv h GLN 618 Cb 0.68 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.23 1wnv h GLN 618 CO 0.05 0.64 0.15 0.00 -1.93 0.00 0.00 178.83 177.75 1wnv h ALA 619 N 1.03 0.85 -0.63 3.38 0.00 -1.81 -2.50 119.26 119.58 1wnv h ALA 619 Ca 0.16 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1wnv h ALA 619 Cb 0.20 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1wnv h ALA 619 CO -0.01 0.57 0.13 1.25 0.00 0.00 0.00 179.25 181.18 1wnv h HIS 620 N 0.95 1.08 -1.00 0.00 -0.00 -0.47 -0.53 115.15 115.18 1wnv h HIS 620 Ca 0.20 -0.14 0.07 0.00 -0.00 0.00 0.00 60.37 60.50 1wnv h HIS 620 Cb 0.36 -0.30 -0.07 0.00 -0.00 0.00 0.00 27.41 27.41 1wnv h HIS 620 CO 0.03 0.91 0.65 0.93 -0.00 0.00 0.00 177.93 180.44 1wnv h GLU 621 N 0.93 1.14 -0.28 5.26 4.39 -1.23 -0.49 114.58 124.30 1wnv h GLU 621 Ca 0.19 -0.07 -0.09 0.00 0.34 0.00 0.00 59.36 59.73 1wnv h GLU 621 Cb 0.39 -0.26 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1wnv h GLU 621 CO 0.01 0.75 -0.21 0.87 -1.16 0.00 0.00 179.01 179.27 1wnv h LYS 622 N 1.17 0.52 -0.08 2.33 1.57 -0.93 -2.30 116.57 118.85 1wnv h LYS 622 Ca 0.43 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.87 1wnv h LYS 622 Cb 0.17 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1wnv h LYS 622 CO -0.17 0.70 -0.66 0.00 -0.57 0.00 0.00 179.45 178.75 1wnv h ALA 623 N 1.31 0.74 -0.01 3.86 0.00 -0.62 -1.82 119.26 122.71 1wnv h ALA 623 Ca 0.07 -0.57 -0.19 0.00 0.00 0.00 0.00 54.91 54.22 1wnv h ALA 623 Cb 0.63 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1wnv h ALA 623 CO 0.04 0.75 -0.84 1.49 0.00 0.00 0.00 179.25 180.70 1wnv h GLU 624 N 0.22 0.25 -0.17 0.00 4.81 -0.85 -3.20 114.58 115.65 1wnv h GLU 624 Ca -0.01 -0.25 -0.07 0.00 -0.13 0.00 0.00 59.36 58.89 1wnv h GLU 624 Cb 1.19 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 30.60 1wnv h GLU 624 CO 0.11 0.95 -0.21 0.72 -0.73 0.00 0.00 179.01 179.85 1wnv n HIS 625 N -3.72 0.53 -1.63 0.92 8.25 -0.89 -4.52 115.22 114.16 1wnv n HIS 625 Ca -0.04 -1.41 -0.37 0.00 -0.26 0.00 0.00 57.72 55.65 1wnv n HIS 625 Cb 0.78 -0.34 0.07 0.00 1.12 0.00 0.00 29.99 31.62 1wnv n HIS 625 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1wnv n SER 626 N -1.11 1.68 -0.28 0.41 3.41 -0.69 -4.80 113.62 112.25 1wnv n SER 626 Ca 0.25 0.79 -0.01 0.00 -0.26 0.00 0.00 58.87 59.64 1wnv n SER 626 Cb 0.84 -1.52 0.12 0.00 -0.26 0.00 0.00 64.21 63.39 1wnv n SER 626 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1wnv h THR 627 N 0.34 1.04 0.23 6.66 2.02 -1.94 -1.26 112.91 120.00 1wnv h THR 627 Ca -0.50 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.36 1wnv h THR 627 Cb 1.34 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1wnv h THR 627 CO 0.52 0.16 -0.11 0.15 0.37 0.00 0.00 175.52 176.61 1wnv h PHE 628 N 0.90 -0.29 -0.17 3.16 3.57 -1.91 -1.29 116.94 120.90 1wnv h PHE 628 Ca 0.34 -0.01 -0.12 0.00 3.53 0.00 0.00 57.97 61.71 1wnv h PHE 628 Cb 0.14 0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1wnv h PHE 628 CO -0.04 -0.03 -0.42 0.52 -2.23 0.00 0.00 178.31 176.11 1wnv h MET 629 N -0.52 0.41 0.07 1.11 2.86 -1.87 0.18 114.93 117.18 1wnv h MET 629 Ca -0.03 -0.21 -0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1wnv h MET 629 Cb 0.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.05 1wnv h MET 629 CO 0.05 0.76 -0.04 0.77 1.06 0.00 0.00 176.91 179.52 1wnv h SER 630 N 0.34 -0.08 -0.84 1.22 0.02 -1.18 -0.34 113.55 112.69 1wnv h SER 630 Ca 0.03 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 1wnv h SER 630 Cb 0.88 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.40 1wnv h SER 630 CO 0.07 0.22 0.48 0.44 -1.14 0.00 0.00 176.83 176.91 1wnv h ASP 631 N -0.39 1.03 -0.07 3.07 3.45 -1.13 -0.75 116.42 121.63 1wnv h ASP 631 Ca -0.01 -0.07 -0.00 0.00 0.43 0.00 0.00 57.03 57.37 1wnv h ASP 631 Cb 0.34 -0.26 -0.00 0.00 -0.56 0.00 0.00 39.33 38.85 1wnv h ASP 631 CO 0.02 0.81 0.04 0.25 -1.57 0.00 0.00 179.24 178.78 1wnv h LEU 632 N 1.17 0.08 -1.00 1.55 5.85 -0.39 -1.25 115.31 121.33 1wnv h LEU 632 Ca 0.30 -0.08 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 1wnv h LEU 632 Cb -0.01 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1wnv h LEU 632 CO -0.05 0.13 -0.47 -0.07 -0.34 0.00 0.00 178.44 177.64 1wnv h LEU 633 N 0.02 0.00 -1.86 2.25 3.38 -0.95 -2.80 115.31 115.36 1wnv h LEU 633 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1wnv h LEU 633 Cb 0.07 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1wnv h LEU 633 CO -0.00 0.47 -0.06 0.11 0.09 0.00 0.00 178.44 179.04 1wnv h LYS 634 N 0.00 0.00 0.00 1.13 1.57 -1.07 -3.47 116.57 114.73 1wnv h LYS 634 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1wnv h LYS 634 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1wnv h LYS 634 CO 0.06 0.06 0.00 0.41 -0.57 0.00 0.00 179.45 179.41 1wnv n GLY 635 N -0.38 0.87 0.02 3.86 0.00 -1.06 -4.99 105.19 103.52 1wnv n GLY 635 Ca -0.01 -0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1wnv n GLY 635 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wnv n ARG 636 N -2.26 0.09 0.00 1.61 1.74 -0.49 -4.82 116.66 112.53 1wnv n ARG 636 Ca 0.00 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.11 1wnv n ARG 636 Cb 0.00 -1.56 0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1wnv n ARG 636 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1wnv n LEU 637 N -1.70 0.00 0.00 0.55 4.77 -1.22 -4.99 117.00 114.41 1wnv n LEU 637 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1wnv n LEU 637 Cb 0.37 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1wnv n LEU 637 CO 0.34 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1wnv n GLY 638 N 5.00 -0.96 0.30 -0.72 0.00 -1.26 -5.00 105.19 102.55 1wnv n GLY 638 Ca 0.00 -1.04 0.14 0.00 0.00 0.00 0.00 46.02 45.12 1wnv n GLY 638 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1wnv h VAL 639 N 0.60 0.69 -0.36 1.61 2.07 -1.98 -1.98 116.25 116.91 1wnv h VAL 639 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1wnv h VAL 639 Cb 0.00 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1wnv h VAL 639 CO 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 177.57 177.55 1wnv h ALA 640 N 1.93 0.49 -0.49 1.67 0.00 -1.99 0.42 119.26 121.29 1wnv h ALA 640 Ca 0.04 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1wnv h ALA 640 Cb 0.18 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1wnv h ALA 640 CO -0.00 0.30 -0.08 0.93 0.00 0.00 0.00 179.25 180.40 1wnv h GLU 641 N 0.47 0.91 -1.00 0.00 3.07 -1.78 -1.79 114.58 114.47 1wnv h GLU 641 Ca 0.10 -0.33 0.03 0.00 -0.50 0.00 0.00 59.36 58.66 1wnv h GLU 641 Cb 0.53 -0.06 -0.06 0.00 -0.84 0.00 0.00 28.75 28.32 1wnv h GLU 641 CO 0.03 0.98 0.66 0.35 -1.40 0.00 0.00 179.01 179.62 1wnv h PHE 642 N 0.76 1.24 -0.34 4.33 3.57 -1.16 -1.11 116.94 124.24 1wnv h PHE 642 Ca 0.13 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.53 1wnv h PHE 642 Cb 0.62 -0.42 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1wnv h PHE 642 CO 