#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rre s VAL 595 N 0.00 3.82 -0.68 1.55 -7.23 -1.26 -1.83 120.40 114.77 1rre s VAL 595 Ca 0.00 1.66 0.00 0.00 -1.81 0.00 0.00 61.98 61.83 1rre s VAL 595 Cb 0.00 -4.06 0.00 0.00 0.56 0.00 0.00 36.38 32.88 1rre s VAL 595 CO 0.00 0.33 0.00 0.61 -0.31 0.00 0.00 175.10 175.73 1rre n GLY 596 N 1.76 0.16 2.68 2.32 0.00 -1.26 -4.88 105.19 105.96 1rre n GLY 596 Ca 0.01 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 1rre n GLY 596 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1rre s GLN 597 N -4.18 0.22 0.00 1.61 2.00 -1.23 -0.17 119.66 117.90 1rre s GLN 597 Ca 0.00 0.05 0.04 0.00 -2.00 0.00 0.00 55.36 53.45 1rre s GLN 597 Cb 0.00 -1.28 -0.01 0.00 0.80 0.00 0.00 33.01 32.51 1rre s GLN 597 CO 0.00 -0.48 -0.13 0.08 -0.50 0.00 0.00 175.29 174.25 1rre s VAL 598 N 2.07 1.06 -0.39 1.34 1.01 -0.28 -4.62 120.40 120.59 1rre s VAL 598 Ca 0.03 -0.66 -0.21 0.00 0.00 0.00 0.00 61.98 61.14 1rre s VAL 598 Cb -0.14 -0.90 0.01 0.00 0.00 0.00 0.00 36.38 35.35 1rre s VAL 598 CO -0.06 0.24 0.69 -0.89 0.00 0.00 0.00 175.10 175.08 1rre s THR 599 N -0.42 4.80 0.33 3.92 2.01 -1.26 -0.35 115.64 124.67 1rre s THR 599 Ca 0.04 0.51 0.06 0.00 0.31 0.00 0.00 61.69 62.61 1rre s THR 599 Cb -0.06 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.26 1rre s THR 599 CO -0.00 -0.48 0.47 -0.83 -0.69 0.00 0.00 174.62 173.09 1rre s GLY 600 N 1.91 1.52 -0.21 4.40 0.00 -0.02 -4.32 107.32 110.60 1rre s GLY 600 Ca 0.26 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.62 1rre s GLY 600 CO 0.18 -1.30 -0.14 1.08 0.00 0.00 0.00 173.10 172.92 1rre s LEU 601 N -4.17 2.52 0.00 0.66 1.43 -1.25 -1.17 118.68 116.70 1rre s LEU 601 Ca 0.43 -0.93 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 1rre s LEU 601 Cb -0.09 -1.39 0.02 0.00 0.03 0.00 0.00 46.19 44.75 1rre s LEU 601 CO 0.31 -0.11 0.43 0.00 0.23 0.00 0.00 176.35 177.21 1rre n ALA 602 N 4.60 -0.59 -1.77 4.21 0.00 -0.39 -4.57 120.51 122.00 1rre n ALA 602 Ca -0.17 -1.10 -0.38 0.00 0.00 0.00 0.00 53.44 51.80 1rre n ALA 602 Cb 0.47 0.88 -0.04 0.00 0.00 0.00 0.00 19.45 20.76 1rre n ALA 602 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1rre s TRP 603 N -3.68 3.41 -0.12 0.00 -0.00 -1.25 -4.41 118.94 112.90 1rre s TRP 603 Ca 0.18 1.68 -0.15 0.00 -0.00 0.00 0.00 56.10 57.81 1rre s TRP 603 Cb -0.02 -3.14 0.04 0.00 -0.00 0.00 0.00 33.47 30.35 1rre s TRP 603 CO 0.13 -0.48 0.41 0.99 -0.00 0.00 0.00 176.95 178.00 1rre s THR 604 N -1.52 0.01 0.27 5.86 2.01 -1.26 -3.16 115.64 117.85 1rre s THR 604 Ca 0.53 -0.10 -0.00 0.00 0.31 0.00 0.00 61.69 62.43 1rre s THR 604 Cb -0.24 -0.61 0.25 0.00 0.01 0.00 0.00 72.50 71.91 1rre s THR 604 CO 0.31 -0.05 1.76 -0.08 -0.69 0.00 0.00 174.62 175.86 1rre h GLU 605 N 5.04 0.59 0.00 4.92 4.57 -1.88 -2.56 114.58 125.25 1rre h GLU 605 Ca -0.27 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1rre h GLU 605 Cb 1.18 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1rre h GLU 605 CO 0.28 0.39 0.00 1.33 -1.18 0.00 0.00 179.01 179.83 1rre n VAL 606 N -4.88 0.00 0.00 0.32 0.24 -1.26 -5.03 118.33 107.72 1rre n VAL 606 Ca 0.18 