#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d8f s ARG 584 N 0.00 0.79 0.41 3.97 3.00 -1.26 -4.86 118.95 121.01 1d8f s ARG 584 Ca 0.00 -0.44 0.03 0.00 0.00 0.00 0.00 55.73 55.32 1d8f s ARG 584 Cb 0.00 0.35 -0.04 0.00 0.00 0.00 0.00 34.95 35.26 1d8f s ARG 584 CO 0.00 -0.25 0.06 0.95 0.00 0.00 0.00 175.30 176.06 1d8f s THR 585 N -2.34 1.08 0.65 0.02 -4.23 -1.26 -0.88 115.64 108.66 1d8f s THR 585 Ca -0.06 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.34 1d8f s THR 585 Cb -0.02 -2.50 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 1d8f s THR 585 CO -0.02 0.00 1.03 -0.36 -0.54 0.00 0.00 174.62 174.73 1d8f s PHE 586 N -3.08 3.47 0.07 3.99 0.40 -1.24 -4.64 117.98 116.95 1d8f s PHE 586 Ca 0.24 1.11 -0.35 0.00 -0.60 0.00 0.00 56.93 57.33 1d8f s PHE 586 Cb 0.05 -2.84 -0.14 0.00 0.51 0.00 0.00 43.02 40.59 1d8f s PHE 586 CO 0.12 -0.88 1.60 -2.30 0.70 0.00 0.00 175.22 174.46 1d8f n PRO 587 N -2.82 1.91 -0.68 0.24 -0.02 -1.26 -0.94 135.00 131.43 1d8f n PRO 587 Ca 0.06 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1d8f n PRO 587 Cb 0.56 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 1d8f n PRO 587 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d8f n GLY 588 N 3.49 1.02 3.67 -1.23 0.00 -1.26 -4.33 105.19 106.54 1d8f n GLY 588 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.95 1d8f n GLY 588 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1d8f n ILE 589 N -2.00 -5.52 -2.57 -0.61 5.41 -0.12 -4.92 119.36 109.03 1d8f n ILE 589 Ca 0.00 -0.83 -0.42 0.00 1.00 0.00 0.00 62.75 62.50 1d8f n ILE 589 Cb 0.00 -4.23 -0.03 0.00 -0.71 0.00 0.00 39.64 34.67 1d8f n ILE 589 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1d8f s PRO 590 N -5.87 4.49 0.18 0.38 0.04 -1.26 -5.02 135.00 127.95 1d8f s PRO 590 Ca 0.29 1.59 0.00 0.00 0.04 0.00 0.00 61.00 62.92 1d8f s PRO 590 Cb -0.09 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1d8f s PRO 590 CO 0.84 -0.17 0.06 -1.59 0.04 0.00 0.00 177.00 176.18 1d8f s LYS 591 N 1.12 1.13 0.44 4.56 -2.85 -1.26 -4.47 119.74 118.41 1d8f s LYS 591 Ca 0.55 -1.57 -0.22 0.00 -1.00 0.00 0.00 55.97 53.73 1d8f s LYS 591 Cb -0.25 -0.02 -0.09 0.00 -2.06 0.00 0.00 37.83 35.41 1d8f s LYS 591 CO 0.28 -0.25 1.04 -1.58 0.10 0.00 0.00 175.35 174.94 1d8f s TRP 592 N -3.88 3.14 -0.01 1.78 0.52 -1.26 -4.90 118.94 114.34 1d8f s TRP 592 Ca 0.29 1.61 -0.02 0.00 0.02 0.00 0.00 56.10 58.01 1d8f s TRP 592 Cb 0.07 -3.09 -0.27 0.00 -1.15 0.00 0.00 33.47 29.03 1d8f s TRP 592 CO 0.07 -0.70 0.81 -0.09 0.02 0.00 0.00 176.95 177.06 1d8f h ARG 593 N 2.05 0.22 -6.41 4.98 2.43 -2.01 -3.46 114.38 112.18 1d8f h ARG 593 Ca -0.49 -0.38 -0.54 0.00 -0.81 0.00 0.00 59.98 57.76 1d8f h ARG 593 Cb 1.22 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.87 1d8f h ARG 593 CO 0.61 1.06 -0.02 -1.59 -1.51 0.00 0.00 179.97 178.52 1d8f s LYS 594 N -2.61 4.07 0.03 0.20 -2.85 -1.26 -4.99 119.74 112.32 1d8f s LYS 594 Ca -0.09 0.62 0.24 0.00 -1.00 0.00 0.00 55.97 55.74 1d8f s LYS 594 Cb 0.07 -2.91 0.34 0.00 -2.06 0.00 0.00 37.83 33.28 1d8f s LYS 594 CO 0.84 0.45 1.29 2.41 0.10 0.00 0.00 175.35 180.44 1d8f n THR 595 N 0.76 0.09 -3.99 3.79 -1.04 -1.26 -4.75 114.28 107.87 1d8f n THR 595 Ca -0.04 -0.09 -0.34 0.00 -2.04 0.00 0.00 64.05 61.55 1d8f n THR 595 Cb 0.52 0.24 -0.14 0.00 -1.82 0.00 0.00 70.33 69.12 1d8f n THR 595 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1d8f s HIS 596 N -3.06 3.17 0.33 -1.42 5.65 -1.26 -1.70 115.29 117.00 1d8f s HIS 596 Ca 0.09 -1.90 0.07 0.00 0.25 0.00 0.00 55.06 53.57 1d8f s HIS 596 Cb 0.16 -2.02 -0.03 0.00 -1.18 0.00 0.00 32.58 29.51 1d8f s HIS 596 CO 0.73 -0.81 0.31 -0.51 -0.65 0.00 0.00 174.74 173.81 1d8f s LEU 597 N 1.23 3.66 0.09 8.88 1.43 -0.49 -5.00 118.68 128.49 1d8f s LEU 597 Ca -0.04 -0.44 0.10 0.00 -1.03 0.00 0.00 54.13 52.71 1d8f s LEU 597 Cb -0.18 -2.29 -0.03 0.00 0.03 0.00 0.00 46.19 43.71 1d8f s LEU 597 CO -0.04 -0.34 -0.25 0.42 0.23 0.00 0.00 176.35 176.37 1d8f s THR 598 N -2.28 2.05 0.15 5.49 -4.23 -1.26 -1.19 115.64 114.37 1d8f s THR 598 Ca 0.41 -1.54 0.06 0.00 -1.18 0.00 0.00 61.69 59.43 1d8f s THR 598 Cb -0.06 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 71.94 1d8f s THR 598 CO 0.27 0.16 -0.12 -0.72 -0.54 0.00 0.00 174.62 173.66 1d8f s TYR 599 N -0.97 1.40 -0.12 3.99 -0.85 0.05 -1.48 117.35 119.37 1d8f s TYR 599 Ca 0.11 -0.65 -0.08 0.00 -0.52 0.00 0.00 57.07 55.92 1d8f s TYR 599 Cb -0.10 -0.70 0.04 0.00 0.38 0.00 0.00 41.96 41.58 1d8f s TYR 599 CO 0.04 0.16 0.30 0.50 -1.52 0.00 0.00 175.55 175.03 1d8f s ARG 600 N -3.38 0.30 -0.49 -3.49 3.52 -0.72 -1.21 118.95 113.48 1d8f s ARG 600 Ca 0.15 0.51 -0.16 0.00 -0.13 0.00 0.00 55.73 56.10 1d8f s ARG 600 Cb -0.01 0.04 0.08 0.00 -1.56 0.00 0.00 34.95 33.51 1d8f s ARG 600 CO 0.03 -0.10 0.43 0.42 -0.81 0.00 0.00 175.30 175.27 1d8f s ILE 601 N 0.71 5.21 0.11 4.11 1.01 -1.26 -0.15 121.20 130.94 1d8f s ILE 601 Ca -0.05 -1.11 -0.14 0.00 0.00 0.00 0.00 60.65 59.35 1d8f s ILE 601 Cb -0.06 -4.18 -0.06 0.00 0.01 0.00 0.00 42.46 38.18 1d8f s ILE 601 CO -0.05 -0.65 1.47 0.58 0.00 0.00 0.00 174.94 176.30 1d8f h VAL 602 N 5.79 1.29 -4.53 2.92 2.07 -1.04 -3.48 116.25 119.26 1d8f h VAL 602 Ca -0.29 -1.32 -0.31 0.00 0.82 0.00 0.00 66.70 65.60 1d8f h VAL 602 Cb 1.11 1.41 -0.13 0.00 -1.52 0.00 0.00 31.29 32.16 1d8f h VAL 602 CO 0.91 0.43 -0.45 0.54 0.02 0.00 0.00 177.57 179.03 1d8f s ASN 603 N -6.47 0.82 0.09 0.57 2.20 -1.26 -5.07 114.94 105.82 1d8f s ASN 603 Ca -0.12 -1.50 0.07 0.00 -0.94 0.00 0.00 52.86 50.36 1d8f s ASN 603 Cb 0.09 0.51 -0.03 0.00 -2.00 0.00 0.00 41.25 39.83 1d8f s ASN 603 CO 0.82 -1.03 -0.18 -0.31 -2.94 0.00 0.00 177.10 173.47 1d8f s TYR 604 N -3.69 1.51 0.17 1.54 1.51 -1.26 -4.59 117.35 112.55 1d8f s TYR 604 Ca 0.37 -0.43 -0.16 0.00 -1.01 0.00 0.00 57.07 55.83 1d8f s TYR 604 Cb 0.03 -0.84 -0.07 0.00 -0.11 0.00 0.00 41.96 40.97 1d8f s TYR 604 CO 0.19 0.13 0.61 -0.08 -1.11 0.00 0.00 175.55 175.29 1d8f s THR 605 N -1.20 4.76 0.32 -0.71 -1.32 -1.26 -4.98 