0.05 0.74 -0.31 1.15 -2.23 0.00 0.00 178.31 177.70 1wnv h THR 643 N 1.30 1.28 -0.80 4.41 2.02 -0.68 -1.54 112.91 118.90 1wnv h THR 643 Ca 0.39 -1.44 -0.04 0.00 0.77 0.00 0.00 66.41 66.08 1wnv h THR 643 Cb -0.05 1.35 -0.04 0.00 -1.74 0.00 0.00 68.15 67.67 1wnv h THR 643 CO -0.11 0.47 0.33 0.03 0.37 0.00 0.00 175.52 176.61 1wnv h ARG 644 N 0.61 1.18 -0.15 6.66 2.47 -0.88 -0.25 114.38 124.02 1wnv h ARG 644 Ca 0.07 -0.21 0.00 0.00 -1.26 0.00 0.00 59.98 58.59 1wnv h ARG 644 Cb 0.82 -0.20 -0.01 0.00 -1.65 0.00 0.00 29.97 28.94 1wnv h ARG 644 CO 0.07 0.95 0.10 1.25 0.56 0.00 0.00 179.97 182.89 1wnv h LEU 645 N 1.16 0.18 -0.89 3.04 5.85 -0.82 -2.39 115.31 121.44 1wnv h LEU 645 Ca 0.27 -0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 1wnv h LEU 645 Cb 0.20 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 1wnv h LEU 645 CO -0.02 0.16 -0.13 1.56 -0.34 0.00 0.00 178.44 179.66 1wnv h GLN 646 N 0.19 0.68 0.01 1.25 1.08 -0.76 0.11 115.11 117.66 1wnv h GLN 646 Ca 0.06 -0.22 0.02 0.00 -1.45 0.00 0.00 58.65 57.05 1wnv h GLN 646 Cb 0.00 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.35 1wnv h GLN 646 CO -0.01 0.79 -0.14 0.93 -0.95 0.00 0.00 178.83 179.44 1wnv h GLU 647 N 0.62 -0.23 -0.79 1.46 5.08 -0.94 0.08 114.58 119.85 1wnv h GLU 647 Ca 0.11 0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1wnv h GLU 647 Cb 0.58 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.83 1wnv h GLU 647 CO 0.04 -0.16 0.50 1.96 -1.00 0.00 0.00 179.01 180.35 1wnv h GLN 648 N -0.24 0.93 -0.92 2.33 1.08 -0.94 -2.54 115.11 114.81 1wnv h GLN 648 Ca 0.05 -0.06 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 1wnv h GLN 648 Cb 0.30 -0.21 -0.04 0.00 -0.05 0.00 0.00 27.48 27.47 1wnv h GLN 648 CO -0.13 0.62 0.58 0.00 -0.95 0.00 0.00 178.83 178.94 1wnv h ALA 649 N 1.34 1.17 -0.79 3.87 0.00 -0.68 -1.53 119.26 122.64 1wnv h ALA 649 Ca 0.32 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1wnv h ALA 649 Cb 0.04 -0.37 -0.04 0.00 0.00 0.00 0.00 17.79 17.42 1wnv h ALA 649 CO -0.12 0.61 0.40 2.35 0.00 0.00 0.00 179.25 182.48 1wnv h TRP 650 N 1.26 1.12 -0.31 0.00 7.01 -0.58 0.21 115.95 124.67 1wnv h TRP 650 Ca 0.33 -0.05 -0.02 0.00 2.11 0.00 0.00 58.89 61.27 1wnv h TRP 650 Cb -0.09 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 26.61 1wnv h TRP 650 CO -0.00 0.81 0.13 -0.07 -2.79 0.00 0.00 178.44 176.52 1wnv h LEU 651 N 1.11 0.41 0.08 0.65 3.38 -1.05 -1.19 115.31 118.71 1wnv h LEU 651 Ca 0.27 -0.15 -0.25 0.00 0.09 0.00 0.00 57.88 57.84 1wnv h LEU 651 Cb 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 1wnv h LEU 651 CO -0.04 0.45 -1.17 2.19 0.09 0.00 0.00 178.44 179.97 1wnv h PHE 652 N 0.35 0.31 -0.18 1.13 -5.15 -1.04 -2.85 116.94 109.51 1wnv h PHE 652 Ca 0.10 -0.23 -0.07 0.00 -0.20 0.00 0.00 57.97 57.57 1wnv h PHE 652 Cb 0.16 -0.01 -0.01 0.00 0.22 0.00 0.00 35.95 36.30 1wnv h PHE 652 CO -0.01 1.18 -0.22 1.88 -2.00 0.00 0.00 178.31 179.14 1wnv h TYR 653 N 0.05 0.34 -0.11 6.09 0.05 -0.61 0.12 116.97 122.89 1wnv h TYR 653 Ca -0.09 -0.06 0.00 0.00 0.05 0.00 0.00 58.73 58.63 1wnv h TYR 653 Cb 1.90 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 39.55 1wnv h TYR 653 CO 0.04 0.51 0.07 1.15 -1.05 0.00 0.00 178.16 178.89 1wnv h THR 654 N 0.28 1.05 -0.55 -2.88 2.02 -1.16 -0.38 112.91 111.28 1wnv h THR 654 Ca 0.05 -0.11 -0.06 0.00 0.77 0.00 0.00 66.41 67.06 1wnv h THR 654 Cb 0.55 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1wnv h THR 654 CO 0.04 0.04 0.10 0.00 0.37 0.00 0.00 175.52 176.07 1wnv h ALA 655 N 1.02 0.73 -0.36 6.16 0.00 -1.25 -2.14 119.26 123.42 1wnv h ALA 655 Ca 0.04 -0.24 0.05 0.00 0.00 0.00 0.00 54.91 54.75 1wnv h ALA 655 Cb 0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1wnv h ALA 655 CO -0.01 0.47 0.11 1.25 0.00 0.00 0.00 179.25 181.07 1wnv h LEU 656 N 0.81 0.09 -1.01 0.00 5.85 -0.55 -2.02 115.31 118.47 1wnv h LEU 656 Ca 0.17 0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.85 1wnv h LEU 656 Cb 0.40 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1wnv h LEU 656 CO 0.01 0.09 -0.43 -0.33 -0.34 0.00 0.00 178.44 177.44 1wnv h GLU 657 N 0.24 0.00 -0.49 1.25 5.08 -0.90 0.79 114.58 120.56 1wnv h GLU 657 Ca 0.17 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.50 1wnv h GLU 657 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 1wnv h GLU 657 CO -0.19 0.43 0.20 1.96 -1.00 0.00 0.00 179.01 180.41 1wnv h GLN 658 N 0.00 0.73 -0.56 2.33 4.20 -0.91 -1.03 115.11 119.87 1wnv h GLN 658 Ca -0.00 -0.13 -0.11 0.00 0.06 0.00 0.00 58.65 58.47 1wnv h GLN 658 Cb 0.87 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.51 1wnv h GLN 658 CO 0.06 0.65 -0.06 0.00 -0.67 0.00 0.00 178.83 178.80 1wnv h ALA 659 N 1.04 0.76 -0.57 3.87 0.00 -0.66 -2.51 119.26 121.21 1wnv h ALA 659 Ca 0.16 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1wnv h ALA 659 Cb 0.19 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1wnv h ALA 659 CO -0.01 0.65 0.38 0.28 0.00 0.00 0.00 179.25 180.54 1wnv h VAL 660 N 0.92 1.14 -0.85 0.00 2.07 -0.77 -1.25 116.25 117.51 1wnv h VAL 660 Ca 0.15 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.45 1wnv h VAL 660 Cb 0.63 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.66 1wnv h VAL 660 CO 0.04 0.14 0.54 0.44 0.02 0.00 0.00 177.57 178.75 1wnv h ASP 661 N 0.77 0.88 -0.11 0.57 3.32 -1.12 0.12 116.42 120.84 1wnv h ASP 661 Ca 0.21 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.22 1wnv h ASP 661 Cb -0.09 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.27 1wnv h ASP 661 CO -0.05 0.59 -0.08 0.00 -1.72 0.00 0.00 179.24 177.98 1wnv h ALA 662 N 1.37 0.16 -0.58 3.45 0.00 -1.03 -1.32 119.26 121.31 1wnv h ALA 662 Ca 0.35 -0.28 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1wnv h ALA 662 Cb 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1wnv h ALA 662 CO -0.13 -0.03 0.36 0.28 0.00 0.00 0.00 179.25 179.73 1wnv h VAL 663 N -0.13 1.16 -0.62 0.00 2.07 -0.99 -2.34 116.25 115.40 1wnv h VAL 663 Ca 0.02 -0.35 0.07 0.00 0.82 0.00 0.00 66.70 67.27 1wnv h VAL 663 Cb 0.58 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 30.64 1wnv h VAL 663 CO 0.02 0.17 0.30 -0.09 0.02 0.00 0.00 177.57 177.99 1wnv h ARG 664 N 0.78 0.53 0.00 1.57 2.43 -0.72 -2.03 114.38 116.95 1wnv h ARG 664 Ca 0.21 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1wnv h ARG 664 Cb -0.04 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1wnv h ARG 664 CO -0.04 0.35 -0.06 0.00 -1.51 0.00 0.00 179.97 178.71 1wnv h ALA 665 N 1.37 1.49 0.00 2.80 0.00 -0.84 0.44 119.26 124.52 1wnv h ALA 665 Ca 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1wnv h ALA 665 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1wnv h ALA 665 CO -0.23 0.08 0.00 -1.13 0.00 0.00 0.00 179.25 177.96 1wnv n SER 666 N -3.87 0.00 0.00 0.00 3.41 -0.77 -4.93 113.62 107.46 1wnv n SER 666 Ca -0.03 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1wnv n SER 666 Cb 0.15 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.76 