0.76 0.00 0.00 -2.04 0.00 0.00 64.34 63.24 1rre n VAL 606 Cb 0.46 -1.49 0.00 0.00 -1.47 0.00 0.00 33.84 31.35 1rre n VAL 606 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rre n GLY 607 N 0.50 -0.12 0.00 7.63 0.00 -0.97 -5.12 105.19 107.12 1rre n GLY 607 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rre n GLY 607 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rre n GLY 608 N 0.00 -0.88 0.00 -0.02 0.00 -1.26 -4.96 105.19 98.07 1rre n GLY 608 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1rre n GLY 608 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1rre n ASP 609 N -1.41 0.00 -4.67 1.61 9.92 -1.26 -4.65 116.55 116.08 1rre n ASP 609 Ca 0.00 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 53.83 1rre n ASP 609 Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 1rre n ASP 609 CO 0.00 0.00 0.00 -0.22 0.13 0.00 0.00 177.20 177.11 1rre s LEU 610 N 0.00 4.25 -0.05 0.64 2.96 -1.26 -1.27 118.68 123.96 1rre s LEU 610 Ca 0.00 1.85 0.04 0.00 -0.22 0.00 0.00 54.13 55.79 1rre s LEU 610 Cb 0.00 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.14 1rre s LEU 610 CO 0.00 -0.70 -0.16 -0.76 -1.32 0.00 0.00 176.35 173.41 1rre s LEU 611 N 2.88 1.88 -0.56 -0.68 1.43 -0.31 -4.98 118.68 118.34 1rre s LEU 611 Ca 0.58 -0.34 -0.13 0.00 -1.03 0.00 0.00 54.13 53.21 1rre s LEU 611 Cb -0.25 -0.93 0.14 0.00 0.03 0.00 0.00 46.19 45.17 1rre s LEU 611 CO 0.20 0.13 0.48 -0.89 0.23 0.00 0.00 176.35 176.51 1rre s THR 612 N 0.13 4.87 -0.20 5.49 2.01 -1.26 -0.84 115.64 125.83 1rre s THR 612 Ca -0.05 -1.79 -0.18 0.00 0.31 0.00 0.00 61.69 59.98 1rre s THR 612 Cb -0.12 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 1rre s THR 612 CO 0.02 -0.86 0.49 -0.63 -0.69 0.00 0.00 174.62 172.95 1rre s ILE 613 N 1.25 5.13 0.10 1.82 1.01 0.53 -3.92 121.20 127.11 1rre s ILE 613 Ca 0.07 0.88 0.06 0.00 0.00 0.00 0.00 60.65 61.66 1rre s ILE 613 Cb -0.26 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.36 1rre s ILE 613 CO -0.00 0.19 -0.06 -1.61 0.00 0.00 0.00 174.94 173.47 1rre s GLU 614 N 1.58 2.32 -0.00 2.79 2.02 0.22 -1.13 118.70 126.50 1rre s GLU 614 Ca 0.23 -0.94 -0.03 0.00 0.02 0.00 0.00 54.97 54.25 1rre s GLU 614 Cb -0.15 -2.41 -0.01 0.00 0.10 0.00 0.00 34.13 31.66 1rre s GLU 614 CO 0.09 0.52 0.04 0.95 0.02 0.00 0.00 175.26 176.89 1rre s THR 615 N -1.25 0.06 0.07 3.63 -4.23 0.76 -1.49 115.64 113.20 1rre s THR 615 Ca 0.23 -0.51 0.05 0.00 -1.18 0.00 0.00 61.69 60.28 1rre s THR 615 Cb -0.11 -0.24 -0.03 0.00 1.34 0.00 0.00 72.50 73.46 1rre s THR 615 CO 0.16 -0.28 -0.14 0.00 -0.54 0.00 0.00 174.62 173.81 1rre s ALA 616 N -0.88 1.18 -0.43 3.99 0.00 0.29 -4.69 121.76 121.23 1rre s ALA 616 Ca -0.10 -1.01 0.06 0.00 0.00 0.00 0.00 51.96 50.92 1rre s ALA 616 Cb -0.06 -0.10 0.21 0.00 0.00 0.00 0.00 23.12 23.17 1rre s ALA 616 CO 0.00 0.17 0.52 0.00 0.00 0.00 0.00 175.76 176.44 1rre s VAL 618 N -0.20 4.75 0.15 0.00 -7.23 -0.99 -4.80 120.40 112.08 1rre s VAL 618 Ca 0.33 0.61 -0.34 0.00 -1.81 0.00 0.00 61.98 60.77 1rre s VAL 618 Cb 0.10 -3.86 -0.14 0.00 0.56 0.00 0.00 36.38 33.05 1rre s VAL 618 CO -0.15 -1.02 1.56 -2.65 -0.31 0.00 