115.64 111.25 1d8f s THR 605 Ca 0.02 0.97 0.22 0.00 -1.21 0.00 0.00 61.69 61.70 1d8f s THR 605 Cb -0.10 -3.77 0.22 0.00 -1.51 0.00 0.00 72.50 67.34 1d8f s THR 605 CO 0.03 0.22 1.93 -0.65 -2.21 0.00 0.00 174.62 173.94 1d8f h PRO 606 N 3.48 0.00 -0.89 7.08 0.11 -2.00 -3.26 132.00 136.51 1d8f h PRO 606 Ca -0.48 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.64 1d8f h PRO 606 Cb 1.19 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.26 1d8f h PRO 606 CO 0.66 0.23 0.59 -0.44 -0.21 0.00 0.00 178.00 178.82 1d8f h ASP 607 N 0.00 1.01 -4.47 -2.05 5.19 -1.94 -3.44 116.42 110.72 1d8f h ASP 607 Ca -0.00 -0.02 -0.41 0.00 -0.62 0.00 0.00 57.03 55.98 1d8f h ASP 607 Cb 0.56 -0.25 -0.22 0.00 0.18 0.00 0.00 39.33 39.60 1d8f h ASP 607 CO 0.03 0.72 -0.78 -0.76 -3.12 0.00 0.00 179.24 175.33 1d8f s LEU 608 N -10.14 2.26 0.51 1.55 1.43 -1.23 -4.94 118.68 108.12 1d8f s LEU 608 Ca -0.13 -0.60 -0.22 0.00 -1.03 0.00 0.00 54.13 52.16 1d8f s LEU 608 Cb 0.17 -0.51 -0.06 0.00 0.03 0.00 0.00 46.19 45.82 1d8f s LEU 608 CO 0.80 -0.07 1.19 -2.16 0.23 0.00 0.00 176.35 176.35 1d8f s PRO 609 N -1.66 3.49 0.36 1.29 0.04 -1.26 -4.69 135.00 132.56 1d8f s PRO 609 Ca -0.02 1.82 0.19 0.00 0.04 0.00 0.00 61.00 63.03 1d8f s PRO 609 Cb -0.10 -2.25 1.28 0.00 0.04 0.00 0.00 34.50 33.47 1d8f s PRO 609 CO 0.02 -0.79 1.58 0.87 0.04 0.00 0.00 177.00 178.73 1d8f h LYS 610 N 1.65 0.01 -0.00 4.56 1.57 -1.99 -0.40 116.57 121.98 1d8f h LYS 610 Ca -0.50 -0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.17 1d8f h LYS 610 Cb 1.26 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 1d8f h LYS 610 CO 0.58 0.01 -0.52 0.22 -0.57 0.00 0.00 179.45 179.17 1d8f h ASP 611 N 0.01 0.00 0.02 0.86 3.58 -2.00 -2.55 116.42 116.35 1d8f h ASP 611 Ca 0.82 -0.00 -0.12 0.00 0.42 0.00 0.00 57.03 58.15 1d8f h ASP 611 Cb 2.12 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 43.16 1d8f h ASP 611 CO -0.78 0.52 -0.37 0.00 -2.88 0.00 0.00 179.24 175.74 1d8f h ALA 612 N 1.48 0.97 -0.33 -0.78 0.00 -1.42 -1.46 119.26 117.73 1d8f h ALA 612 Ca -0.01 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.43 1d8f h ALA 612 Cb 0.92 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1d8f h ALA 612 CO 0.07 0.61 -0.06 0.28 0.00 0.00 0.00 179.25 180.15 1d8f h VAL 613 N 0.39 1.27 0.47 0.00 2.07 -1.43 -2.28 116.25 116.75 1d8f h VAL 613 Ca 0.04 -1.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.46 1d8f h VAL 613 Cb 0.83 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1d8f h VAL 613 CO 0.07 0.35 -0.35 0.44 0.02 0.00 0.00 177.57 178.11 1d8f h ASP 614 N 0.40 -0.90 -0.98 0.57 5.19 -1.20 -1.47 116.42 118.04 1d8f h ASP 614 Ca 0.09 0.06 0.12 0.00 -0.62 0.00 0.00 57.03 56.68 1d8f h ASP 614 Cb 0.54 0.28 -0.08 0.00 0.18 0.00 0.00 39.33 40.25 1d8f h ASP 614 CO 0.03 -0.52 0.62 0.28 -3.12 0.00 0.00 179.24 176.53 1d8f h SER 615 N -0.80 0.87 -0.24 6.45 0.02 -1.28 0.22 113.55 118.78 1d8f h SER 615 Ca -0.05 0.05 -0.08 0.00 -0.84 0.00 0.00 61.79 60.86 1d8f h SER 615 Cb 0.68 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.07 1d8f h SER 615 CO 0.01 0.46 -0.12 0.00 -1.14 0.00 0.00 176.83 176.05 1d8f h ALA 616 N 1.55 1.11 -0.09 3.77 0.00 -0.98 -0.75 119.26 123.87 1d8f h ALA 616 Ca 0.48 -0.30 -0.19 0.00 0.00 0.00 0.00 54.91 54.90 1d8f h ALA 616 Cb 0.53 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1d8f h ALA 616 CO -0.25 0.56 -0.74 0.28 0.00 0.00 0.00 179.25 179.10 1d8f h VAL 617 N 0.59 1.36 -0.65 0.00 2.07 0.06 -1.42 116.25 118.27 1d8f h VAL 617 Ca 0.10 -2.12 -0.04 0.00 0.82 0.00 0.00 66.70 65.47 1d8f h VAL 617 Cb 0.55 2.09 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 1d8f h VAL 617 CO 0.03 0.64 0.27 -0.33 0.02 0.00 0.00 177.57 178.20 1d8f h GLU 618 N 0.32 0.97 -0.27 1.57 5.08 -0.27 -2.36 114.58 119.62 1d8f h GLU 618 Ca -0.04 -0.17 -0.17 0.00 -1.00 0.00 0.00 59.36 57.98 1d8f h GLU 618 Cb 1.33 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.41 1d8f h GLU 618 CO 0.13 0.81 -0.50 0.87 -1.00 0.00 0.00 179.01 179.32 1d8f h LYS 619 N 0.92 0.75 -0.94 2.33 1.57 -1.08 -2.47 116.57 117.65 1d8f h LYS 619 Ca 0.22 -0.45 -0.00 0.00 -1.87 0.00 0.00 60.65 58.54 1d8f h LYS 619 Cb 0.20 0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.50 1d8f h LYS 619 CO -0.02 1.08 0.58 0.00 -0.57 0.00 0.00 179.45 180.52 1d8f h ALA 620 N 0.84 1.26 -0.35 3.86 0.00 -1.03 -2.37 119.26 121.46 1d8f h ALA 620 Ca 0.02 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.71 1d8f h ALA 620 Cb 1.08 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1d8f h ALA 620 CO 0.11 0.65 -0.29 -0.07 0.00 0.00 0.00 179.25 179.64 1d8f h LEU 621 N 1.28 0.86 -0.78 0.00 3.38 -1.45 -3.25 115.31 115.36 1d8f h LEU 621 Ca 0.34 -0.45 0.10 0.00 0.09 0.00 0.00 57.88 57.95 1d8f h LEU 621 Cb -0.08 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 40.35 1d8f h LEU 621 CO -0.07 1.13 0.42 0.50 0.09 0.00 0.00 178.44 180.51 1d8f h LYS 622 N 0.60 0.67 -0.11 1.13 3.64 -1.07 -0.59 116.57 120.84 1d8f h LYS 622 Ca 0.06 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.38 1d8f h LYS 622 Cb 0.87 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 1d8f h LYS 622 CO 0.08 0.44 -0.03 -0.39 -2.27 0.00 0.00 179.45 177.28 1d8f h VAL 623 N 0.69 1.09 0.20 2.00 -1.51 -1.47 -0.21 116.25 117.04 1d8f h VAL 623 Ca 0.38 -0.38 -0.30 0.00 -1.23 0.00 0.00 66.70 65.18 1d8f h VAL 623 Cb 0.39 1.05 0.02 0.00 -2.13 0.00 0.00 31.29 30.63 1d8f h VAL 623 CO -0.27 0.12 -1.37 -0.50 -1.23 0.00 0.00 177.57 174.33 1d8f h TRP 624 N 0.15 0.77 0.00 5.19 4.06 -1.41 -3.27 115.95 121.44 1d8f h TRP 624 Ca 0.04 -0.56 -0.00 0.00 2.06 0.00 0.00 58.89 60.42 1d8f h TRP 624 Cb 0.16 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.29 1d8f h TRP 624 CO 0.00 1.53 -0.02 1.49 -3.56 0.00 0.00 178.44 177.88 1d8f h GLU 625 N -0.04 0.00 -0.01 0.49 4.81 -0.81 -2.71 114.58 116.31 1d8f h GLU 625 Ca -0.25 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.83 1d8f h GLU 625 Cb 1.98 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 