1wnv n SER 666 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wnv n GLY 667 N 1.23 0.48 3.72 5.00 0.00 0.14 -5.05 105.19 110.72 1wnv n GLY 667 Ca 0.12 -0.62 -0.36 0.00 0.00 0.00 0.00 46.02 45.17 1wnv n GLY 667 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1wnv s PHE 668 N -2.00 3.42 -1.42 1.61 5.36 -1.19 -4.37 117.98 119.40 1wnv s PHE 668 Ca 0.00 0.43 -0.06 0.00 -0.96 0.00 0.00 56.93 56.34 1wnv s PHE 668 Cb 0.00 -2.24 0.03 0.00 -0.34 0.00 0.00 43.02 40.47 1wnv s PHE 668 CO 0.00 0.25 0.48 0.00 -1.46 0.00 0.00 175.22 174.49 1wnv n ALA 669 N 3.60 -0.98 -0.25 11.12 0.00 -1.26 -4.39 120.51 128.36 1wnv n ALA 669 Ca -0.14 0.19 0.04 0.00 0.00 0.00 0.00 53.44 53.52 1wnv n ALA 669 Cb 0.52 -3.18 0.17 0.00 0.00 0.00 0.00 19.45 16.96 1wnv n ALA 669 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1wnv h GLU 670 N -1.05 0.42 -0.14 0.00 5.08 -1.90 -1.94 114.58 115.05 1wnv h GLU 670 Ca -0.47 -0.03 -0.07 0.00 -1.00 0.00 0.00 59.36 57.79 1wnv h GLU 670 Cb 1.32 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1wnv h GLU 670 CO 0.54 0.28 -0.24 0.66 -1.00 0.00 0.00 179.01 179.24 1wnv h SER 671 N 0.43 0.25 -0.62 1.42 4.64 -1.96 -2.38 113.55 115.33 1wnv h SER 671 Ca 0.39 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.55 1wnv h SER 671 Cb 0.57 -0.07 -0.02 0.00 -0.31 0.00 0.00 62.40 62.57 1wnv h SER 671 CO -0.39 0.50 0.03 0.25 -0.87 0.00 0.00 176.83 176.36 1wnv h LEU 672 N 0.23 1.05 -5.31 5.97 5.85 -1.74 -3.35 115.31 118.00 1wnv h LEU 672 Ca 0.04 -0.29 -0.68 0.00 0.84 0.00 0.00 57.88 57.78 1wnv h LEU 672 Cb 0.56 -0.28 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 1wnv h LEU 672 CO 0.04 1.08 2.55 0.18 -0.34 0.00 0.00 178.44 181.95 1wnv n LEU 673 N -4.20 8.03 -4.66 2.25 4.77 -0.89 -4.93 117.00 117.36 1wnv n LEU 673 Ca 0.03 -4.62 -0.42 0.00 -0.03 0.00 0.00 56.01 50.97 1wnv n LEU 673 Cb 0.33 -1.41 -0.03 0.00 -2.33 0.00 0.00 43.42 39.99 1wnv n LEU 673 CO 0.44 2.03 1.46 -0.62 -1.33 0.00 0.00 177.39 179.37 1wnv s ASP 674 N 0.93 6.58 0.54 -1.43 -1.08 -1.26 -4.89 116.67 116.06 1wnv s ASP 674 Ca 0.59 2.39 0.36 0.00 -0.52 0.00 0.00 52.55 55.38 1wnv s ASP 674 Cb 0.20 -2.53 1.82 0.00 -1.46 0.00 0.00 42.92 40.95 1wnv s ASP 674 CO -0.09 -0.98 2.09 1.55 0.52 0.00 0.00 175.17 178.25 1wnv h PRO 675 N 9.96 0.00 0.00 4.34 0.13 -1.93 -1.36 132.00 143.14 1wnv h PRO 675 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1wnv h PRO 675 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1wnv h PRO 675 CO 0.95 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.72 1wnv h ALA 676 N 2.02 1.00 0.00 -0.56 0.00 -1.97 -1.78 119.26 117.98 1wnv h ALA 676 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wnv h ALA 676 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wnv h ALA 676 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 179.25 179.18 1wnv h LEU 677 N 0.00 0.00 -9.32 0.00 3.38 -1.63 -3.45 115.31 104.29 1wnv h LEU 677 Ca 0.00 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.31 1wnv h LEU 677 Cb 0.14 0.00 0.07 0.00 0.09 0.00 0.00 40.66 40.96 1wnv h LEU 677 CO 0.00 0.00 0.34 0.59 0.09 0.00 0.00 178.44 179.46 1wnv n ASN 678 N -2.65 1.47 -0.00 -0.43 5.03 -0.67 -4.91 115.26 113.10 1wnv n ASN 678 Ca 0.05 1.13 0.04 0.00 0.87 0.00 0.00 54.58 56.67 1wnv n ASN 678 Cb 0.47 -1.21 -0.06 0.00 -1.02 0.00 0.00 39.78 37.96 1wnv n ASN 678 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1wnv n ARG 679 N 2.03 0.68 -0.21 3.52 5.12 -1.26 -4.75 116.66 121.80 1wnv n ARG 679 Ca 0.16 -0.06 -0.07 0.00 -1.93 0.00 0.00 57.85 55.95 1wnv n ARG 679 Cb 0.23 -1.15 0.03 0.00 -1.16 0.00 0.00 32.46 30.40 1wnv n ARG 679 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1wnv h ALA 680 N 0.76 0.75 -0.22 7.54 0.00 -1.91 -0.40 119.26 125.79 1wnv h ALA 680 Ca 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 1wnv h ALA 680 Cb 0.34 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1wnv h ALA 680 CO 0.00 0.26 -0.49 0.93 0.00 0.00 0.00 179.25 179.95 1wnv h GLU 681 N 0.79 0.58 -0.39 0.00 3.07 -1.97 -1.82 114.58 114.84 1wnv h GLU 681 Ca 0.21 -0.33 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 1wnv h GLU 681 Cb 0.03 0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.95 1wnv h GLU 681 CO -0.03 0.93 0.22 0.28 -1.40 0.00 0.00 179.01 179.01 1wnv h VAL 682 N 0.46 1.14 -0.98 3.13 2.07 -1.78 -1.89 116.25 118.39 1wnv h VAL 682 Ca 0.02 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.23 1wnv h VAL 682 Cb 1.01 0.66 -0.05 0.00 -1.52 0.00 0.00 31.29 31.39 1wnv h VAL 682 CO 0.09 0.14 0.65 -0.07 0.02 0.00 0.00 177.57 178.40 1wnv h LEU 683 N 0.50 1.10 -0.55 2.57 3.38 -0.82 0.45 115.31 121.93 1wnv h LEU 683 Ca 0.14 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 1wnv h LEU 683 Cb 0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1wnv h LEU 683 CO -0.02 0.77 0.21 0.00 0.09 0.00 0.00 178.44 179.49 1wnv h ALA 684 N 1.38 0.71 -0.48 1.53 0.00 -1.08 0.88 119.26 122.20 1wnv h ALA 684 Ca 0.38 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1wnv h ALA 684 Cb -0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1wnv h ALA 684 CO -0.10 0.33 0.31 0.00 0.00 0.00 0.00 179.25 179.79 1wnv h ARG 685 N 0.75 0.61 -0.60 0.00 3.08 -0.99 -0.57 114.38 116.66 1wnv h ARG 685 Ca 0.18 -0.04 0.05 0.00 0.07 0.00 0.00 59.98 60.24 1wnv h ARG 685 Cb 0.21 -0.14 -0.05 0.00 0.08 0.00 0.00 29.97 30.07 1wnv h ARG 685 CO -0.01 0.40 0.34 -0.44 -1.07 0.00 0.00 179.97 179.18 1wnv h ASP 686 N 0.63 0.51 -0.43 7.04 3.45 -0.61 -1.41 116.42 125.60 1wnv h ASP 686 Ca 0.18 0.02 -0.05 0.00 0.43 0.00 0.00 57.03 57.61 1wnv h ASP 686 Cb -0.05 -0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 1wnv h ASP 686 CO -0.05 0.34 0.10 -0.07 -1.57 0.00 0.00 179.24 177.99 1wnv h LEU 687 N 0.64 0.72 -1.03 1.55 3.38 -0.57 0.71 115.31 120.70 1wnv h LEU 687 Ca 0.26 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 58.13 1wnv h LEU 687 Cb 0.12 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 40.63 1wnv h LEU 687 CO -0.15 0.72 0.65 0.44 0.09 0.00 0.00 178.44 180.19 1wnv h ASP 688 N 0.74 1.10 -0.06 -0.43 3.32 -0.69 -0.30 116.42 120.09 1wnv h ASP 688 Ca 0.16 -0.01 -0.20 0.00 0.02 0.00 0.00 57.03 57.00 1wnv h ASP 688 Cb 0.30 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.61 1wnv h ASP 688 CO 0.00 0.76 -0.74 0.11 -1.72 0.00 0.00 179.24 177.65 1wnv h LYS 689 N 1.27 0.61 -0.84 3.56 1.79 -0.50 0.11 116.57 122.57 1wnv h LYS 689 Ca 0.39 -0.58 0.02 0.00 -2.18 0.00 0.00 60.65 58.30 1wnv h LYS 689 Cb -0.03 0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 30.72 1wnv h LYS 689 CO -0.11 1.19 0.56 -0.07 -1.08 0.00 0.00 179.45 179.93 1wnv h LEU 690 N 0.24 0.95 0.00 2.94 3.38 -0.64 -3.06 115.31 119.11 1wnv h LEU 690 Ca -0.08 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1wnv h LEU 690 Cb 1.41 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1wnv h LEU 690 CO 0.15 0.68 -0.40 0.78 0.09 0.00 0.00 178.44 179.74 1wnv h ASN 691 N 1.12 