0.00 175.10 172.53 1rre n PRO 619 N -2.58 2.06 0.00 4.82 -0.02 -1.26 -0.66 135.00 137.36 1rre n PRO 619 Ca 0.04 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.26 1rre n PRO 619 Cb 0.55 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 1rre n PRO 619 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rre n GLY 620 N 3.36 2.73 0.10 -1.23 0.00 -0.56 -4.56 105.19 105.03 1rre n GLY 620 Ca 0.17 -0.02 0.03 0.00 0.00 0.00 0.00 46.02 46.20 1rre n GLY 620 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1rre n LYS 621 N 0.00 1.38 0.00 1.61 4.76 -1.26 -3.98 118.16 120.68 1rre n LYS 621 Ca 0.00 -1.47 0.00 0.00 -2.87 0.00 0.00 58.31 53.97 1rre n LYS 621 Cb 0.00 -0.93 0.00 0.00 -1.84 0.00 0.00 35.03 32.26 1rre n LYS 621 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1rre n GLY 622 N -0.54 0.90 3.74 0.72 0.00 -0.79 -4.68 105.19 104.54 1rre n GLY 622 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1rre n GLY 622 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1rre s LYS 623 N -0.69 2.79 -0.09 1.61 2.47 -1.25 -4.82 119.74 119.76 1rre s LYS 623 Ca 0.00 2.04 -0.01 0.00 -1.56 0.00 0.00 55.97 56.45 1rre s LYS 623 Cb 0.00 -1.96 0.03 0.00 -1.46 0.00 0.00 37.83 34.44 1rre s LYS 623 CO 0.00 -1.41 -0.04 -0.51 0.16 0.00 0.00 175.35 173.55 1rre s LEU 624 N -4.11 0.98 -0.06 5.43 1.43 -1.26 -1.27 118.68 119.83 1rre s LEU 624 Ca 0.79 -0.19 0.01 0.00 -1.03 0.00 0.00 54.13 53.71 1rre s LEU 624 Cb -0.36 -0.64 0.02 0.00 0.03 0.00 0.00 46.19 45.24 1rre s LEU 624 CO 0.40 -0.14 -0.07 0.42 0.23 0.00 0.00 176.35 177.19 1rre s THR 625 N 1.68 0.74 -0.18 5.49 -4.23 -0.47 -5.01 115.64 113.66 1rre s THR 625 Ca 0.02 -0.22 0.01 0.00 -1.18 0.00 0.00 61.69 60.31 1rre s THR 625 Cb -0.13 -0.74 0.02 0.00 1.34 0.00 0.00 72.50 72.99 1rre s THR 625 CO -0.06 0.28 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.81 1rre s TYR 626 N 0.98 2.80 0.26 3.99 4.12 -1.26 -1.41 117.35 126.83 1rre s TYR 626 Ca -0.10 -1.58 0.01 0.00 0.02 0.00 0.00 57.07 55.42 1rre s TYR 626 Cb -0.14 -1.94 -0.05 0.00 -1.52 0.00 0.00 41.96 38.31 1rre s TYR 626 CO 0.00 -0.79 0.12 0.95 0.02 0.00 0.00 175.55 175.85 1rre s THR 627 N 1.31 0.42 0.00 -0.71 -4.23 -0.52 -4.93 115.64 106.98 1rre s THR 627 Ca 0.05 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1rre s THR 627 Cb -0.13 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1rre s THR 627 CO -0.12 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 1rre n GLY 628 N -0.47 1.53 3.78 3.99 0.00 -1.26 -2.11 105.19 110.65 1rre n GLY 628 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1rre n GLY 628 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rre n SER 629 N 0.00 -2.61 -4.73 1.61 7.64 -1.24 -4.54 113.62 109.75 1rre n SER 629 Ca 0.00 -0.80 -0.40 0.00 1.01 0.00 0.00 58.87 58.68 1rre n SER 629 Cb 0.00 -4.01 -0.04 0.00 -1.01 0.00 0.00 64.21 59.15 1rre n SER 629 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1rre s LEU 630 N -6.92 4.43 0.71 -3.43 1.43 -1.26 -1.98 118.68 111.65 1rre s LEU 630 Ca 0.26 1.51 -0.10 0.00 -1.03 0.00 0.00 54.13 54.77 1rre s LEU 630 Cb -0.13 -3.34 0.03 0.00 0.03 0.00 0.00 