31.35 1d8f h GLU 625 CO 0.20 0.02 -0.68 1.49 -0.73 0.00 0.00 179.01 179.31 1d8f h GLU 626 N 0.00 0.07 -0.14 1.92 4.81 -1.09 -3.33 114.58 116.82 1d8f h GLU 626 Ca -0.00 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.17 1d8f h GLU 626 Cb 0.06 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.44 1d8f h GLU 626 CO 0.00 0.72 -0.02 1.33 -0.73 0.00 0.00 179.01 180.32 1d8f n VAL 627 N -3.75 2.12 -3.94 0.32 0.24 -1.03 -4.79 118.33 107.50 1d8f n VAL 627 Ca -0.02 -2.14 -0.10 0.00 -2.04 0.00 0.00 64.34 60.04 1d8f n VAL 627 Cb 0.67 -0.25 -0.02 0.00 -1.47 0.00 0.00 33.84 32.77 1d8f n VAL 627 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 1d8f s THR 628 N -2.89 0.00 -1.72 3.34 -4.23 -1.21 -4.13 115.64 104.81 1d8f s THR 628 Ca 0.38 -1.27 0.28 0.00 -1.18 0.00 0.00 61.69 59.89 1d8f s THR 628 Cb 0.32 -2.51 0.64 0.00 1.34 0.00 0.00 72.50 72.28 1d8f s THR 628 CO 0.05 0.00 1.97 -2.65 -0.54 0.00 0.00 174.62 173.46 1d8f n PRO 629 N -0.49 0.64 -1.92 3.99 -0.02 -1.25 -4.09 135.00 131.85 1d8f n PRO 629 Ca -0.03 0.02 -0.41 0.00 -2.02 0.00 0.00 63.50 61.05 1d8f n PRO 629 Cb 0.61 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.57 1d8f n PRO 629 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1d8f s LEU 630 N -2.28 4.37 0.08 2.45 1.43 -1.26 -4.88 118.68 118.59 1d8f s LEU 630 Ca 0.34 2.79 0.06 0.00 -1.03 0.00 0.00 54.13 56.29 1d8f s LEU 630 Cb 0.19 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 1d8f s LEU 630 CO 0.37 -0.78 -0.16 0.42 0.23 0.00 0.00 176.35 176.43 1d8f s THR 631 N -0.11 1.27 -0.03 5.49 -4.23 -0.69 -4.43 115.64 112.91 1d8f s THR 631 Ca 0.60 -1.40 0.03 0.00 -1.18 0.00 0.00 61.69 59.74 1d8f s THR 631 Cb -0.44 -1.23 0.00 0.00 1.34 0.00 0.00 72.50 72.17 1d8f s THR 631 CO 0.46 -0.21 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.88 1d8f s PHE 632 N -1.33 1.02 0.08 3.99 0.40 -1.26 -1.39 117.98 119.49 1d8f s PHE 632 Ca 0.01 -0.26 0.07 0.00 -0.60 0.00 0.00 56.93 56.15 1d8f s PHE 632 Cb -0.09 -0.72 -0.03 0.00 0.51 0.00 0.00 43.02 42.68 1d8f s PHE 632 CO 0.03 -0.10 -0.20 -1.54 0.70 0.00 0.00 175.22 174.11 1d8f s SER 633 N 0.17 2.37 -0.10 1.36 1.04 -0.33 -4.98 113.70 113.22 1d8f s SER 633 Ca -0.03 -0.61 -0.17 0.00 0.48 0.00 0.00 55.95 55.61 1d8f s SER 633 Cb -0.09 -0.15 -0.05 0.00 0.10 0.00 0.00 66.02 65.84 1d8f s SER 633 CO 0.01 0.07 0.44 -0.60 0.98 0.00 0.00 173.24 174.14 1d8f s ARG 634 N -1.62 4.27 -0.07 4.02 3.52 -1.26 -0.77 118.95 127.04 1d8f s ARG 634 Ca 0.06 0.40 0.01 0.00 -0.13 0.00 0.00 55.73 56.06 1d8f s ARG 634 Cb -0.09 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.87 1d8f s ARG 634 CO 0.03 0.26 -0.07 -0.51 -0.81 0.00 0.00 175.30 174.19 1d8f s LEU 635 N 0.32 3.13 0.00 -0.88 1.43 -0.35 -4.95 118.68 117.38 1d8f s LEU 635 Ca 0.24 -0.04 0.13 0.00 -1.03 0.00 0.00 54.13 53.44 1d8f s LEU 635 Cb -0.15 -1.68 -0.10 0.00 0.03 0.00 0.00 46.19 44.29 1d8f s LEU 635 CO 0.10 0.36 0.63 -1.22 0.23 0.00 0.00 176.35 176.45 1d8f n TYR 636 N 2.24 0.00 -4.31 0.29 4.02 -1.26 -4.54 117.16 113.61 1d8f n TYR 636 Ca -0.18 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.55 1d8f n TYR 636 Cb 0.53 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.75 1d8f n TYR 636 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 1d8f s GLU 637 N -2.10 1.27 0.95 -0.72 1.03 -1.26 -5.08 118.70 112.79 1d8f s GLU 637 Ca 0.07 -1.63 0.00 0.00 0.03 0.00 0.00 54.97 53.44 1d8f s GLU 637 Cb 0.10 -0.54 0.00 0.00 -0.80 0.00 0.00 34.13 32.89 1d8f s GLU 637 CO 0.49 -0.09 0.00 0.41 -1.33 0.00 0.00 175.26 174.74 1d8f n GLY 638 N -0.37 -1.83 3.73 -3.83 0.00 -1.26 -4.77 105.19 96.87 1d8f n GLY 638 Ca -0.06 -1.31 -0.36 0.00 0.00 0.00 0.00 46.02 44.29 1d8f n GLY 638 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1d8f s GLU 639 N -0.49 4.21 0.30 1.61 0.41 -1.26 -5.06 118.70 118.42 1d8f s GLU 639 Ca 0.00 0.00 0.09 0.00 -0.41 0.00 0.00 54.97 54.66 1d8f s GLU 639 Cb 0.00 -3.42 -0.04 0.00 -1.78 0.00 0.00 34.13 28.89 1d8f s GLU 639 CO 0.00 0.27 0.03 0.00 -0.49 0.00 0.00 175.26 175.08 1d8f s ALA 640 N 0.38 3.25 0.09 5.21 0.00 -1.26 -5.06 121.76 124.37 1d8f s ALA 640 Ca 0.14 -1.74 -0.35 0.00 0.00 0.00 0.00 51.96 50.01 1d8f s ALA 640 Cb -0.12 -0.70 -0.15 0.00 0.00 0.00 0.00 23.12 22.14 1d8f s ALA 640 CO 0.02 0.18 1.57 -0.44 0.00 0.00 0.00 175.76 177.10 1d8f h ASP 641 N 1.79 -1.32 -3.15 0.00 3.32 -1.74 -3.36 116.42 111.96 1d8f h ASP 641 Ca -0.44 0.11 -0.74 0.00 0.02 0.00 0.00 57.03 55.98 1d8f h ASP 641 Cb 1.25 0.45 -0.23 0.00 0.22 0.00 0.00 39.33 41.02 1d8f h ASP 641 CO 0.62 -0.61 -0.21 -0.63 -1.72 0.00 0.00 179.24 176.68 1d8f s ILE 642 N -5.89 5.16 -0.32 0.35 1.01 -0.55 -4.36 121.20 116.60 1d8f s ILE 642 Ca -0.17 -1.25 -0.19 0.00 0.00 0.00 0.00 60.65 59.03 1d8f s ILE 642 Cb 0.05 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.23 1d8f s ILE 642 CO 0.61 -0.79 0.57 -0.04 0.00 0.00 0.00 174.94 175.29 1d8f s MET 643 N 1.77 3.80 -0.21 2.79 -1.94 -1.26 -1.76 119.30 122.49 1d8f s MET 643 Ca 0.05 0.11 -0.08 0.00 -1.71 0.00 0.00 55.69 54.06 1d8f s MET 643 Cb -0.27 -3.76 -0.04 0.00 2.01 0.00 0.00 34.83 32.78 1d8f s MET 643 CO 0.05 -0.59 0.07 0.42 -0.01 0.00 0.00 175.02 174.97 1d8f s ILE 644 N 2.51 4.63 0.19 2.53 1.01 0.79 -1.29 121.20 131.58 1d8f s ILE 644 Ca 0.22 -0.08 -0.09 0.00 0.00 0.00 0.00 60.65 60.70 1d8f s ILE 644 Cb -0.15 -3.12 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 1d8f s ILE 644 CO 0.12 0.40 0.31 -0.94 0.00 0.00 0.00 174.94 174.83 1d8f s SER 645 N 0.94 0.02 -0.02 3.58 1.04 -0.58 -0.29 113.70 118.39 1d8f s SER 645 Ca 0.04 -0.95 -0.01 0.00 0.48 0.00 0.00 55.95 55.51 1d8f s SER 645 Cb -0.14 0.47 -0.04 0.00 0.10 0.00 0.00 66.02 66.41 1d8f s SER 645 CO 0.03 -0.95 0.05 -0.36 0.98 0.00 0.00 173.24 172.99 1d8f s PHE 646 N -4.00 3.23 0.12 5.02 0.40 -1.26 -0.75 117.98 120.72 1d8f s PHE 646 Ca 0.21 0.19 -0.15 0.00 -0.60 0.00 0.00 56.93 56.58 1d8f s PHE 646 Cb 0.03 -1.74 0.03 0.00 0.51 0.00 0.00 43.02 41.85 1d8f s PHE 646 CO 0.04 0.52 0.38 0.00 0.70 0.00 0.00 175.22 