0.00 -1.74 -0.43 2.35 -1.04 -3.48 115.58 112.35 1wnv h ASN 691 Ca 0.32 -0.10 -0.36 0.00 -0.55 0.00 0.00 56.30 55.61 1wnv h ASN 691 Cb -0.09 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.17 1wnv h ASN 691 CO -0.08 0.05 -0.37 0.61 -1.65 0.00 0.00 177.43 175.99 1wnv n GLY 692 N 1.28 1.09 3.51 2.83 0.00 0.36 -4.93 105.19 109.33 1wnv n GLY 692 Ca 0.04 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 1wnv n GLY 692 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wnv s SER 693 N -2.38 -0.38 0.07 1.61 0.15 -1.07 -5.03 113.70 106.67 1wnv s SER 693 Ca 0.00 -0.02 0.28 0.00 0.70 0.00 0.00 55.95 56.91 1wnv s SER 693 Cb 0.00 0.42 1.08 0.00 -1.71 0.00 0.00 66.02 65.81 1wnv s SER 693 CO 0.00 -0.68 1.87 -1.54 1.20 0.00 0.00 173.24 174.09 1wnv n SER 694 N -0.27 0.28 0.10 5.45 3.41 -1.26 -4.41 113.62 116.92 1wnv n SER 694 Ca -0.10 0.51 0.09 0.00 -0.26 0.00 0.00 58.87 59.12 1wnv n SER 694 Cb 0.62 -0.58 0.43 0.00 -0.26 0.00 0.00 64.21 64.42 1wnv n SER 694 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1wnv n GLU 695 N -1.75 0.12 -0.08 4.33 -0.00 -1.26 -2.29 120.64 119.70 1wnv n GLU 695 Ca 0.06 0.46 0.24 0.00 -0.00 0.00 0.00 57.16 57.93 1wnv n GLU 695 Cb 0.37 -1.79 0.71 0.00 -0.00 0.00 0.00 31.44 30.73 1wnv n GLU 695 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.13 177.24 1wnv h TRP 696 N 0.00 0.00 0.00 -1.84 5.08 -1.95 -0.46 115.95 116.78 1wnv h TRP 696 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 59.96 1wnv h TRP 696 Cb 0.20 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.36 1wnv h TRP 696 CO 0.00 0.00 -0.03 0.00 -1.28 0.00 0.00 178.44 177.13 1wnv h ARG 697 N 0.00 0.00 -0.02 0.12 3.08 -1.83 -0.31 114.38 115.42 1wnv h ARG 697 Ca 0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1wnv h ARG 697 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1wnv h ARG 697 CO -0.00 0.03 0.00 0.43 -1.07 0.00 0.00 179.97 179.36 1wnv n SER 698 N -3.46 1.44 0.00 7.04 7.64 -0.18 -4.30 113.62 121.79 1wnv n SER 698 Ca -0.02 -1.48 0.00 0.00 1.01 0.00 0.00 58.87 58.37 1wnv n SER 698 Cb 0.14 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.33 1wnv n SER 698 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1wnv n ARG 699 N 0.13 2.09 -2.57 1.43 1.74 -0.22 -5.08 116.66 114.18 1wnv n ARG 699 Ca 0.19 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.88 1wnv n ARG 699 Cb 0.34 -0.83 -0.05 0.00 -1.02 0.00 0.00 32.46 30.91 1wnv n ARG 699 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1wnv s ILE 700 N -1.34 3.70 -0.05 0.55 2.07 -0.67 -5.05 121.20 120.41 1wnv s ILE 700 Ca 0.00 1.61 -0.10 0.00 -1.41 0.00 0.00 60.65 60.75 1wnv s ILE 700 Cb 0.00 -3.98 0.02 0.00 0.13 0.00 0.00 42.46 38.63 1wnv s ILE 700 CO 0.00 0.30 0.25 0.28 -1.91 0.00 0.00 174.94 173.86 1wnv s THR 701 N -1.30 0.04 0.21 4.00 -1.32 -1.26 -5.04 115.64 110.97 1wnv s THR 701 Ca 0.47 -0.29 -0.30 0.00 -1.21 0.00 0.00 61.69 60.36 1wnv s THR 701 Cb -0.28 -0.45 -0.09 0.00 -1.51 0.00 0.00 72.50 70.17 1wnv s THR 701 CO 0.35 -0.16 1.35 0.00 -2.21 0.00 0.00 174.62 173.95 1wnv s ALA 702 N -0.62 3.56 0.96 11.08 0.00 -1.26 -4.94 121.76 130.55 1wnv s ALA 702 Ca -0.07 1.17 -0.12 0.00 0.00 0.00 0.00 51.96 52.94 1wnv s ALA 702 Cb -0.04 -3.51 0.17 0.00 0.00 0.00 0.00 23.12 19.74 1wnv s ALA 702 CO 0.02 -0.60 1.09 -1.54 0.00 0.00 0.00 175.76 174.73 1wnv s SER 703 N 0.36 2.87 0.35 0.00 1.04 -1.26 -4.72 113.70 112.33 1wnv s SER 703 Ca 0.58 1.41 0.03 0.00 0.48 0.00 0.00 55.95 58.44 1wnv s SER 703 Cb -0.38 -2.08 0.63 0.00 0.10 0.00 0.00 66.02 64.29 1wnv s SER 703 CO 0.39 -3.01 1.98 -0.65 0.98 0.00 0.00 173.24 172.94 1wnv h PRO 704 N -1.80 0.77 -0.33 4.02 0.11 -1.97 -0.19 132.00 132.60 1wnv h PRO 704 Ca -0.52 -0.07 -0.11 0.00 0.11 0.00 0.00 66.00 65.41 1wnv h PRO 704 Cb 1.31 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1wnv h PRO 704 CO 0.55 0.55 -0.24 0.00 -0.21 0.00 0.00 178.00 178.65 1wnv h ALA 705 N 1.58 0.96 -0.08 -0.75 0.00 -1.92 -2.53 119.26 116.53 1wnv h ALA 705 Ca 0.20 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 1wnv h ALA 705 Cb -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1wnv h ALA 705 CO -0.04 0.60 -0.64 0.28 0.00 0.00 0.00 179.25 179.46 1wnv h VAL 706 N 0.57 1.39 -0.41 0.00 2.07 -1.65 -1.14 116.25 117.08 1wnv h VAL 706 Ca 0.08 -2.03 0.05 0.00 0.82 0.00 0.00 66.70 65.62 1wnv h VAL 706 Cb 0.71 2.03 -0.04 0.00 -1.52 0.00 0.00 31.29 32.47 1wnv h VAL 706 CO 0.05 0.60 0.15 0.40 0.02 0.00 0.00 177.57 178.80 1wnv h ILE 707 N 0.21 0.89 -0.49 4.57 2.04 -0.86 0.21 117.51 124.08 1wnv h ILE 707 Ca -0.01 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1wnv h ILE 707 Cb 1.16 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 37.76 1wnv h ILE 707 CO 0.10 0.06 0.26 0.44 0.00 0.00 0.00 178.15 179.01 1wnv h ASP 708 N 0.32 0.61 -0.28 1.72 3.32 -1.27 -0.62 116.42 120.22 1wnv h ASP 708 Ca 0.19 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1wnv h ASP 708 Cb 0.16 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1wnv h ASP 708 CO -0.18 0.53 0.16 0.22 -1.72 0.00 0.00 179.24 178.26 1wnv h TYR 709 N 0.64 0.38 -0.71 4.55 3.20 -0.85 -2.24 116.97 121.93 1wnv h TYR 709 Ca 0.17 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.00 1wnv h TYR 709 Cb 0.06 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 1wnv h TYR 709 CO -0.02 0.30 0.29 0.28 -1.64 0.00 0.00 178.16 177.37 1wnv h VAL 710 N 0.35 1.24 -0.91 1.81 2.07 -0.43 -0.99 116.25 119.39 1wnv h VAL 710 Ca 0.10 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.86 1wnv h VAL 710 Cb 0.04 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 1wnv h VAL 710 CO -0.02 0.30 0.54 0.78 0.02 0.00 0.00 177.57 179.19 1wnv h ASN 711 N 1.03 1.10 -0.22 0.57 2.35 -0.80 0.81 115.58 120.43 1wnv h ASN 711 Ca 0.24 -0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 1wnv h ASN 711 Cb 0.19 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.27 1wnv h ASN 711 CO -0.02 0.86 -0.17 -0.09 -1.65 0.00 0.00 177.43 176.36 1wnv h ARG 712 N 1.26 0.49 -0.62 0.81 9.65 -0.77 -1.10 114.38 124.10 1wnv h ARG 712 Ca 0.33 -0.24 -0.03 0.00 -1.10 0.00 0.00 59.98 58.94 1wnv h ARG 712 Cb -0.03 -0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.52 1wnv h ARG 712 CO -0.06 0.81 0.28 -0.07 2.80 0.00 0.00 179.97 183.73 1wnv h LEU 713 N 0.18 0.81 -0.74 3.80 3.38 -0.75 -0.42 115.31 121.57 1wnv h LEU 713 Ca 0.04 -0.09 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1wnv h LEU 713 Cb 0.69 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1wnv h LEU 713 CO 0.04 0.70 0.25 -0.33 0.09 0.00 0.00 178.44 179.19 1wnv h GLU 714 N 0.88 1.13 -0.58 1.13 5.08 -0.68 -0.57 114.58 120.98 1wnv h GLU 714 Ca 0.22 -0.23 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1wnv h GLU 714 Cb 0.12 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1wnv h GLU 714 CO -0.03 0.96 0.37 0.93 -1.00 0.00 0.00 179.01 180.24 1wnv h GLU 715 N 1.08 0.72 -0.76 2.33 5.08 -0.42 -0.58 114.58 122.03 1wnv h GLU 715 Ca 0.24 