46.19 42.78 1rre s LEU 630 CO 0.82 -0.07 1.08 -0.83 0.23 0.00 0.00 176.35 177.58 1rre s GLY 631 N 0.26 1.62 0.29 -3.19 0.00 0.67 -4.82 107.32 102.16 1rre s GLY 631 Ca 0.42 -0.47 0.02 0.00 0.00 0.00 0.00 44.72 44.69 1rre s GLY 631 CO 0.24 -0.10 1.85 0.83 0.00 0.00 0.00 173.10 175.93 1rre h GLU 632 N -0.65 0.96 -1.43 2.90 5.08 -1.97 -1.86 114.58 117.61 1rre h GLU 632 Ca -0.45 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.85 1rre h GLU 632 Cb 1.27 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 30.30 1rre h GLU 632 CO 0.64 0.63 0.00 0.28 -1.00 0.00 0.00 179.01 179.56 1rre n VAL 633 N -4.58 0.30 0.00 3.13 0.31 -1.26 -1.69 118.33 114.53 1rre n VAL 633 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 1rre n VAL 633 Cb 0.33 -0.60 0.00 0.00 -0.91 0.00 0.00 33.84 32.66 1rre n VAL 633 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1rre n GLN 635 N 0.74 0.00 0.07 5.55 6.02 -0.70 -1.87 117.38 127.18 1rre n GLN 635 Ca 0.00 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.97 1rre n GLN 635 Cb 0.17 0.00 0.23 0.00 1.02 0.00 0.00 30.24 31.66 1rre n GLN 635 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 1rre h GLU 636 N 0.00 0.31 -0.53 -1.09 5.08 -1.61 -1.95 114.58 114.80 1rre h GLU 636 Ca 0.00 -0.13 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1rre h GLU 636 Cb 0.00 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 1rre h GLU 636 CO 0.00 0.62 0.10 0.66 -1.00 0.00 0.00 179.01 179.39 1rre h SER 637 N 0.27 0.77 -0.55 1.42 4.64 -1.65 0.14 113.55 118.59 1rre h SER 637 Ca 0.03 -0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.19 1rre h SER 637 Cb 0.73 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.60 1rre h SER 637 CO 0.06 0.78 0.28 0.40 -0.87 0.00 0.00 176.83 177.47 1rre h ILE 638 N 0.79 1.20 -0.83 0.95 2.04 -1.67 -0.24 117.51 119.74 1rre h ILE 638 Ca 0.17 -0.54 -0.03 0.00 1.00 0.00 0.00 64.86 65.45 1rre h ILE 638 Cb 0.33 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 36.91 1rre h ILE 638 CO 0.00 0.22 0.38 1.56 0.00 0.00 0.00 178.15 180.32 1rre h GLN 639 N 0.74 1.20 0.06 2.37 4.20 -0.66 -0.23 115.11 122.79 1rre h GLN 639 Ca 0.19 -0.19 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1rre h GLN 639 Cb 0.10 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.67 1rre h GLN 639 CO -0.03 0.93 -0.03 0.00 -0.67 0.00 0.00 178.83 179.04 1rre h ALA 640 N 1.21 -0.08 -0.96 3.87 0.00 -0.51 -2.03 119.26 120.75 1rre h ALA 640 Ca 0.28 -0.08 0.12 0.00 0.00 0.00 0.00 54.91 55.23 1rre h ALA 640 Cb 0.14 0.03 -0.08 0.00 0.00 0.00 0.00 17.79 17.88 1rre h ALA 640 CO -0.03 -0.48 0.59 0.00 0.00 0.00 0.00 179.25 179.33 1rre h ALA 641 N 0.71 1.45 -0.28 0.00 0.00 -0.86 -1.56 119.26 118.72 1rre h ALA 641 Ca -0.01 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1rre h ALA 641 Cb 0.19 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1rre h ALA 641 CO 0.01 0.16 0.05 1.25 0.00 0.00 0.00 179.25 180.73 1rre h LEU 642 N 0.92 0.45 -1.40 0.00 5.85 -0.79 -2.24 115.31 118.10 1rre h LEU 642 Ca 0.48 -0.26 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1rre h LEU 642 Cb 0.51 