176.86 1d8f s ALA 647 N -1.11 -0.86 -0.02 5.36 0.00 0.66 -4.85 121.76 120.95 1d8f s ALA 647 Ca 0.20 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.10 1d8f s ALA 647 Cb -0.12 0.65 -0.00 0.00 0.00 0.00 0.00 23.12 23.65 1d8f s ALA 647 CO 0.10 -0.62 -0.09 0.14 0.00 0.00 0.00 175.76 175.30 1d8f s VAL 648 N -3.73 0.74 0.00 0.00 -7.23 -1.26 -0.94 120.40 107.98 1d8f s VAL 648 Ca 0.03 -0.37 0.00 0.00 -1.81 0.00 0.00 61.98 59.83 1d8f s VAL 648 Cb 0.02 -0.64 0.00 0.00 0.56 0.00 0.00 36.38 36.32 1d8f s VAL 648 CO -0.11 0.22 0.00 0.54 -0.31 0.00 0.00 175.10 175.44 1d8f n ARG 649 N 3.08 0.00 -2.43 4.82 1.74 -1.25 -4.19 116.66 118.43 1d8f n ARG 649 Ca -0.16 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.49 1d8f n ARG 649 Cb 0.56 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.97 1d8f n ARG 649 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1d8f s GLU 650 N 0.00 3.99 -0.27 5.56 2.56 -1.26 -1.13 118.70 128.14 1d8f s GLU 650 Ca 0.00 1.34 0.19 0.00 0.00 0.00 0.00 54.97 56.51 1d8f s GLU 650 Cb 0.00 -3.85 0.50 0.00 2.00 0.00 0.00 34.13 32.78 1d8f s GLU 650 CO 0.00 -1.02 1.12 -2.39 -0.56 0.00 0.00 175.26 172.41 1d8f n HIS 651 N 7.38 1.57 -0.74 5.30 1.44 -1.26 -4.99 115.22 123.93 1d8f n HIS 651 Ca 0.14 -2.19 0.00 0.00 -2.01 0.00 0.00 57.72 53.67 1d8f n HIS 651 Cb 0.46 -0.26 0.00 0.00 0.12 0.00 0.00 29.99 30.32 1d8f n HIS 651 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1d8f n GLY 652 N -0.60 0.59 3.31 -1.39 0.00 -1.26 -5.04 105.19 100.80 1d8f n GLY 652 Ca 0.15 -0.33 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 1d8f n GLY 652 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1d8f s ASP 653 N -2.30 1.12 0.64 1.61 1.47 -1.26 -5.04 116.67 112.90 1d8f s ASP 653 Ca 0.00 -1.38 0.39 0.00 1.18 0.00 0.00 52.55 52.74 1d8f s ASP 653 Cb 0.00 0.18 2.21 0.00 -0.34 0.00 0.00 42.92 44.96 1d8f s ASP 653 CO 0.00 -0.73 2.32 -0.26 0.68 0.00 0.00 175.17 177.18 1d8f h PHE 654 N 2.41 0.00 -3.67 2.11 -1.00 -2.02 -3.39 116.94 111.38 1d8f h PHE 654 Ca -0.38 0.00 -0.66 0.00 2.81 0.00 0.00 57.97 59.74 1d8f h PHE 654 Cb 1.25 0.00 -0.40 0.00 3.61 0.00 0.00 35.95 40.41 1d8f h PHE 654 CO 0.45 0.00 -0.71 0.71 -1.61 0.00 0.00 178.31 177.16 1d8f s TYR 655 N -4.32 3.74 0.67 -0.55 1.51 -1.26 -5.11 117.35 112.03 1d8f s TYR 655 Ca -0.05 -2.98 -0.12 0.00 -1.01 0.00 0.00 57.07 52.91 1d8f s TYR 655 Cb 0.14 -2.95 -0.00 0.00 -0.11 0.00 0.00 41.96 39.04 1d8f s TYR 655 CO 0.45 -0.94 1.06 -1.25 -1.11 0.00 0.00 175.55 173.76 1d8f s PRO 656 N 0.87 3.02 0.36 -1.71 0.04 -1.26 -4.90 135.00 131.42 1d8f s PRO 656 Ca 0.11 1.02 -0.06 0.00 0.04 0.00 0.00 61.00 62.11 1d8f s PRO 656 Cb -0.19 -2.00 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1d8f s PRO 656 CO -0.07 -1.04 0.65 -0.06 0.04 0.00 0.00 177.00 176.52 1d8f s PHE 657 N -2.89 3.49 0.00 0.56 2.99 -0.29 -4.95 117.98 116.89 1d8f s PHE 657 Ca 0.59 0.77 0.00 0.00 0.00 0.00 0.00 56.93 58.29 1d8f s PHE 657 Cb -0.15 -2.22 0.00 0.00 0.00 0.00 0.00 43.02 40.65 1d8f s PHE 657 CO 0.50 0.02 0.00 -0.40 -0.00 0.00 0.00 175.22 175.34 1d8f n ASP 658 N -1.31 0.00 -0.05 1.36 5.68 -1.26 -3.80 116.55 117.17 1d8f n ASP 658 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 1d8f n ASP 658 Cb 0.54 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 1d8f n ASP 658 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1d8f n GLY 659 N 5.00 1.77 3.75 6.12 0.00 -1.26 -4.34 105.19 116.23 1d8f n GLY 659 Ca 0.00 -1.71 -0.40 0.00 0.00 0.00 0.00 46.02 43.91 1d8f n GLY 659 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1d8f s PRO 660 N 4.21 4.71 0.00 1.61 0.04 -1.26 -4.76 135.00 139.55 1d8f s PRO 660 Ca 0.00 1.68 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1d8f s PRO 660 Cb 0.00 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.30 1d8f s PRO 660 CO 0.00 0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.74 1d8f n GLY 661 N 1.44 -1.02 7.00 0.56 0.00 -1.26 -5.04 105.19 106.87 1d8f n GLY 661 Ca -0.01 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.37 1d8f n GLY 661 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1d8f n ASN 662 N -1.28 0.00 -4.65 1.61 4.13 -1.26 -4.65 115.26 109.17 1d8f n ASN 662 Ca 0.00 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.84 1d8f n ASN 662 Cb 0.00 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.21 1d8f n ASN 662 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1d8f s VAL 663 N 0.00 3.24 -0.06 2.41 1.01 -1.26 -4.86 120.40 120.88 1d8f s VAL 663 Ca 0.00 0.29 0.13 0.00 0.00 0.00 0.00 61.98 62.40 1d8f s VAL 663 Cb 0.00 -3.21 -0.22 0.00 0.00 0.00 0.00 36.38 32.94 1d8f s VAL 663 CO 0.00 -0.06 0.62 0.18 0.00 0.00 0.00 175.10 175.85 1d8f n LEU 664 N 8.19 0.79 -3.77 3.92 4.77 -1.26 -4.74 117.00 124.91 1d8f n LEU 664 Ca 0.21 0.38 -0.00 0.00 -0.03 0.00 0.00 56.01 56.56 1d8f n LEU 664 Cb 0.43 0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 1d8f n LEU 664 CO 0.66 0.38 0.95 0.00 -1.33 0.00 0.00 177.39 178.05 1d8f s ALA 665 N -2.62 -2.04 -0.28 -1.18 0.00 -1.26 -1.18 121.76 113.19 1d8f s ALA 665 Ca -0.05 0.26 -0.19 0.00 0.00 0.00 0.00 51.96 51.98 1d8f s ALA 665 Cb 0.08 0.59 0.10 0.00 0.00 0.00 0.00 23.12 23.89 1d8f s ALA 665 CO 0.82 -1.07 0.82 -3.38 0.00 0.00 0.00 175.76 172.95 1d8f s HIS 666 N -2.48 -0.79 0.36 0.00 -3.43 -0.37 -4.99 115.29 103.59 1d8f s HIS 666 Ca 0.18 1.69 0.08 0.00 -0.80 0.00 0.00 55.06 56.22 1d8f s HIS 666 Cb 0.01 0.45 -0.06 0.00 -1.43 0.00 0.00 32.58 31.55 1d8f s HIS 666 CO -0.00 -0.39 0.04 0.00 -2.00 0.00 0.00 174.74 172.39 1d8f s ALA 667 N 1.09 3.27 0.07 -1.38 0.00 -1.26 -0.98 121.76 122.56 1d8f s ALA 667 Ca -0.06 -2.04 0.06 0.00 0.00 0.00 0.00 51.96 49.93 1d8f s ALA 667 Cb -0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 1d8f s ALA 667 CO -0.12 -0.00 -0.12 0.71 0.00 0.00 0.00 175.76 176.22 1d8f s TYR 668 N -2.56 2.70 0.85 0.00 1.51 -0.20 -4.82 117.35 114.82 1d8f s TYR 668 Ca 0.36 -0.17 -0.13 0.00 -1.01 0.00 0.00 57.07 56.12 1d8f s TYR 668 Cb 0.02 -1.47 0.08 0.00 -0.11 