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1wnv h GLU 715 Cb 0.28 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 1wnv h GLU 715 CO -0.01 0.47 0.42 0.82 -1.00 0.00 0.00 179.01 179.71 1wnv h ILE 716 N 0.74 1.23 0.16 3.13 2.04 -0.84 -0.46 117.51 123.50 1wnv h ILE 716 Ca 0.23 -0.58 -0.01 0.00 1.00 0.00 0.00 64.86 65.50 1wnv h ILE 716 Cb -0.03 0.22 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1wnv h ILE 716 CO -0.08 0.26 -0.08 -0.09 0.00 0.00 0.00 178.15 178.16 1wnv h ARG 717 N 1.06 -0.20 -0.11 2.37 2.43 -0.89 -0.87 114.38 118.16 1wnv h ARG 717 Ca 0.27 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.36 1wnv h ARG 717 Cb 0.04 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1wnv h ARG 717 CO -0.04 -0.11 -0.32 -0.44 -1.51 0.00 0.00 179.97 177.55 1wnv h ASP 718 N -0.24 0.23 0.13 -3.80 3.32 -0.88 -2.51 116.42 112.67 1wnv h ASP 718 Ca -0.02 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1wnv h ASP 718 Cb 0.19 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1wnv h ASP 718 CO 0.04 0.55 -0.24 0.59 -1.72 0.00 0.00 179.24 178.45 1wnv n ASN 719 N -4.10 1.39 -3.85 6.45 3.02 -0.20 -4.96 115.26 113.01 1wnv n ASN 719 Ca -0.01 -1.17 -0.32 0.00 -0.03 0.00 0.00 54.58 53.05 1wnv n ASN 719 Cb 0.41 0.17 0.02 0.00 -0.61 0.00 0.00 39.78 39.77 1wnv n ASN 719 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1wnv n VAL 720 N -0.29 -4.34 -2.98 2.41 0.31 -0.40 -4.86 118.33 108.17 1wnv n VAL 720 Ca 0.13 -0.75 -0.44 0.00 -0.01 0.00 0.00 64.34 63.27 1wnv n VAL 720 Cb 0.38 -3.39 -0.03 0.00 -0.91 0.00 0.00 33.84 29.90 1wnv n VAL 720 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1wnv s ASP 721 N -3.80 6.60 0.10 4.52 -1.08 -0.77 -4.89 116.67 117.36 1wnv s ASP 721 Ca 0.31 -2.04 -0.35 0.00 -0.52 0.00 0.00 52.55 49.95 1wnv s ASP 721 Cb -0.13 -2.37 -0.15 0.00 -1.46 0.00 0.00 42.92 38.82 1wnv s ASP 721 CO 0.89 -1.02 1.56 1.23 0.52 0.00 0.00 175.17 178.35 1wnv h GLY 722 N 10.10 -1.16 0.96 2.66 0.00 -1.89 -0.51 103.07 113.23 1wnv h GLY 722 Ca 0.10 0.63 0.03 0.00 0.00 0.00 0.00 47.33 48.10 1wnv h GLY 722 CO 1.06 -0.28 0.64 -2.55 0.00 0.00 0.00 176.54 175.41 1wnv h PRO 723 N -0.79 1.21 -0.45 4.80 0.11 -1.91 -0.08 132.00 134.89 1wnv h PRO 723 Ca -0.01 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 66.00 1wnv h PRO 723 Cb 0.78 -0.27 -0.02 0.00 0.11 0.00 0.00 31.00 31.59 1wnv h PRO 723 CO -0.26 0.80 0.17 0.00 -0.21 0.00 0.00 178.00 178.50 1wnv h ALA 724 N 1.42 0.58 -0.32 -0.75 0.00 -1.82 -2.43 119.26 115.95 1wnv h ALA 724 Ca 0.38 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 55.16 1wnv h ALA 724 Cb -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1wnv h ALA 724 CO -0.11 0.21 0.12 1.25 0.00 0.00 0.00 179.25 180.72 1wnv h LEU 725 N 0.58 0.14 -1.03 0.00 7.12 -0.51 -2.52 115.31 119.09 1wnv h LEU 725 Ca 0.15 0.03 0.07 0.00 0.13 0.00 0.00 57.88 58.26 1wnv h LEU 725 Cb 0.22 0.01 -0.07 0.00 -0.53 0.00 0.00 40.66 40.29 1wnv h LEU 725 CO -0.01 0.11 0.64 0.58 -0.13 0.00 0.00 178.44 179.64 1wnv h VAL 726 N 0.26 1.08 -0.44 1.05 2.07 -0.80 0.13 116.25 119.61 1wnv h VAL 726 Ca 0.14 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.30 1wnv h VAL 726 Cb 0.11 -0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 29.67 1wnv h VAL 726 CO -0.14 0.21 0.23 0.00 0.02 0.00 0.00 177.57 177.89 1wnv h ALA 727 N 1.46 0.55 -0.14 1.67 0.00 -1.04 -0.08 119.26 121.70 1wnv h ALA 727 Ca 0.43 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.26 1wnv h ALA 727 Cb 0.17 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1wnv h ALA 727 CO -0.17 -0.11 -0.32 0.45 0.00 0.00 0.00 179.25 179.10 1wnv h HIS 728 N 0.46 0.31 -0.37 0.00 3.86 -0.91 -2.10 115.15 116.40 1wnv h HIS 728 Ca 0.19 -0.07 -0.04 0.00 -1.16 0.00 0.00 60.37 59.29 1wnv h HIS 728 Cb 0.08 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.46 1wnv h HIS 728 CO -0.09 0.57 0.07 1.25 0.86 0.00 0.00 177.93 180.58 1wnv h HIS 729 N 0.24 0.65 0.16 2.45 6.17 -0.19 -1.45 115.15 123.18 1wnv h HIS 729 Ca 0.03 -0.09 -0.01 0.00 0.71 0.00 0.00 60.37 61.02 1wnv h HIS 729 Cb 0.69 -0.18 0.00 0.00 2.52 0.00 0.00 27.41 30.44 1wnv h HIS 729 CO 0.01 0.65 -0.07 -0.92 0.71 0.00 0.00 177.93 178.31 1wnv h TYR 730 N 0.46 -0.19 -0.44 5.26 3.20 -0.90 0.04 116.97 124.39 1wnv h TYR 730 Ca 0.11 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.94 1wnv h TYR 730 Cb 0.35 0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 1wnv h TYR 730 CO 0.02 -0.08 0.13 0.28 -1.64 0.00 0.00 178.16 176.88 1wnv h VAL 731 N -0.26 1.22 0.02 1.81 2.07 -1.31 -1.98 116.25 117.83 1wnv h VAL 731 Ca -0.02 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1wnv h VAL 731 Cb 0.20 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 1wnv h VAL 731 CO 0.03 0.27 -0.01 0.03 0.02 0.00 0.00 177.57 177.91 1wnv h ARG 732 N 0.58 -0.03 0.20 1.57 2.47 -1.22 -3.28 114.38 114.67 1wnv h ARG 732 Ca 0.14 0.00 -0.32 0.00 -1.26 0.00 0.00 59.98 58.54 1wnv h ARG 732 Cb 0.28 0.01 0.04 0.00 -1.65 0.00 0.00 29.97 28.64 1wnv h ARG 732 CO -0.00 0.63 -1.38 1.88 0.56 0.00 0.00 179.97 181.65 1wnv h TYR 733 N -0.97 1.00 -0.44 3.04 0.05 -1.05 -1.24 116.97 117.36 1wnv h TYR 733 Ca -0.00 -0.69 -0.11 0.00 0.05 0.00 0.00 58.73 57.98 1wnv h TYR 733 Cb 0.66 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 38.33 1wnv h TYR 733 CO 0.18 1.53 -0.16 1.25 -1.05 0.00 0.00 178.16 179.91 1wnv h LEU 734 N 0.19 0.84 -0.21 3.88 5.85 -1.44 0.73 115.31 125.15 1wnv h LEU 734 Ca -0.23 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.26 1wnv h LEU 734 Cb 2.06 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 42.82 1wnv h LEU 734 CO 0.26 0.99 -0.09 1.23 -0.34 0.00 0.00 178.44 180.49 1wnv h GLY 735 N 0.96 0.09 1.84 3.75 0.00 -1.61 -2.05 103.07 106.06 1wnv h GLY 735 Ca 0.11 0.12 -0.08 0.00 0.00 0.00 0.00 47.33 47.48 1wnv h GLY 735 CO 0.05 -0.12 -0.32 0.00 0.00 0.00 0.00 176.54 176.15 1wnv h ALA 736 N 1.12 1.28 0.00 3.60 0.00 -0.60 -1.94 119.26 122.71 1wnv h ALA 736 Ca 0.11 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.65 1wnv h ALA 736 Cb 0.23 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 1wnv h ALA 736 CO -0.25 0.50 -0.16 -0.07 0.00 0.00 0.00 179.25 179.26 1wnv h LEU 737 N 0.17 0.00 0.02 0.00 3.38 -0.70 -3.16 115.31 115.02 1wnv h LEU 737 Ca 0.02 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 1wnv h LEU 737 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.38 1wnv h LEU 737 CO 0.05 0.16 -1.05 0.28 0.09 0.00 0.00 178.44 177.97 1wnv h SER 738 N 0.00 0.07 -0.15 -0.43 0.02 -0.62 -3.42 113.55 109.02 1wnv h SER 738 Ca -0.00 -0.68 0.00 0.00 -0.84 0.00 0.00 61.79 60.27 1wnv h SER 738 Cb 0.79 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 63.31 1wnv h SER 738 CO 0.02 1.42 0.00 0.61 -1.14 0.00 0.00 176.83 177.74 1wnv n GLY 739 N 1.54 3.25 0.23 -3.77 0.00 -1.03 -4.78 105.19 100.62 1wnv n GLY 739 Ca -0.26 -0.38 -0.05 0.00 0.00 0.00 0.00 46.02 45.33 1wnv n GLY 739 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1wnv