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1rre h LEU 642 CO -0.28 0.59 0.11 0.74 -0.34 0.00 0.00 178.44 179.27 1rre h THR 643 N 0.28 1.16 -0.22 1.05 2.02 -0.94 -1.80 112.91 114.45 1rre h THR 643 Ca 0.09 -0.53 0.03 0.00 0.77 0.00 0.00 66.41 66.77 1rre h THR 643 Cb 0.34 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 1rre h THR 643 CO 0.01 0.20 0.02 0.58 0.37 0.00 0.00 175.52 176.69 1rre h VAL 644 N 0.51 0.87 -0.63 3.16 2.07 -0.82 -0.92 116.25 120.49 1rre h VAL 644 Ca 0.12 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.62 1rre h VAL 644 Cb 0.16 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1rre h VAL 644 CO -0.01 0.02 0.41 0.58 0.02 0.00 0.00 177.57 178.59 1rre h VAL 645 N 0.09 1.14 -0.53 2.57 2.07 -1.07 -2.66 116.25 117.87 1rre h VAL 645 Ca 0.10 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1rre h VAL 645 Cb 0.12 0.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.10 1rre h VAL 645 CO -0.16 0.15 0.30 0.03 0.02 0.00 0.00 177.57 177.91 1rre h ARG 646 N 0.83 0.74 -0.25 1.57 3.08 -1.03 0.26 114.38 119.58 1rre h ARG 646 Ca 0.24 -0.08 0.01 0.00 0.07 0.00 0.00 59.98 60.22 1rre h ARG 646 Cb -0.07 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.82 1rre h ARG 646 CO -0.06 0.56 0.17 0.00 -1.07 0.00 0.00 179.97 179.56 1rre h ALA 647 N 1.13 1.87 -0.36 0.04 0.00 -1.01 -2.87 119.26 118.07 1rre h ALA 647 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1rre h ALA 647 Cb 0.03 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rre h ALA 647 CO -0.03 0.10 0.00 0.54 0.00 0.00 0.00 179.25 179.86 1rre n ARG 648 N -4.50 2.88 -0.10 0.00 1.74 -0.86 -4.81 116.66 111.01 1rre n ARG 648 Ca 0.01 -2.12 -0.06 0.00 -0.77 0.00 0.00 57.85 54.91 1rre n ARG 648 Cb 0.10 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.23 1rre n ARG 648 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1rre h ALA 649 N 2.09 0.16 -0.38 7.54 0.00 -0.26 -1.59 119.26 126.82 1rre h ALA 649 Ca 0.00 0.13 0.08 0.00 0.00 0.00 0.00 54.91 55.12 1rre h ALA 649 Cb 0.79 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1rre h ALA 649 CO 0.02 -0.51 -0.13 0.93 0.00 0.00 0.00 179.25 179.55 1rre h GLU 650 N -0.07 -0.05 -0.89 0.00 4.39 -1.85 -0.56 114.58 115.55 1rre h GLU 650 Ca 0.17 0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.89 1rre h GLU 650 Cb 0.33 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.95 1rre h GLU 650 CO -0.40 -0.04 0.59 0.87 -1.16 0.00 0.00 179.01 178.88 1rre h LYS 651 N -0.05 1.14 -0.04 2.33 1.57 -1.65 -2.24 116.57 117.62 1rre h LYS 651 Ca 0.19 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 1rre h LYS 651 Cb 0.34 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1rre h LYS 651 CO -0.42 0.75 0.00 1.28 -0.57 0.00 0.00 179.45 180.49 1rre n LEU 652 N -4.41 0.41 0.00 2.94 4.77 -0.68 -4.88 117.00 115.15 1rre n LEU 652 Ca 0.11 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1rre n LEU 652 Cb 0.05 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1rre n LEU 652 CO 0.36 0.08 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1rre n GLY 653 N 0.90 1.02 3.71 -0.72 0.00 -0.84 -4.94 105.19 104.32 1rre n