0.00 0.00 41.96 40.48 1d8f s TYR 668 CO 0.20 0.36 1.00 0.00 -1.11 0.00 0.00 175.55 176.00 1d8f n ALA 669 N 1.14 -0.78 -1.41 3.71 0.00 -1.26 -0.13 120.51 121.78 1d8f n ALA 669 Ca -0.15 -0.42 -0.38 0.00 0.00 0.00 0.00 53.44 52.48 1d8f n ALA 669 Cb 0.52 -2.13 0.03 0.00 0.00 0.00 0.00 19.45 17.88 1d8f n ALA 669 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1d8f n PRO 670 N -3.03 0.38 -0.13 0.00 -0.02 -1.24 -1.44 135.00 129.52 1d8f n PRO 670 Ca 0.12 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1d8f n PRO 670 Cb 0.51 -1.52 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 1d8f n PRO 670 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d8f n GLY 671 N 1.96 0.91 3.90 -1.23 0.00 -1.26 -4.72 105.19 104.75 1d8f n GLY 671 Ca 0.11 -1.90 -0.29 0.00 0.00 0.00 0.00 46.02 43.94 1d8f n GLY 671 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1d8f s PRO 672 N -1.70 2.17 7.92 1.61 0.04 -1.26 -4.39 135.00 139.39 1d8f s PRO 672 Ca 0.00 0.17 0.00 0.00 0.04 0.00 0.00 61.00 61.21 1d8f s PRO 672 Cb 0.00 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.56 1d8f s PRO 672 CO 0.00 -1.46 0.00 0.41 0.04 0.00 0.00 177.00 175.99 1d8f n GLY 673 N -3.23 3.72 0.14 0.56 0.00 -1.26 -1.30 105.19 103.81 1d8f n GLY 673 Ca 0.08 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1d8f n GLY 673 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1d8f n ILE 674 N 0.00 0.82 -2.15 -0.61 3.06 -1.26 -4.73 119.36 114.50 1d8f n ILE 674 Ca 0.00 0.24 -0.41 0.00 -2.50 0.00 0.00 62.75 60.08 1d8f n ILE 674 Cb 0.00 -1.19 -0.02 0.00 0.54 0.00 0.00 39.64 38.97 1d8f n ILE 674 CO 0.00 0.00 0.00 0.20 -2.50 0.00 0.00 176.55 174.25 1d8f s ASN 675 N -4.32 6.82 0.00 9.51 -0.87 -0.42 -2.26 114.94 123.39 1d8f s ASN 675 Ca 0.04 2.64 0.00 0.00 -1.57 0.00 0.00 52.86 53.96 1d8f s ASN 675 Cb 0.09 -2.64 0.00 0.00 -0.02 0.00 0.00 41.25 38.68 1d8f s ASN 675 CO 0.40 -0.51 0.00 0.61 -2.57 0.00 0.00 177.10 175.03 1d8f n GLY 676 N 0.99 2.34 3.80 0.66 0.00 0.81 -4.43 105.19 109.37 1d8f n GLY 676 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1d8f n GLY 676 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1d8f s ASP 677 N -2.81 6.48 -0.08 1.61 1.11 -0.96 -4.33 116.67 117.68 1d8f s ASP 677 Ca 0.00 1.92 0.04 0.00 0.18 0.00 0.00 52.55 54.69 1d8f s ASP 677 Cb 0.00 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.43 1d8f s ASP 677 CO 0.00 -0.69 -0.20 0.00 1.18 0.00 0.00 175.17 175.47 1d8f s ALA 678 N -1.95 1.83 -0.10 5.23 0.00 -0.41 -1.04 121.76 125.32 1d8f s ALA 678 Ca 0.65 -0.77 0.03 0.00 0.00 0.00 0.00 51.96 51.87 1d8f s ALA 678 Cb -0.16 -0.71 0.01 0.00 0.00 0.00 0.00 23.12 22.26 1d8f s ALA 678 CO 0.20 0.24 -0.20 -1.01 0.00 0.00 0.00 175.76 174.99 1d8f s HIS 679 N 0.41 2.30 -0.16 0.00 3.76 -0.15 -1.53 115.29 119.92 1d8f s HIS 679 Ca -0.16 -1.00 -0.02 0.00 -0.15 0.00 0.00 55.06 53.73 1d8f s HIS 679 Cb -0.17 -1.57 -0.02 0.00 1.11 0.00 0.00 32.58 31.93 1d8f s HIS 679 CO 0.07 -0.44 -0.07 -0.06 -0.85 0.00 0.00 174.74 173.38 1d8f s PHE 680 N 0.59 2.93 -0.17 1.40 0.40 0.07 -1.23 117.98 121.96 1d8f s PHE 680 Ca -0.14 -0.55 -0.29 0.00 -0.60 0.00 0.00 56.93 55.35 1d8f s PHE 680 Cb -0.17 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.38 1d8f s PHE 680 CO 0.04 -0.20 1.73 0.34 0.70 0.00 0.00 175.22 177.83 1d8f s ASP 681 N 0.59 6.31 0.00 1.36 -1.08 -0.33 -0.25 116.67 123.27 1d8f s ASP 681 Ca -0.05 1.83 0.31 0.00 -0.52 0.00 0.00 52.55 54.12 1d8f s ASP 681 Cb -0.15 -2.53 1.84 0.00 -1.46 0.00 0.00 42.92 40.62 1d8f s ASP 681 CO 0.03 -1.28 2.18 -0.67 0.52 0.00 0.00 175.17 175.95 1d8f n ASP 682 N 8.57 0.00 -0.11 -0.34 -0.08 -0.12 -2.85 116.55 121.62 1d8f n ASP 682 Ca 0.20 -1.00 0.07 0.00 -1.51 0.00 0.00 54.79 52.55 1d8f n ASP 682 Cb 0.44 0.00 0.37 0.00 2.34 0.00 0.00 41.12 44.28 1d8f n ASP 682 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 1d8f n ASP 683 N -0.99 0.33 -4.76 1.67 8.00 -1.26 -4.74 116.55 114.80 1d8f n ASP 683 Ca 0.23 -1.63 -0.22 0.00 0.71 0.00 0.00 54.79 53.88 1d8f n ASP 683 Cb 0.11 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.12 1d8f n ASP 683 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1d8f s GLU 684 N -1.95 2.55 -0.57 -1.24 0.41 -1.13 -4.07 118.70 112.70 1d8f s GLU 684 Ca 0.22 -1.37 -0.17 0.00 -0.41 0.00 0.00 54.97 53.24 1d8f s GLU 684 Cb 0.10 -2.32 0.13 0.00 -1.78 0.00 0.00 34.13 30.27 1d8f s GLU 684 CO 0.17 0.21 0.57 -1.14 -0.49 0.00 0.00 175.26 174.57 1d8f s GLN 685 N -3.85 3.05 -0.22 1.61 2.00 -1.26 -5.02 119.66 115.97 1d8f s GLN 685 Ca 0.36 -1.68 -0.29 0.00 -2.00 0.00 0.00 55.36 51.76 1d8f s GLN 685 Cb -0.05 -4.31 -0.01 0.00 0.80 0.00 0.00 33.01 29.44 1d8f s GLN 685 CO 0.23 -1.38 1.29 -1.58 -0.50 0.00 0.00 175.29 173.36 1d8f s TRP 686 N 1.75 2.76 0.27 1.67 0.52 -1.26 -0.94 118.94 123.71 1d8f s TRP 686 Ca 0.06 0.94 0.10 0.00 0.02 0.00 0.00 56.10 57.23 1d8f s TRP 686 Cb -0.27 -3.67 -0.05 0.00 -1.15 0.00 0.00 33.47 28.33 1d8f s TRP 686 CO 0.03 -1.74 -0.17 0.99 0.02 0.00 0.00 176.95 176.08 1d8f s THR 687 N 3.88 2.23 -0.60 2.01 2.01 -0.16 -4.48 115.64 120.54 1d8f s THR 687 Ca 0.56 -2.33 0.16 0.00 0.31 0.00 0.00 61.69 60.39 1d8f s THR 687 Cb -0.20 -2.28 0.70 0.00 0.01 0.00 0.00 72.50 70.73 1d8f s THR 687 CO 0.18 -0.42 1.62 2.29 -0.69 0.00 0.00 174.62 177.60 1d8f n LYS 688 N -0.58 3.98 0.00 4.92 2.85 -1.26 -1.44 118.16 126.63 1d8f n LYS 688 Ca -0.06 -2.94 0.00 0.00 -1.05 0.00 0.00 58.31 54.26 1d8f n LYS 688 Cb 0.61 -1.99 0.00 0.00 -0.65 0.00 0.00 35.03 33.00 1d8f n LYS 688 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95 1d8f n ASP 689 N 0.58 0.00 -1.72 -5.58 5.75 -1.26 -4.99 116.55 109.32 1d8f n ASP 689 Ca 0.25 0.00 -0.15 0.00 -0.01 0.00 0.00 54.79 54.88 1d8f n ASP 689 Cb 0.98 0.00 0.18 0.00 -1.03 0.00 0.00 41.12 41.25 1d8f n ASP 689 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1d8f n THR 690 N 0.00 2.90 0.01 2.12 -2.24 -1.26 -4.28 114.28 111.53 1d8f n THR 690 Ca 0.00 -2.43 -0.22 0.00 -2.27 0.00 0.00 64.05 59.13 1d8f n THR 690 Cb 0.00 -0.45 -0.14 0.00 -2.10 0.00 0.00 70.33 67.64 1d8f n THR 690 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1d8f h THR 691 N 1.03 0.78 0.00 4.28 1.35 -1.96 -3.48 112.91 114.91 1d8f h THR 691 Ca 0.43 -2.37 0.00 0.00 -0.55 0.00 0.00 66.41 63.93 1d8f h THR 691 Cb 2.17 2.56 0.00 0.00 -1.73 0.00 0.00 68.15 71.15 1d8f h THR 691 CO 0.78 0.80 0.00 0.61 -0.25 0.00 0.00 175.52 177.46 1d8f n GLY 692 N 1.87 0.88 3.35 5.82 0.00 -1.26 -5.07 105.19 110.77 1d8f n GLY 692 Ca -0.29 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 1d8f n GLY 692 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d8f s THR 693 N 2.76 3.42 -0.01 2.61 2.01 -0.11 -4.95 115.64 121.37 1d8f s THR 693 Ca 0.00 -0.49 -0.30 0.00 0.31 0.00 0.00 61.69 61.21 1d8f s THR 693 Cb 0.00 -2.53 -0.05 0.00 0.01 0.00 0.00 72.50 69.93 1d8f s THR 693 CO 0.00 0.45 1.33 0.21 -0.69 0.00 0.00 174.62 175.92 1d8f s ASN 694 N 1.14 6.92 0.04 3.53 2.47 -1.26 -0.99 114.94 126.79 1d8f s ASN 694 Ca 0.02 2.02 -0.25 0.00 0.42 0.00 0.00 52.86 55.07 1d8f s ASN 694 Cb -0.15 -2.56 -0.17 0.00 -1.45 0.00 0.00 41.25 36.92 1d8f s ASN 694 CO -0.01 -0.67 1.47 0.25 -3.72 0.00 0.00 177.10 174.42 1d8f h LEU 695 N 8.20 -0.15 -0.24 3.21 5.85 -1.58 -2.97 115.31 127.63 1d8f h LEU 695 Ca -0.37 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.22 1d8f h LEU 695 Cb 1.18 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 42.18 1d8f h LEU 695 CO 0.89 0.11 -0.16 0.15 -0.34 0.00 0.00 178.44 179.09 1d8f h PHE 696 N -0.40 -0.41 -0.68 1.25 3.57 -1.83 0.03 116.94 118.48 1d8f h PHE 696 Ca -0.02 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.56 1d8f h PHE 696 Cb 0.32 0.22 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 1d8f h PHE 696 CO 0.00 -0.23 0.40 1.25 -2.23 0.00 0.00 178.31 177.50 1d8f h LEU 697 N -0.15 0.62 -0.10 0.59 5.85 -1.92 0.27 115.31 120.48 1d8f h LEU 697 Ca 0.14 0.02 -0.21 0.00 0.84 0.00 0.00 57.88 58.66 1d8f h LEU 697 Cb 0.35 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1d8f h LEU 697 CO -0.33 0.42 -0.98 0.58 -0.34 0.00 0.00 178.44 177.78 1d8f h VAL 698 N 0.76 1.63 -0.59 1.05 2.07 -1.41 -3.02 116.25 116.73 1d8f h VAL 698 Ca 0.29 -3.12 -0.06 0.00 0.82 0.00 0.00 66.70 64.63 1d8f h VAL 698 Cb 0.12 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.60 1d8f h VAL 698 CO -0.15 0.90 0.13 0.00 0.02 0.00 0.00 177.57 178.47 1d8f h ALA 699 N 0.97 0.78 -0.17 1.67 0.00 -0.49 -0.66 119.26 121.35 1d8f h ALA 699 Ca -0.03 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.59 1d8f h ALA 699 Cb 1.69 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.25 1d8f h ALA 699 CO 0.14 0.49 -0.13 0.00 0.00 0.00 0.00 179.25 179.75 1d8f h ALA 700 N 1.03 1.46 -0.06 0.00 0.00 -0.52 -1.29 119.26 119.88 1d8f h ALA 700 Ca 0.18 -0.22 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 1d8f h ALA 700 Cb 0.37 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1d8f h ALA 700 CO 0.00 0.38 -0.84 1.25 0.00 0.00 0.00 179.25 180.04 1d8f h HIS 701 N 0.26 0.73 -0.16 0.00 6.17 -1.32 -3.08 115.15 117.75 1d8f h HIS 701 Ca 0.05 -0.35 -0.22 0.00 0.71 0.00 0.00 60.37 60.56 1d8f h HIS 701 Cb 0.40 -0.10 0.01 0.00 2.52 0.00 0.00 27.41 30.24 1d8f h HIS 701 CO 0.01 1.16 -0.76 0.93 0.71 0.00 0.00 177.93 179.98 1d8f h GLU 702 N 0.33 0.79 0.00 5.26 4.39 -0.74 -3.04 114.58 121.57 1d8f h GLU 702 Ca -0.06 -0.63 0.00 0.00 0.34 0.00 0.00 59.36 59.01 1d8f h GLU 702 Cb 1.46 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 30.23 1d8f h GLU 702 CO 0.15 1.24 0.00 0.82 -1.16 0.00 0.00 179.01 180.07 1d8f h ILE 703 N 0.55 0.00 -0.51 3.13 2.04 -1.34 -0.00 117.51 121.38 1d8f h ILE 703 Ca -0.05 -0.47 0.01 0.00 1.00 0.00 0.00 64.86 65.35 1d8f h ILE 703 Cb 1.38 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 38.83 1d8f h ILE 703 CO 0.16 0.00 0.32 1.23 0.00 0.00 0.00 178.15 179.86 1d8f h GLY 704 N 2.51 0.72 0.90 5.37 0.00 -1.44 -2.07 103.07 109.06 1d8f h GLY 704 Ca 0.00 -0.25 -0.02 0.00 0.00 0.00 0.00 47.33 47.06 1d8f h GLY 704 CO 0.00 0.24 0.09 0.45 0.00 0.00 0.00 176.54 177.32 1d8f h HIS 705 N 0.66 0.41 0.00 5.60 3.86 -0.98 -1.34 115.15 123.35 1d8f h HIS 705 Ca 0.19 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1d8f h HIS 705 Cb -0.04 -0.12 0.00 0.00 1.06 0.00 0.00 27.41 28.31 1d8f h HIS 705 CO -0.05 0.43 0.07 0.77 0.86 0.00 0.00 177.93 180.01 1d8f h SER 706 N 0.26 0.00 0.05 2.45 0.02 -1.26 -0.81 113.55 114.26 1d8f h SER 706 Ca 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.04 1d8f h SER 706 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 1d8f h SER 706 CO -0.01 0.00 -1.32 0.18 -1.14 0.00 0.00 176.83 174.55 1d8f n LEU 707 N -2.98 0.63 0.00 5.07 4.32 -0.66 -3.69 117.00 119.68 1d8f n LEU 707 Ca -0.03 -0.28 0.00 0.00 -0.02 0.00 0.00 56.01 55.68 1d8f n LEU 707 Cb 0.13 -0.01 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 1d8f n LEU 707 CO 0.18 0.14 0.00 0.61 -1.22 0.00 0.00 177.39 177.10 1d8f n GLY 708 N 1.41 1.11 3.74 -0.72 0.00 -0.31 -4.65 105.19 105.76 1d8f n GLY 708 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1d8f n GLY 708 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1d8f s LEU 709 N 0.00 4.27 0.00 0.99 1.43 -0.67 -3.68 118.68 121.02 1d8f s LEU 709 Ca 0.00 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 1d8f s LEU 709 Cb 0.00 -2.42 0.00 0.00 0.03 0.00 0.00 46.19 43.80 1d8f s LEU 709 CO 0.00 0.12 0.00 0.33 0.23 0.00 0.00 176.35 177.03 1d8f n PHE 710 N 3.38 0.00 -2.58 0.29 7.35 -0.06 -3.69 117.46 122.15 1d8f n PHE 710 Ca -0.12 0.00 -0.41 0.00 -0.76 0.00 0.00 57.45 56.16 1d8f n PHE 710 Cb 0.52 0.00 -0.04 0.00 0.35 0.00 0.00 39.48 40.31 1d8f n PHE 710 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1d8f s HIS 711 N 2.11 3.64 0.35 -5.13 3.76 -1.26 -4.60 115.29 114.16 1d8f s HIS 711 Ca 0.00 1.63 -0.04 0.00 -0.15 0.00 0.00 55.06 56.50 1d8f s HIS 711 Cb 0.00 -3.22 -0.04 0.00 1.11 0.00 0.00 32.58 30.43 1d8f s HIS 711 CO 0.00 -0.42 0.61 0.45 -0.85 0.00 0.00 174.74 174.54 1d8f s SER 712 N 0.11 6.37 0.00 1.40 0.15 -0.96 -4.09 113.70 