h GLY 740 N 0.91 0.54 1.92 -0.02 0.00 -1.77 -2.33 103.07 102.33 1wnv h GLY 740 Ca 0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 47.33 46.80 1wnv h GLY 740 CO 0.02 0.43 -0.22 -1.61 0.00 0.00 0.00 176.54 175.17 1wnv h GLN 741 N 0.43 0.10 -0.06 4.80 5.75 -1.87 -1.31 115.11 122.95 1wnv h GLN 741 Ca 0.05 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1wnv h GLN 741 Cb 0.76 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.30 1wnv h GLN 741 CO 0.06 0.32 0.03 0.28 -2.65 0.00 0.00 178.83 176.88 1wnv h VAL 742 N 0.09 1.09 -0.43 2.39 2.07 -1.77 -1.20 116.25 118.49 1wnv h VAL 742 Ca 0.02 -0.25 -0.05 0.00 0.82 0.00 0.00 66.70 67.23 1wnv h VAL 742 Cb 0.45 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.35 1wnv h VAL 742 CO 0.03 0.07 0.07 0.40 0.02 0.00 0.00 177.57 178.17 1wnv h ILE 743 N -0.00 1.24 -0.54 4.57 2.04 -1.42 -1.01 117.51 122.40 1wnv h ILE 743 Ca 0.02 -0.88 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 1wnv h ILE 743 Cb 0.09 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1wnv h ILE 743 CO -0.00 0.31 0.24 0.00 0.00 0.00 0.00 178.15 178.69 1wnv h ALA 744 N 0.94 0.70 -0.44 1.87 0.00 -1.20 -1.25 119.26 119.87 1wnv h ALA 744 Ca 0.13 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 1wnv h ALA 744 Cb 0.37 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1wnv h ALA 744 CO 0.01 0.29 -0.10 -0.09 0.00 0.00 0.00 179.25 179.35 1wnv h ARG 745 N 0.73 0.85 -0.13 0.00 2.43 -0.82 -2.34 114.38 115.10 1wnv h ARG 745 Ca 0.18 -0.32 -0.03 0.00 -0.81 0.00 0.00 59.98 59.00 1wnv h ARG 745 Cb 0.16 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1wnv h ARG 745 CO -0.02 0.95 -0.04 0.52 -1.51 0.00 0.00 179.97 179.87 1wnv h MET 746 N 0.68 0.19 -0.30 0.20 2.86 -0.78 0.13 114.93 117.91 1wnv h MET 746 Ca 0.11 -0.03 -0.15 0.00 -2.06 0.00 0.00 59.70 57.58 1wnv h MET 746 Cb 0.64 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.26 1wnv h MET 746 CO 0.04 0.25 -0.42 0.52 1.06 0.00 0.00 176.91 178.36 1wnv h MET 747 N 0.19 0.73 0.00 1.72 2.86 -0.86 0.28 114.93 119.85 1wnv h MET 747 Ca 0.04 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 1wnv h MET 747 Cb 0.20 0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.88 1wnv h MET 747 CO 0.01 1.01 -0.00 1.96 1.06 0.00 0.00 176.91 180.95 1wnv h GLN 748 N 0.60 -0.00 0.48 1.72 4.20 -1.12 -2.14 115.11 118.84 1wnv h GLN 748 Ca 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1wnv h GLN 748 Cb 0.97 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 1wnv h GLN 748 CO 0.09 0.39 -0.35 -0.09 -0.67 0.00 0.00 178.83 178.20 1wnv h ARG 749 N -0.39 -0.78 0.09 1.46 2.43 -0.66 -1.44 114.38 115.09 1wnv h ARG 749 Ca -0.00 0.05 -0.28 0.00 -0.81 0.00 0.00 59.98 58.94 1wnv h ARG 749 Cb 0.39 0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1wnv h ARG 749 CO 0.00 -0.52 -1.40 0.45 -1.51 0.00 0.00 179.97 176.99 1wnv h HIS 750 N -0.81 0.36 0.00 2.20 3.86 -1.05 -3.39 115.15 116.32 1wnv h HIS 750 Ca -0.05 -0.27 0.00 0.00 -1.16 0.00 0.00 60.37 58.89 1wnv h HIS 750 Cb 0.68 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.14 1wnv h HIS 750 CO -0.14 1.28 0.00 0.66 0.86 0.00 0.00 177.93 180.59 1wnv n TYR 751 N -3.43 0.00 -2.22 2.45 0.53 -0.83 -5.01 117.16 108.65 1wnv n TYR 751 Ca -0.12 0.00 -0.19 0.00 -1.02 0.00 0.00 57.90 56.57 1wnv n TYR 751 Cb 1.03 0.00 -0.02 0.00 -1.03 0.00 0.00 39.34 39.31 1wnv n TYR 751 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1wnv n GLY 752 N 0.21 -0.02 3.76 2.72 0.00 -0.54 -4.85 105.19 106.47 1wnv n GLY 752 Ca 0.00 -0.09 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1wnv n GLY 752 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wnv s VAL 753 N -2.90 2.16 0.30 1.61 1.01 -1.03 -4.94 120.40 116.60 1wnv s VAL 753 Ca 0.00 0.14 -0.28 0.00 0.00 0.00 0.00 61.98 61.84 1wnv s VAL 753 Cb 0.00 -3.09 -0.09 0.00 0.00 0.00 0.00 36.38 33.20 1wnv s VAL 753 CO 0.00 0.03 1.08 -0.62 0.00 0.00 0.00 175.10 175.58 1wnv s ASP 754 N 0.26 7.19 0.51 3.32 -1.08 -1.26 -4.29 116.67 121.32 1wnv s ASP 754 Ca 0.59 2.20 0.23 0.00 -0.52 0.00 0.00 52.55 55.05 1wnv s ASP 754 Cb -0.46 -2.62 1.33 0.00 -1.46 0.00 0.00 42.92 39.70 1wnv s ASP 754 CO 0.52 -0.19 2.01 -0.65 0.52 0.00 0.00 175.17 177.38 1wnv h PRO 755 N 3.58 0.06 0.00 4.34 0.11 -1.97 -0.71 132.00 137.42 1wnv h PRO 755 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1wnv h PRO 755 Cb 1.21 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1wnv h PRO 755 CO 0.66 0.04 0.00 0.39 -0.21 0.00 0.00 178.00 178.88 1wnv n GLU 756 N -4.41 0.18 -0.19 1.05 1.02 -1.26 -1.38 120.64 115.65 1wnv n GLU 756 Ca 0.09 0.50 0.11 0.00 -0.02 0.00 0.00 57.16 57.84 1wnv n GLU 756 Cb 0.52 -1.91 0.25 0.00 -0.02 0.00 0.00 31.44 30.29 1wnv n GLU 756 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wnv n ALA 757 N -1.78 2.44 -1.40 0.62 0.00 -0.27 -4.36 120.51 115.75 1wnv n ALA 757 Ca 0.01 -0.91 0.02 0.00 0.00 0.00 0.00 53.44 52.56 1wnv n ALA 757 Cb 0.16 -0.93 0.20 0.00 0.00 0.00 0.00 19.45 18.89 1wnv n ALA 757 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1wnv n LEU 758 N 1.24 3.44 0.03 0.00 4.77 -0.48 -4.79 117.00 121.21 1wnv n LEU 758 Ca 0.19 -3.65 0.19 0.00 -0.03 0.00 0.00 56.01 52.71 1wnv n LEU 758 Cb 0.54 -0.57 0.68 0.00 -2.33 0.00 0.00 43.42 41.75 1wnv n LEU 758 CO 0.15 1.17 1.17 1.23 -1.33 0.00 0.00 177.39 179.79 1wnv h GLY 759 N 0.96 0.01 0.20 -0.72 0.00 -1.76 -2.42 103.07 99.34 1wnv h GLY 759 Ca 0.10 -0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.60 1wnv h GLY 759 CO 0.20 0.00 0.59 -2.75 0.00 0.00 0.00 176.54 174.59 1wnv h PHE 760 N 0.00 1.05 -0.00 5.60 3.57 -1.86 -1.96 116.94 123.34 1wnv h PHE 760 Ca 0.23 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.76 1wnv h PHE 760 Cb 0.91 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 39.33 1wnv h PHE 760 CO -0.00 0.27 -0.01 0.66 -2.23 0.00 0.00 178.31 177.00 1wnv n TYR 761 N -4.75 0.00 -4.94 0.41 4.02 -0.91 -4.80 117.16 106.18 1wnv n TYR 761 Ca 0.22 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.83 1wnv n TYR 761 Cb 0.51 -0.13 -0.16 0.00 -0.02 0.00 0.00 39.34 39.54 1wnv n TYR 761 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1wnv s HIS 762 N -2.28 1.96 -0.36 -0.72 3.76 -0.74 -4.44 115.29 112.47 1wnv s HIS 762 Ca 0.38 -0.65 -0.07 0.00 -0.15 0.00 0.00 55.06 54.56 1wnv s HIS 762 Cb 0.21 -1.32 0.05 0.00 1.11 0.00 0.00 32.58 32.62 1wnv s HIS 762 CO 0.42 -0.24 0.15 -0.06 -0.85 0.00 0.00 174.74 174.15 1wnv s PHE 763 N 0.17 3.28 0.18 1.40 0.40 -1.26 -4.96 117.98 117.18 1wnv s PHE 763 Ca -0.09 -1.39 -0.30 0.00 -0.60 0.00 0.00 56.93 54.55 1wnv s PHE 763 Cb -0.14 -2.43 -0.08 0.00 0.51 0.00 0.00 43.02 40.88 1wnv s PHE 763 CO 0.04 -0.74 1.12 -1.21 0.70 0.00 0.00 175.22 175.13 1wnv s GLU 764 N 1.42 4.57 0.00 0.44 2.02 -1.26 -2.37 118.70 123.52 1wnv s GLU 764 Ca -0.00 1.76 0.00 0.00 0.02 0.00 0.00 54.97 56.75 1wnv s GLU 764 Cb -0.20 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.76 1wnv s