GLY 653 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1rre n GLY 653 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rre s ILE 654 N -3.35 4.84 -0.03 -0.61 1.01 -0.31 -4.98 121.20 117.76 1rre s ILE 654 Ca 0.00 2.00 -0.30 0.00 0.00 0.00 0.00 60.65 62.36 1rre s ILE 654 Cb 0.00 -4.29 -0.07 0.00 0.01 0.00 0.00 42.46 38.10 1rre s ILE 654 CO 0.00 0.19 1.87 0.21 0.00 0.00 0.00 174.94 177.21 1rre s ASN 655 N 0.85 6.42 0.64 3.58 3.04 -1.26 -3.74 114.94 124.45 1rre s ASN 655 Ca 0.50 2.40 0.42 0.00 0.04 0.00 0.00 52.86 56.21 1rre s ASN 655 Cb -0.21 -2.53 2.13 0.00 -1.54 0.00 0.00 41.25 39.10 1rre s ASN 655 CO 0.27 -1.11 2.26 1.55 -3.04 0.00 0.00 177.10 177.03 1rre h PRO 656 N 10.70 0.00 0.00 0.43 0.13 -1.95 -0.11 132.00 141.21 1rre h PRO 656 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1rre h PRO 656 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1rre h PRO 656 CO 0.95 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.32 1rre n ASP 657 N -3.08 0.00 0.25 1.44 3.85 -1.26 -3.87 116.55 113.88 1rre n ASP 657 Ca -0.02 0.05 0.14 0.00 -0.71 0.00 0.00 54.79 54.25 1rre n ASP 657 Cb 0.14 -0.22 0.81 0.00 -1.35 0.00 0.00 41.12 40.50 1rre n ASP 657 CO 0.00 0.00 0.00 2.19 -1.01 0.00 0.00 177.20 178.38 1rre h PHE 658 N 0.00 0.00 0.00 2.11 -5.15 -1.39 -1.51 116.94 111.00 1rre h PHE 658 Ca 0.00 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.72 1rre h PHE 658 Cb 0.07 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.23 1rre h PHE 658 CO 0.00 0.00 -0.24 0.10 -2.00 0.00 0.00 178.31 176.17 1rre h TYR 659 N 0.00 0.00 -0.01 6.09 -0.00 -1.84 -1.24 116.97 119.97 1rre h TYR 659 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.76 1rre h TYR 659 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.88 1rre h TYR 659 CO 0.00 0.24 -0.26 -0.85 -0.00 0.00 0.00 178.16 177.29 1rre n GLU 660 N -3.62 2.37 -0.00 0.10 0.28 -0.87 -4.15 120.64 114.74 1rre n GLU 660 Ca -0.01 -0.50 0.09 0.00 -0.16 0.00 0.00 57.16 56.58 1rre n GLU 660 Cb 0.37 -1.07 -0.12 0.00 1.43 0.00 0.00 31.44 32.05 1rre n GLU 660 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1rre n LYS 661 N -0.43 0.80 -4.29 3.44 3.00 -0.62 -3.27 118.16 116.79 1rre n LYS 661 Ca 0.04 -0.07 -0.22 0.00 -0.00 0.00 0.00 58.31 58.05 1rre n LYS 661 Cb 0.20 -1.40 -0.12 0.00 0.00 0.00 0.00 35.03 33.72 1rre n LYS 661 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 1rre s ARG 662 N -2.98 1.15 -0.26 1.64 0.52 -0.49 -1.49 118.95 117.05 1rre s ARG 662 Ca 0.01 -1.26 -0.10 0.00 -0.52 0.00 0.00 55.73 53.87 1rre s ARG 662 Cb 0.13 -1.28 -0.04 0.00 0.52 0.00 0.00 34.95 34.28 1rre s ARG 662 CO 0.76 0.28 0.15 -0.51 0.02 0.00 0.00 175.30 176.00 1rre s ASP 663 N -2.26 5.83 -0.16 0.23 1.11 0.16 -1.88 116.67 119.71 1rre s ASP 663 Ca 0.10 -0.01 -0.03 0.00 0.18 0.00 0.00 52.55 52.79 1rre s ASP 663 Cb -0.08 -2.06 -0.02 0.00 1.07 0.00 0.00 42.92 41.83 1rre s ASP 663 CO 0.05 0.00 -0.06 -0.63 1.18 0.00 0.00 175.17 175.71 1rre s ILE 664 N 1.44 3.68 -0.14 0.77 1.01 -0.39 -2.33 121.20 125.22 1rre s ILE 664 Ca 0.07 -0.43 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 1rre s ILE 664 Cb -0.15 -2.60 0.03 0.00 0.01 0.00 0.00 42.46 39.75 1rre s ILE 664 CO 0.07 0.49 -0.08 -2.28 0.00 0.00 0.00 174.94 173.15 1rre s HIS 665 N 0.47 1.71 -0.27 3.97 2.46 -0.32 -1.36 115.29 121.95 1rre s HIS 665 Ca -0.05 -0.99 -0.08 0.00 0.47 0.00 0.00 55.06 54.42 1rre s HIS 665 Cb -0.15 -1.33 -0.02 0.00 -0.13 0.00 0.00 32.58 30.95 1rre s HIS 665 CO 0.03 -0.59 0.10 0.08 -2.47 0.00 0.00 174.74 171.89 1rre s VAL 666 N 1.63 4.41 -0.03 0.89 1.01 -0.50 -0.55 120.40 127.27 1rre s VAL 666 Ca 0.03 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.82 1rre s VAL 666 Cb -0.14 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.11 1rre s VAL 666 CO -0.08 0.26 -0.17 -2.28 0.00 0.00 0.00 175.10 172.82 1rre s HIS 667 N 1.62 1.61 -0.36 5.22 2.46 -0.56 -1.44 115.29 123.84 1rre s HIS 667 Ca 0.06 -0.39 0.02 0.00 0.47 0.00 0.00 55.06 55.21 1rre s HIS 667 Cb -0.16 -1.06 0.11 0.00 -0.13 0.00 0.00 32.58 31.34 1rre s HIS 667 CO 0.05 -0.10 0.12 0.08 -2.47 0.00 0.00 174.74 172.42 1rre s VAL 668 N -0.15 1.57 0.95 0.89 1.01 -0.90 -0.61 120.40 123.16 1rre s VAL 668 Ca 0.01 -2.09 -0.12 0.00 0.00 0.00 0.00 61.98 59.78 1rre s VAL 668 Cb -0.09 -2.15 0.16 0.00 0.00 0.00 0.00 36.38 34.30 1rre s VAL 668 CO 0.01 -0.71 1.09 -2.84 0.00 0.00 0.00 175.10 172.65 1rre s PRO 669 N 0.98 0.83 0.36 2.72 0.02 -1.25 -4.41 135.00 134.25 1rre s PRO 669 Ca 0.12 0.79 -0.26 0.00 0.02 0.00 0.00 61.00 61.67 1rre s PRO 669 Cb -0.20 -1.76 -0.09 0.00 0.02 0.00 0.00 34.50 32.47 1rre s PRO 669 CO -0.13 -2.53 1.10 -1.21 -0.33 0.00 0.00 177.00 173.91 1rre s GLU 670 N -4.88 4.27 0.38 5.54 2.02 -1.26 -4.33 118.70 120.44 1rre s GLU 670 Ca 0.64 1.71 0.06 0.00 0.02 0.00 0.00 54.97 57.41 1rre s GLU 670 Cb -0.19 -2.78 0.78 0.00 0.10 0.00 0.00 34.13 32.04 1rre s GLU 670 CO 0.58 -0.09 2.00 0.78 0.02 0.00 0.00 175.26 178.55 1rre h GLY 671 N 2.94 0.79 1.79 -1.39 0.00 -1.89 -2.66 103.07 102.65 1rre h GLY 671 Ca -0.48 -0.27 -0.06 0.00 0.00 0.00 0.00 47.33 46.52 1rre h GLY 671 CO 0.64 0.23 -0.46 0.00 0.00 0.00 0.00 176.54 176.94 1rre h ALA 672 N 1.65 0.77 -2.03 3.60 0.00 -1.92 -3.30 119.26 118.03 1rre h ALA 672 Ca 0.25 -0.28 -0.58 0.00 0.00 0.00 0.00 54.91 54.30 1rre h ALA 672 Cb 0.12 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1rre h ALA 672 CO -0.07 0.35 0.81 0.99 0.00 0.00 0.00 179.25 181.34 1rre s THR 673 N -3.09 4.61 0.27 0.00 2.01 -1.01 -4.97 115.64 113.46 1rre s THR 673 Ca 0.04 1.90 -0.30 0.00 0.31 0.00 0.00 61.69 63.64 1rre s THR 673 Cb 0.07 -4.35 -0.13 0.00 0.01 0.00 0.00 72.50 68.10 1rre s THR 673 CO 0.73 -0.30 1.42 -2.65 -0.69 0.00 0.00 174.62 173.12 1rre n PRO 674 N 6.54 2.17 -3.93 4.92 -0.02 -1.26 -4.56 135.00 138.86 1rre n PRO 674 Ca 0.12 0.77 -0.11 0.00 -2.02 0.00 0.00 63.50 62.25 1rre n PRO 674 Cb 0.46 -2.43 -0.13 0.00 -0.02 0.00 0.00 33.50 31.38 1rre n PRO 674 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1rre s LYS 675 N -0.71 0.14 0.29 -0.52 1.02 -0.84 -2.74 119.74 116.38 1rre s LYS 675 Ca 0.65 -0.22 -0.16 0.00 0.02 0.00 0.00 55.97 56.27 1rre s LYS 675 Cb -0.61 -0.01 0.06 0.00 -0.52 0.00 0.00 37.83 36.75 1rre s LYS 675 CO 0.52 -0.00 0.79 -3.47 -0.92 0.00 0.00 