116.67 1d8f s SER 712 Ca 0.50 0.71 0.22 0.00 0.70 0.00 0.00 55.95 58.09 1d8f s SER 712 Cb -0.27 -2.15 0.01 0.00 -1.71 0.00 0.00 66.02 61.90 1d8f s SER 712 CO 0.32 -0.32 1.07 0.00 1.20 0.00 0.00 173.24 175.52 1d8f n ALA 713 N -1.47 4.28 -2.58 5.45 0.00 -1.26 -4.43 120.51 120.50 1d8f n ALA 713 Ca -0.02 -0.54 -0.43 0.00 0.00 0.00 0.00 53.44 52.46 1d8f n ALA 713 Cb 0.55 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 19.10 1d8f n ALA 713 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1d8f s ASN 714 N -2.92 7.06 0.44 0.00 2.47 -1.26 -4.96 114.94 115.76 1d8f s ASN 714 Ca 0.11 1.50 0.11 0.00 0.42 0.00 0.00 52.86 55.00 1d8f s ASN 714 Cb 0.17 -2.54 0.99 0.00 -1.45 0.00 0.00 41.25 38.41 1d8f s ASN 714 CO 0.78 -0.69 2.04 0.71 -3.72 0.00 0.00 177.10 176.22 1d8f h THR 715 N 5.43 1.00 -0.46 -5.21 1.35 -2.01 -2.56 112.91 110.46 1d8f h THR 715 Ca -0.22 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1d8f h THR 715 Cb 1.08 0.54 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1d8f h THR 715 CO 0.97 0.08 0.00 -0.62 -0.25 0.00 0.00 175.52 175.69 1d8f n GLU 716 N -4.48 3.22 -3.26 4.72 -0.58 -1.26 -4.84 120.64 114.16 1d8f n GLU 716 Ca 0.05 -2.15 -0.36 0.00 -0.42 0.00 0.00 57.16 54.28 1d8f n GLU 716 Cb 0.20 -1.81 -0.06 0.00 -0.57 0.00 0.00 31.44 29.20 1d8f n GLU 716 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1d8f s ALA 717 N -1.89 3.53 0.53 0.62 0.00 -0.96 -4.61 121.76 118.96 1d8f s ALA 717 Ca 0.38 -0.00 0.18 0.00 0.00 0.00 0.00 51.96 52.52 1d8f s ALA 717 Cb 0.26 -2.64 1.34 0.00 0.00 0.00 0.00 23.12 22.08 1d8f s ALA 717 CO 0.16 0.40 2.15 1.25 0.00 0.00 0.00 175.76 179.73 1d8f h LEU 718 N 3.69 0.00 -0.23 0.00 5.85 -1.90 -1.78 115.31 120.93 1d8f h LEU 718 Ca -0.49 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.23 1d8f h LEU 718 Cb 1.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1d8f h LEU 718 CO 0.65 0.00 0.00 0.23 -0.34 0.00 0.00 178.44 178.98 1d8f n MET 719 N -4.45 1.15 -2.37 1.25 2.81 -1.26 -4.83 117.12 109.43 1d8f n MET 719 Ca -0.02 -0.23 -0.42 0.00 -1.81 0.00 0.00 57.70 55.22 1d8f n MET 719 Cb 0.13 -1.29 -0.03 0.00 -0.71 0.00 0.00 33.22 31.32 1d8f n MET 719 CO 0.00 0.00 0.00 -0.47 1.51 0.00 0.00 175.97 177.01 1d8f s TYR 720 N -1.95 3.40 0.00 2.03 5.04 -0.67 -2.28 117.35 122.92 1d8f s TYR 720 Ca 0.27 1.24 -0.00 0.00 -2.44 0.00 0.00 57.07 56.14 1d8f s TYR 720 Cb 0.13 -3.47 -0.00 0.00 0.35 0.00 0.00 41.96 38.96 1d8f s TYR 720 CO 0.21 -1.50 0.43 -0.35 -1.34 0.00 0.00 175.55 173.00 1d8f n PRO 721 N 3.82 0.21 -3.70 4.97 -0.04 -1.26 -4.71 135.00 134.30 1d8f n PRO 721 Ca 0.09 -0.01 -0.14 0.00 -0.04 0.00 0.00 63.50 63.40 1d8f n PRO 721 Cb 0.45 -1.41 -0.14 0.00 -0.04 0.00 0.00 33.50 32.37 1d8f n PRO 721 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1d8f s LEU 722 N 0.00 0.15 -0.02 1.53 2.96 -1.26 -5.14 118.68 116.90 1d8f s LEU 722 Ca 0.01 0.46 -0.09 0.00 -0.22 0.00 0.00 54.13 54.29 1d8f s LEU 722 Cb 0.00 0.55 -0.05 0.00 0.50 0.00 0.00 46.19 47.20 1d8f s LEU 722 CO 0.00 -0.20 0.29 -0.47 -1.32 0.00 0.00 176.35 174.65 1d8f s TYR 723 N 1.82 3.62 0.08 5.38 5.04 -1.26 -5.10 117.35 126.93 1d8f s TYR 723 Ca -0.03 0.69 -0.14 0.00 -2.44 0.00 0.00 57.07 55.15 1d8f s TYR 723 Cb -0.11 -2.07 0.02 0.00 0.35 0.00 0.00 41.96 40.14 1d8f s TYR 723 CO -0.07 0.64 0.32 -3.38 -1.34 0.00 0.00 175.55 171.71 1d8f s HIS 724 N -1.19 -0.09 0.03 4.97 -3.43 -1.26 -5.13 115.29 109.19 1d8f s HIS 724 Ca 0.24 -0.16 -0.27 0.00 -0.80 0.00 0.00 55.06 54.08 1d8f s HIS 724 Cb -0.14 0.12 -0.05 0.00 -1.43 0.00 0.00 32.58 31.08 1d8f s HIS 724 CO 0.13 -0.58 0.84 -1.12 -2.00 0.00 0.00 174.74 172.01 1d8f s SER 725 N -2.46 7.27 0.00 7.38 0.01 -1.26 -4.93 113.70 119.70 1d8f s SER 725 Ca -0.00 1.52 0.00 0.00 1.31 0.00 0.00 55.95 58.78 1d8f s SER 725 Cb 0.01 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.74 1d8f s SER 725 CO -0.08 -0.08 0.11 0.00 0.41 0.00 0.00 173.24 173.61 1d8f n LEU 726 N 3.17 0.23 0.00 2.44 -0.00 -1.26 -5.03 117.00 116.55 1d8f n LEU 726 Ca 0.00 -0.49 0.00 0.00 -0.00 0.00 0.00 56.01 55.52 1d8f n LEU 726 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.92 1d8f n LEU 726 CO 0.49 0.06 0.00 0.35 -0.00 0.00 0.00 177.39 178.29 1d8f n THR 727 N -0.53 0.00 -3.53 1.47 -2.24 -1.26 -4.88 114.28 103.32 1d8f n THR 727 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 1d8f n THR 727 Cb 0.02 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 68.19 1d8f n THR 727 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1d8f s ASP 728 N -0.02 5.99 0.00 3.42 1.11 -1.26 -4.74 116.67 121.17 1d8f s ASP 728 Ca 0.00 -2.79 0.25 0.00 0.18 0.00 0.00 52.55 50.19 1d8f s ASP 728 Cb 0.00 -2.03 0.59 0.00 1.07 0.00 0.00 42.92 42.55 1d8f s ASP 728 CO 0.00 -0.47 1.49 0.18 1.18 0.00 0.00 175.17 177.55 1d8f n LEU 729 N 3.71 2.37 0.12 1.23 7.99 -1.26 -4.03 117.00 127.13 1d8f n LEU 729 Ca 0.11 -0.86 -0.02 0.00 -0.01 0.00 0.00 56.01 55.23 1d8f n LEU 729 Cb 0.42 -0.05 0.11 0.00 -0.11 0.00 0.00 43.42 43.79 1d8f n LEU 729 CO 0.33 0.43 0.43 0.71 -1.51 0.00 0.00 177.39 177.78 1d8f h THR 730 N 3.52 1.42 -2.16 -5.08 1.35 -2.01 -3.35 112.91 106.61 1d8f h THR 730 Ca 0.00 -2.39 -0.58 0.00 -0.55 0.00 0.00 66.41 62.89 1d8f h THR 730 Cb 0.76 2.31 -0.40 0.00 -1.73 0.00 0.00 68.15 69.08 1d8f h THR 730 CO 0.00 0.67 -0.90 -2.11 -0.25 0.00 0.00 175.52 172.93 1d8f n ARG 731 N -3.63 1.32 -3.91 4.72 0.00 -1.26 -5.09 116.66 108.82 1d8f n ARG 731 Ca -0.01 -3.76 -0.35 0.00 -0.00 0.00 0.00 57.85 53.73 1d8f n ARG 731 Cb 0.69 -1.66 -0.10 0.00 -0.00 0.00 0.00 32.46 31.39 1d8f n ARG 731 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.63 177.75 1d8f s PHE 732 N -1.51 3.26 0.00 2.89 5.36 -1.26 -5.06 117.98 121.66 1d8f s PHE 732 Ca 0.36 0.07 0.00 0.00 -0.96 0.00 0.00 56.93 56.40 1d8f s PHE 732 Cb 0.14 -2.13 -0.00 0.00 -0.34 0.00 0.00 43.02 40.69 1d8f s PHE 732 CO -0.09 0.10 -0.01 1.03 -1.46 0.00 0.00 175.22 174.79 1d8f s ARG 733 N 0.60 0.08 0.38 10.12 0.52 -1.26 -5.13 118.95 124.26 1d8f s ARG 733 Ca 0.04 -0.12 -0.27 