GLU 764 CO 0.03 0.03 0.00 0.41 0.02 0.00 0.00 175.26 175.75 1wnv n GLY 765 N 2.09 0.43 3.43 -1.39 0.00 -1.26 -4.91 105.19 103.59 1wnv n GLY 765 Ca 0.03 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.61 1wnv n GLY 765 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wnv s ILE 766 N -2.27 4.93 -0.28 -0.61 1.01 -1.00 -4.89 121.20 118.09 1wnv s ILE 766 Ca 0.00 -1.91 0.21 0.00 0.00 0.00 0.00 60.65 58.95 1wnv s ILE 766 Cb 0.00 -4.75 0.12 0.00 0.01 0.00 0.00 42.46 37.83 1wnv s ILE 766 CO 0.00 -1.45 1.29 0.00 0.00 0.00 0.00 174.94 174.78 1wnv h ALA 767 N 8.38 0.73 -3.06 9.38 0.00 -1.91 -3.40 119.26 129.39 1wnv h ALA 767 Ca 0.18 -0.18 -0.69 0.00 0.00 0.00 0.00 54.91 54.21 1wnv h ALA 767 Cb 1.00 0.02 -0.36 0.00 0.00 0.00 0.00 17.79 18.45 1wnv h ALA 767 CO 1.08 0.22 -0.29 0.15 0.00 0.00 0.00 179.25 180.41 1wnv s LYS 768 N -3.19 2.81 0.02 0.00 1.02 -1.26 -4.98 119.74 114.16 1wnv s LYS 768 Ca 0.03 -2.87 -0.19 0.00 0.02 0.00 0.00 55.97 52.95 1wnv s LYS 768 Cb 0.07 -3.78 -0.21 0.00 -0.52 0.00 0.00 37.83 33.39 1wnv s LYS 768 CO 0.74 -1.22 1.16 1.25 -0.92 0.00 0.00 175.35 176.36 1wnv h LEU 769 N 6.52 0.54 -1.13 3.17 5.85 -1.99 -1.12 115.31 127.13 1wnv h LEU 769 Ca 0.06 -0.70 -0.04 0.00 0.84 0.00 0.00 57.88 58.04 1wnv h LEU 769 Cb 0.89 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1wnv h LEU 769 CO 0.76 1.16 0.15 0.50 -0.34 0.00 0.00 178.44 180.67 1wnv h LYS 770 N -0.04 0.76 -0.44 1.25 3.64 -1.97 -0.41 116.57 119.37 1wnv h LYS 770 Ca -0.05 -0.14 -0.08 0.00 -1.27 0.00 0.00 60.65 59.11 1wnv h LYS 770 Cb 1.20 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.88 1wnv h LYS 770 CO 0.10 0.67 -0.04 0.28 -2.27 0.00 0.00 179.45 178.19 1wnv h VAL 771 N 0.74 1.27 -0.59 2.00 2.07 -1.91 -0.97 116.25 118.86 1wnv h VAL 771 Ca 0.17 -1.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1wnv h VAL 771 Cb 0.24 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 1wnv h VAL 771 CO -0.01 0.38 0.36 0.22 0.02 0.00 0.00 177.57 178.55 1wnv h TYR 772 N 0.63 0.77 -0.28 1.57 3.20 -0.84 -0.46 116.97 121.56 1wnv h TYR 772 Ca 0.12 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 1wnv h TYR 772 Cb 0.56 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 1wnv h TYR 772 CO 0.04 0.51 0.13 0.87 -1.64 0.00 0.00 178.16 178.08 1wnv h LYS 773 N 0.80 0.40 -0.46 1.82 1.57 -0.81 0.67 116.57 120.56 1wnv h LYS 773 Ca 0.21 -0.06 0.07 0.00 -1.87 0.00 0.00 60.65 59.00 1wnv h LYS 773 Cb -0.04 -0.07 -0.06 0.00 0.08 0.00 0.00 32.23 32.14 1wnv h LYS 773 CO -0.04 0.39 0.12 -0.44 -0.57 0.00 0.00 179.45 178.91 1wnv h ASP 774 N 0.32 0.06 0.12 0.86 3.32 -0.87 -1.75 116.42 118.49 1wnv h ASP 774 Ca 0.10 0.07 -0.11 0.00 0.02 0.00 0.00 57.03 57.11 1wnv h ASP 774 Cb 0.12 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1wnv h ASP 774 CO -0.01 0.06 -0.38 -0.33 -1.72 0.00 0.00 179.24 176.86 1wnv h GLU 775 N 0.26 0.35 -0.02 3.56 5.08 -0.83 -0.49 114.58 122.49 1wnv h GLU 775 Ca 0.22 -0.16 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1wnv h GLU 775 Cb 0.27 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.49 1wnv h GLU 775 CO -0.27 0.68 -0.10 -0.92 -1.00 0.00 0.00 179.01 177.40 1wnv h TYR 776 N 0.29 -0.25 -0.93 4.33 5.03 -0.50 0.12 116.97 125.07 1wnv h TYR 776 Ca 0.03 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.35 1wnv h TYR 776 Cb 0.81 0.11 -0.05 0.00 1.55 0.00 0.00 36.73 39.15 1wnv h TYR 776 CO 0.02 -0.15 0.58 0.00 -1.32 0.00 0.00 178.16 177.29 1wnv h ARG 777 N -0.16 1.25 -0.56 1.82 3.08 -1.11 -0.91 114.38 117.80 1wnv h ARG 777 Ca 0.04 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 1wnv h ARG 777 Cb 0.22 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1wnv h ARG 777 CO -0.11 0.86 0.09 0.93 -1.07 0.00 0.00 179.97 180.67 1wnv h GLU 778 N 1.28 0.89 -0.61 0.04 4.39 -0.78 -1.01 114.58 118.78 1wnv h GLU 778 Ca 0.34 -0.21 -0.02 0.00 0.34 0.00 0.00 59.36 59.81 1wnv h GLU 778 Cb -0.09 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.41 1wnv h GLU 778 CO -0.07 0.83 0.30 0.87 -1.16 0.00 0.00 179.01 179.78 1wnv h LYS 779 N 0.85 0.85 -0.27 2.33 1.57 -0.05 -0.55 116.57 121.30 1wnv h LYS 779 Ca 0.18 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1wnv h LYS 779 Cb 0.37 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 1wnv h LYS 779 CO 0.01 0.65 0.05 -0.07 -0.57 0.00 0.00 179.45 179.52 1wnv h LEU 780 N 0.85 0.43 -1.78 2.94 3.38 -0.66 -2.02 115.31 118.46 1wnv h LEU 780 Ca 0.21 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1wnv h LEU 780 Cb 0.08 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1wnv h LEU 780 CO -0.03 0.57 0.18 0.78 0.09 0.00 0.00 178.44 180.03 1wnv h ASN 781 N 0.27 0.26 -0.02 -0.43 2.35 -0.75 -2.87 115.58 114.39 1wnv h ASN 781 Ca 0.08 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1wnv h ASN 781 Cb 0.32 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1wnv h ASN 781 CO 0.00 0.18 -0.11 0.59 -1.65 0.00 0.00 177.43 176.45 1wnv n ASN 782 N -4.50 2.55 -4.68 5.81 3.02 -0.25 -4.75 115.26 112.46 1wnv n ASN 782 Ca 0.02 -1.80 -0.42 0.00 -0.03 0.00 0.00 54.58 52.35 1wnv n ASN 782 Cb 0.12 0.11 -0.03 0.00 -0.61 0.00 0.00 39.78 39.37 1wnv n ASN 782 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1wnv s LEU 783 N -2.12 4.37 -0.33 3.41 1.43 -0.77 -4.95 118.68 119.71 1wnv s LEU 783 Ca 0.27 2.50 -0.29 0.00 -1.03 0.00 0.00 54.13 55.58 1wnv s LEU 783 Cb 0.20 -3.55 0.02 0.00 0.03 0.00 0.00 46.19 42.88 1wnv s LEU 783 CO 0.37 -0.94 1.11 -0.70 0.23 0.00 0.00 176.35 176.42 1wnv s GLU 784 N 3.32 4.01 -0.00 1.70 2.56 -1.26 -5.01 118.70 124.02 1wnv s GLU 784 Ca 0.77 1.04 0.04 0.00 0.00 0.00 0.00 54.97 56.82 1wnv s GLU 784 Cb -0.40 -3.77 -0.01 0.00 2.00 0.00 0.00 34.13 31.95 1wnv s GLU 784 CO 0.34 -0.98 -0.13 -0.51 -0.56 0.00 0.00 175.26 173.41 1wnv s LEU 785 N 3.83 2.05 0.82 2.70 1.43 -1.26 -5.09 118.68 123.17 1wnv s LEU 785 Ca 0.47 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 53.19 1wnv s LEU 785 Cb -0.12 -0.66 0.09 0.00 0.03 0.00 0.00 46.19 45.52 1wnv s LEU 785 CO 0.18 0.14 1.09 -0.94 0.23 0.00 0.00 176.35 177.05 1wnv s SER 786 N -0.44 4.12 0.26 2.29 1.04 -1.26 -4.81 113.70 114.90 1wnv s SER 786 Ca 0.04 1.60 -0.02 0.00 0.48 0.00 0.00 55.95 58.06 1wnv s SER 786 Cb -0.05 -2.31 0.51 0.00 0.10 0.00 0.00 66.02 64.26 1wnv s SER 786 CO -0.00 -2.25 1.75 0.44 0.98 0.00 0.00 173.24 174.16 1wnv h ASP 787 N -1.28 0.43 -0.54 7.02 3.32 -2.00 -0.23 116.42 123.13 1wnv h ASP 787 Ca -0.47 0.10 -0.12 0.00 0.02 0.00 0.00 57.03 56.57 1wnv h ASP 787 Cb 1.26 0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.83 1wnv h ASP 787 CO 0.54 0.17 -0.11 -0.33 -1.72 0.00 0.00 179.24 177.79 1wnv h GLU 788 N 0.55 1.04 -0.38 3.56 3.07 -1.99 -1.54 114.58 118.88 1wnv h GLU 788 Ca 0.45 -0.38 -0.09 0.00 -0.50 0.00 0.00 59.36 58.83 1wnv h GLU 788 Cb 0.65 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 28.49 1wnv h GLU 788 CO -0.38 1.08 -0.13 1.96 -1.40 0.00 0.00 179.01 180.14 1wnv h GLN 789 N 0.92 0.76 -0.10 2.33 