0.00 -0.52 0.00 0.00 55.73 54.87 1d8f s ARG 733 Cb -0.13 -0.01 -0.10 0.00 0.52 0.00 0.00 34.95 35.23 1d8f s ARG 733 CO 0.01 -0.00 1.36 -0.51 0.02 0.00 0.00 175.30 176.18 1d8f s LEU 734 N -0.25 4.28 0.65 2.53 1.43 -1.26 -4.98 118.68 121.07 1d8f s LEU 734 Ca -0.02 2.79 -0.14 0.00 -1.03 0.00 0.00 54.13 55.73 1d8f s LEU 734 Cb -0.02 -3.78 -0.01 0.00 0.03 0.00 0.00 46.19 42.41 1d8f s LEU 734 CO -0.00 -0.81 1.08 -0.55 0.23 0.00 0.00 176.35 176.29 1d8f s SER 735 N -0.50 5.38 0.45 2.29 0.15 -1.26 -4.87 113.70 115.35 1d8f s SER 735 Ca 0.54 1.85 0.17 0.00 0.70 0.00 0.00 55.95 59.21 1d8f s SER 735 Cb -0.41 -2.53 1.12 0.00 -1.71 0.00 0.00 66.02 62.49 1d8f s SER 735 CO 0.54 -1.44 1.96 1.56 1.20 0.00 0.00 173.24 177.07 1d8f h GLN 736 N -0.01 0.30 -0.60 5.44 1.08 -1.93 -1.53 115.11 117.86 1d8f h GLN 736 Ca -0.46 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.72 1d8f h GLN 736 Cb 1.23 -0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 28.56 1d8f h GLN 736 CO 0.56 0.20 0.38 0.22 -0.95 0.00 0.00 178.83 179.24 1d8f h ASP 737 N 0.31 0.71 -0.24 1.46 1.82 -1.96 0.04 116.42 118.56 1d8f h ASP 737 Ca 0.30 -0.04 -0.00 0.00 -0.39 0.00 0.00 57.03 56.90 1d8f h ASP 737 Cb 0.75 -0.18 -0.01 0.00 0.68 0.00 0.00 39.33 40.57 1d8f h ASP 737 CO -0.07 0.54 0.14 0.44 -1.61 0.00 0.00 179.24 178.68 1d8f h ASP 738 N 0.82 0.28 0.00 2.28 3.32 -1.65 -0.73 116.42 120.75 1d8f h ASP 738 Ca 0.22 -0.05 0.02 0.00 0.02 0.00 0.00 57.03 57.24 1d8f h ASP 738 Cb -0.05 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 1d8f h ASP 738 CO -0.04 0.25 -0.11 0.40 -1.72 0.00 0.00 179.24 178.02 1d8f h ILE 739 N 0.29 0.72 -0.82 0.35 2.04 -1.26 -1.56 117.51 117.28 1d8f h ILE 739 Ca 0.08 0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.08 1d8f h ILE 739 Cb 0.02 0.72 -0.09 0.00 -0.74 0.00 0.00 36.82 36.73 1d8f h ILE 739 CO -0.02 0.00 0.42 0.78 0.00 0.00 0.00 178.15 179.33 1d8f h ASN 740 N -0.19 0.51 0.31 1.72 4.21 -0.60 -0.55 115.58 120.99 1d8f h ASN 740 Ca 0.04 0.09 -0.23 0.00 1.21 0.00 0.00 56.30 57.41 1d8f h ASN 740 Cb 0.24 0.01 0.00 0.00 -1.12 0.00 0.00 38.32 37.45 1d8f h ASN 740 CO -0.11 0.23 -0.95 1.23 -1.29 0.00 0.00 177.43 176.53 1d8f h GLY 741 N 0.61 0.49 2.00 2.83 0.00 -0.63 -2.44 103.07 105.93 1d8f h GLY 741 Ca 0.44 -0.86 -0.20 0.00 0.00 0.00 0.00 47.33 46.71 1d8f h GLY 741 CO -0.35 0.76 -0.96 1.19 0.00 0.00 0.00 176.54 177.18 1d8f h ILE 742 N 0.24 1.67 0.00 2.60 6.09 -1.03 -3.16 117.51 123.93 1d8f h ILE 742 Ca -0.08 -3.33 0.00 0.00 -1.37 0.00 0.00 64.86 60.08 1d8f h ILE 742 Cb 1.59 2.81 0.00 0.00 0.47 0.00 0.00 36.82 41.69 1d8f h ILE 742 CO 0.17 0.94 0.00 1.56 -3.07 0.00 0.00 178.15 177.75 1d8f h GLN 743 N 0.00 0.00 0.00 2.19 4.20 -1.12 -0.92 115.11 119.46 1d8f h GLN 743 Ca -0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1d8f h GLN 743 Cb 1.73 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.51 1d8f h GLN 743 CO 0.13 0.00 0.00 -1.13 -0.67 0.00 0.00 178.83 177.16 1d8f n SER 744 N -3.01 0.33 -0.10 1.46 3.41 -0.92 -1.24 113.62 113.55 1d8f n SER 744 Ca 0.03 0.55 -0.16 0.00 -0.26 0.00 0.00 58.87 59.02 1d8f n SER 744 Cb 0.42 -0.63 -0.05 0.00 -0.26 0.00 0.00 64.21 63.68 1d8f n SER 744 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1d8f n LEU 745 N -1.83 1.84 -0.00 1.04 4.77 -0.87 -4.85 117.00 117.10 1d8f n LEU 745 Ca 0.05 0.31 0.06 0.00 -0.03 0.00 0.00 56.01 56.40 1d8f n LEU 745 Cb 0.30 -0.73 -0.09 0.00 -2.33 0.00 0.00 43.42 40.58 1d8f n LEU 745 CO 0.23 0.04 -0.50 -1.22 -1.33 0.00 0.00 177.39 174.61 1d8f n TYR 746 N -4.28 0.00 0.00 -1.77 4.02 -0.40 -5.05 117.16 109.67 1d8f n TYR 746 Ca -0.29 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.60 1d8f n TYR 746 Cb 0.64 -0.22 0.00 0.00 -0.02 0.00 0.00 39.34 39.74 1d8f n TYR 746 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1d8f n GLY 747 N 1.68 -1.05 3.86 2.72 0.00 -0.37 -4.55 105.19 107.47 1d8f n GLY 747 Ca -0.01 -1.62 -0.29 0.00 0.00 0.00 0.00 46.02 44.10 1d8f n GLY 747 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1d8f s PRO 748 N -1.02 2.03 0.32 1.61 0.04 -1.26 -3.97 135.00 132.75 1d8f s PRO 748 Ca 0.00 0.33 -0.29 0.00 0.04 0.00 0.00 61.00 61.08 1d8f s PRO 748 Cb 0.00 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.50 1d8f s PRO 748 CO 0.00 -1.59 1.33 -2.14 0.04 0.00 0.00 177.00 174.64 1d8f s PRO 749 N -5.39 4.33 0.35 0.56 0.02 -1.26 -3.82 135.00 129.79 1d8f s PRO 749 Ca 0.61 2.24 0.26 0.00 0.02 0.00 0.00 61.00 64.13 1d8f s PRO 749 Cb -0.12 -3.07 1.22 0.00 0.02 0.00 0.00 34.50 32.55 1d8f s PRO 749 CO 0.51 -0.24 1.78 -1.00 -0.33 0.00 0.00 177.00 177.72 1d8f h PRO 750 N 3.63 0.00 -0.29 5.54 0.13 -1.94 -2.74 132.00 136.33 1d8f h PRO 750 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1d8f h PRO 750 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1d8f h PRO 750 CO 0.67 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.04 1d8f n ASP 751 N -2.40 3.14 -4.78 1.44 5.68 -1.26 -4.98 116.55 113.40 1d8f n ASP 751 Ca 0.00 -1.92 -0.34 0.00 -0.50 0.00 0.00 54.79 52.03 1d8f n ASP 751 Cb 0.14 -0.19 -0.07 0.00 -1.14 0.00 0.00 41.12 39.87 1d8f n ASP 751 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1d8f s SER 752 N -1.40 5.72 0.06 -1.12 0.01 -1.03 -5.09 113.70 110.85 1d8f s SER 752 Ca 0.32 0.21 -0.28 0.00 1.31 0.00 0.00 55.95 57.52 1d8f s SER 752 Cb 0.19 -1.68 -0.05 0.00 0.21 0.00 0.00 66.02 64.69 1d8f s SER 752 CO 0.27 0.32 0.87 -2.16 0.41 0.00 0.00 173.24 172.95 1d8f s PRO 753 N -1.42 4.58 -0.17 12.44 0.04 -1.26 -4.87 135.00 144.34 1d8f s PRO 753 Ca 0.19 1.25 -0.15 0.00 0.04 0.00 0.00 61.00 62.34 1d8f s PRO 753 Cb -0.12 -3.38 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1d8f s PRO 753 CO 0.10 0.21 0.34 -2.00 0.04 0.00 0.00 177.00 175.68 1d8f s GLU 754 N 0.13 4.24 0.00 4.56 2.56 -1.26 -5.14 118.70 123.79 1d8f s GLU 754 Ca 0.43 0.15 0.13 0.00 0.00 0.00 0.00 54.97 55.68 1d8f s GLU 754 Cb -0.22 -3.47 0.75 0.00 2.00 0.00 0.00 34.13 33.20 1d8f s GLU 754 CO 0.26 0.14 1.18 0.25 -0.56 0.00 0.00 175.26 176.52