4.20 -1.75 -1.69 115.11 119.78 1wnv h GLN 789 Ca 0.14 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 1wnv h GLN 789 Cb 0.68 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 1wnv h GLN 789 CO 0.05 0.92 0.06 -0.09 -0.67 0.00 0.00 178.83 179.10 1wnv h ARG 790 N 0.56 0.14 -0.68 1.46 2.43 -0.89 -1.19 114.38 116.21 1wnv h ARG 790 Ca 0.09 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1wnv h ARG 790 Cb 0.66 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.15 1wnv h ARG 790 CO 0.04 0.13 0.41 1.49 -1.51 0.00 0.00 179.97 180.53 1wnv h GLU 791 N 0.11 0.91 -0.30 0.20 4.81 -1.19 -1.00 114.58 118.12 1wnv h GLU 791 Ca 0.04 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.04 1wnv h GLU 791 Cb 0.02 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.20 1wnv h GLU 791 CO -0.01 0.63 -0.42 1.25 -0.73 0.00 0.00 179.01 179.74 1wnv h HIS 792 N 0.93 0.88 -0.24 0.92 2.76 -0.88 -1.53 115.15 118.00 1wnv h HIS 792 Ca 0.24 -0.27 -0.05 0.00 -2.20 0.00 0.00 60.37 58.10 1wnv h HIS 792 Cb -0.05 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.72 1wnv h HIS 792 CO 0.00 1.02 -0.04 1.25 -1.30 0.00 0.00 177.93 178.87 1wnv h LEU 793 N 0.60 0.44 -0.63 0.26 6.46 -0.94 -0.34 115.31 121.16 1wnv h LEU 793 Ca 0.05 -0.35 -0.10 0.00 -0.12 0.00 0.00 57.88 57.36 1wnv h LEU 793 Cb 0.97 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.75 1wnv h LEU 793 CO 0.09 0.69 -0.00 -0.07 -0.62 0.00 0.00 178.44 178.53 1wnv h LEU 794 N 0.19 1.05 -0.53 2.25 3.38 -1.07 -0.68 115.31 119.89 1wnv h LEU 794 Ca 0.06 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1wnv h LEU 794 Cb 0.49 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1wnv h LEU 794 CO 0.02 1.10 0.28 0.11 0.09 0.00 0.00 178.44 180.03 1wnv h LYS 795 N 0.97 0.75 -0.06 1.13 1.57 -1.17 -2.67 116.57 117.10 1wnv h LYS 795 Ca 0.17 -0.09 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 1wnv h LYS 795 Cb 0.56 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.72 1wnv h LYS 795 CO 0.03 0.59 -0.23 1.49 -0.57 0.00 0.00 179.45 180.76 1wnv h GLU 796 N 0.71 0.09 -0.35 3.15 4.57 -0.27 -1.65 114.58 120.84 1wnv h GLU 796 Ca 0.18 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.26 1wnv h GLU 796 Cb 0.07 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 1wnv h GLU 796 CO -0.03 0.33 -0.11 0.00 -1.18 0.00 0.00 179.01 178.02 1wnv h ALA 797 N 1.68 1.16 -0.24 2.92 0.00 -0.82 0.30 119.26 124.26 1wnv h ALA 797 Ca 0.01 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.58 1wnv h ALA 797 Cb 0.47 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1wnv h ALA 797 CO 0.03 0.53 -0.08 1.15 0.00 0.00 0.00 179.25 180.89 1wnv h THR 798 N 0.55 1.29 -0.56 0.00 2.02 -1.22 -2.17 112.91 112.82 1wnv h THR 798 Ca 0.10 -1.11 -0.02 0.00 0.77 0.00 0.00 66.41 66.14 1wnv h THR 798 Cb 0.52 1.51 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 1wnv h THR 798 CO 0.03 0.35 0.25 0.44 0.37 0.00 0.00 175.52 176.95 1wnv h ASP 799 N 0.22 0.72 -0.74 4.18 3.32 -0.74 -2.26 116.42 121.12 1wnv h ASP 799 Ca 0.06 -0.08 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 1wnv h ASP 799 Cb 0.56 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 1wnv h ASP 799 CO 0.03 0.63 0.28 0.00 -1.72 0.00 0.00 179.24 178.46 1wnv h ALA 800 N 1.48 0.97 -0.08 3.45 0.00 -0.09 -0.40 119.26 124.59 1wnv h ALA 800 Ca 0.19 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1wnv h ALA 800 Cb 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1wnv h ALA 800 CO -0.02 0.61 -0.32 0.74 0.00 0.00 0.00 179.25 180.26 1wnv h PHE 801 N 1.08 0.18 -0.46 0.00 -1.00 -1.11 -1.70 116.94 113.92 1wnv h PHE 801 Ca 0.25 -0.04 -0.07 0.00 2.81 0.00 0.00 57.97 60.92 1wnv h PHE 801 Cb 0.23 -0.04 -0.02 0.00 3.61 0.00 0.00 35.95 39.73 1wnv h PHE 801 CO 0.02 0.46 0.01 0.28 -1.61 0.00 0.00 178.31 177.47 1wnv h VAL 802 N 0.14 1.26 -0.65 -0.55 2.07 -0.76 -0.01 116.25 117.75 1wnv h VAL 802 Ca 0.02 -1.04 -0.00 0.00 0.82 0.00 0.00 66.70 66.50 1wnv h VAL 802 Cb 0.64 1.02 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 1wnv h VAL 802 CO 0.05 0.36 0.40 -0.26 0.02 0.00 0.00 177.57 178.14 1wnv h PHE 803 N 0.66 0.85 -0.60 1.57 -1.00 -0.91 -2.21 116.94 115.29 1wnv h PHE 803 Ca 0.13 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.90 1wnv h PHE 803 Cb 0.49 -0.28 -0.03 0.00 3.61 0.00 0.00 35.95 39.74 1wnv h PHE 803 CO 0.04 0.56 0.31 -0.97 -1.61 0.00 0.00 178.31 176.64 1wnv h ASN 804 N 0.88 0.77 -0.68 2.17 -0.73 -0.88 -1.67 115.58 115.45 1wnv h ASN 804 Ca 0.23 -0.12 0.08 0.00 1.87 0.00 0.00 56.30 58.37 1wnv h ASN 804 Cb -0.04 -0.20 -0.06 0.00 0.27 0.00 0.00 38.32 38.28 1wnv h ASN 804 CO -0.05 0.67 0.35 -0.74 -0.37 0.00 0.00 177.43 177.29 1wnv h HIS 805 N 0.82 0.63 -0.32 0.67 2.76 -0.53 -2.04 115.15 117.14 1wnv h HIS 805 Ca 0.21 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.29 1wnv h HIS 805 Cb 0.09 -0.18 -0.01 0.00 1.55 0.00 0.00 27.41 28.85 1wnv h HIS 805 CO -0.00 0.26 -0.27 1.96 -1.30 0.00 0.00 177.93 178.58 1wnv h GLN 806 N 0.62 0.65 -0.38 5.26 1.08 -0.98 0.24 115.11 121.58 1wnv h GLN 806 Ca 0.32 -0.27 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 1wnv h GLN 806 Cb 0.29 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 1wnv h GLN 806 CO -0.23 0.85 0.24 0.28 -0.95 0.00 0.00 178.83 179.02 1wnv h VAL 807 N 0.56 1.11 -0.20 -0.54 2.07 -0.90 -0.74 116.25 117.61 1wnv h VAL 807 Ca 0.07 -0.24 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 1wnv h VAL 807 Cb 0.75 0.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1wnv h VAL 807 CO 0.06 0.11 -0.33 -0.26 0.02 0.00 0.00 177.57 177.18 1wnv h PHE 808 N 0.51 0.46 -0.66 1.57 0.04 -1.22 -1.44 116.94 116.20 1wnv h PHE 808 Ca 0.14 -0.11 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 1wnv h PHE 808 Cb -0.03 -0.11 -0.03 0.00 2.20 0.00 0.00 35.95 37.99 1wnv h PHE 808 CO -0.04 0.68 0.34 0.00 -0.60 0.00 0.00 178.31 178.69 1wnv h ALA 809 N 1.31 0.84 -0.54 2.45 0.00 -0.70 -0.88 119.26 121.75 1wnv h ALA 809 Ca 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1wnv h ALA 809 Cb 0.74 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1wnv h ALA 809 CO 0.06 0.39 0.26 -0.44 0.00 0.00 0.00 179.25 179.51 1wnv h ASP 810 N 0.90 0.70 -0.52 0.00 5.19 -0.78 -2.30 116.42 119.61 1wnv h ASP 810 Ca 0.23 -0.13 -0.03 0.00 -0.62 0.00 0.00 57.03 56.48 1wnv h ASP 810 Cb 0.08 -0.18 -0.03 0.00 0.18 0.00 0.00 39.33 39.39 1wnv h ASP 810 CO -0.03 0.63 0.22 -0.07 -3.12 0.00 0.00 179.24 176.87 1wnv h LEU 811 N 0.72 0.75 -0.47 1.55 3.38 -0.99 -2.85 115.31 117.40 1wnv h LEU 811 Ca 0.18 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1wnv h LEU 811 Cb 0.12 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1wnv h LEU 811 CO -0.02 0.68 -0.09 0.61 0.09 0.00 0.00 178.44 179.70 1wnv n GLY 812 N -1.05 -0.61 0.00 0.83 0.00 -0.36 -5.06 105.19 98.95 1wnv n GLY 812 Ca 0.05 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1wnv n GLY 812 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60