175.35 172.27 1rre n ASP 676 N 2.59 -1.89 0.00 2.83 -0.08 -1.19 -0.23 116.55 118.58 1rre n ASP 676 Ca -0.16 -2.21 0.00 0.00 -1.51 0.00 0.00 54.79 50.91 1rre n ASP 676 Cb 0.58 3.12 0.00 0.00 2.34 0.00 0.00 41.12 47.16 1rre n ASP 676 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rre n GLY 677 N -0.55 0.06 0.68 0.27 0.00 -1.26 -3.81 105.19 100.59 1rre n GLY 677 Ca -0.06 -1.77 0.11 0.00 0.00 0.00 0.00 46.02 44.31 1rre n GLY 677 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rre n PRO 678 N 0.21 1.90 0.00 1.61 -0.04 -1.26 -4.58 135.00 132.84 1rre n PRO 678 Ca 0.00 -1.35 0.13 0.00 -0.04 0.00 0.00 63.50 62.25 1rre n PRO 678 Cb 0.00 -1.43 0.69 0.00 -0.04 0.00 0.00 33.50 32.72 1rre n PRO 678 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rre n ALA 679 N 0.58 2.36 1.17 0.55 0.00 -1.26 -2.55 120.51 121.36 1rre n ALA 679 Ca 0.17 -0.13 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1rre n ALA 679 Cb 0.40 -1.45 0.31 0.00 0.00 0.00 0.00 19.45 18.71 1rre n ALA 679 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rre n ALA 680 N -1.29 2.51 -0.22 0.00 0.00 -1.26 -1.11 120.51 119.15 1rre n ALA 680 Ca 0.13 -0.60 0.02 0.00 0.00 0.00 0.00 53.44 52.99 1rre n ALA 680 Cb 0.22 -0.99 0.12 0.00 0.00 0.00 0.00 19.45 18.80 1rre n ALA 680 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1rre h GLY 681 N 4.78 0.72 1.69 0.00 0.00 -1.32 -1.68 103.07 107.26 1rre h GLY 681 Ca 0.00 0.08 -0.15 0.00 0.00 0.00 0.00 47.33 47.26 1rre h GLY 681 CO 0.00 -0.21 -0.58 0.16 0.00 0.00 0.00 176.54 175.91 1rre h ILE 682 N 0.13 1.36 0.00 2.60 3.07 -1.64 -1.35 117.51 121.68 1rre h ILE 682 Ca 0.34 -1.90 0.00 0.00 1.55 0.00 0.00 64.86 64.85 1rre h ILE 682 Cb 0.57 1.92 0.00 0.00 -0.27 0.00 0.00 36.82 39.04 1rre h ILE 682 CO -0.55 0.57 0.00 0.00 -1.05 0.00 0.00 178.15 177.12 1rre n ALA 683 N -2.48 1.48 0.00 0.16 0.00 -0.63 -0.99 120.51 118.04 1rre n ALA 683 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1rre n ALA 683 Cb 0.61 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1rre n ALA 683 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rre h THR 686 N 0.00 1.21 -0.90 0.00 2.02 -1.33 -0.31 112.91 113.60 1rre h THR 686 Ca 0.00 -0.69 0.05 0.00 0.77 0.00 0.00 66.41 66.54 1rre h THR 686 Cb 0.00 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1rre h THR 686 CO 0.00 0.23 0.59 0.00 0.37 0.00 0.00 175.52 176.71 1rre h ALA 687 N 0.90 1.48 -0.03 6.16 0.00 -1.01 -1.30 119.26 125.46 1rre h ALA 687 Ca 0.09 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1rre h ALA 687 Cb 0.27 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1rre h ALA 687 CO -0.00 0.41 -0.18 -0.07 0.00 0.00 0.00 179.25 179.40 1rre h LEU 688 N 1.07 0.22 -0.32 0.00 3.38 -1.68 -2.36 115.31 115.62 1rre h LEU 688 Ca 0.38 -0.68 0.03 0.00 0.09 0.00 0.00 57.88 57.70 1rre h LEU 688 Cb 0.12 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1rre h LEU 688 CO -0.13 0.86 0.14 1.62 0.09 0.00 0.00 178.44 181.01 1rre h VAL 689 N -0.41 0.95 -0.40 1.22 3.04 -0.90 -2.31 116.25 117.44 1rre h VAL 689 Ca -0.01 -0.10 0.08 0.00 -1.01 0.00 0.00 66.70 65.66 1rre h VAL 689 Cb 0.86 0.63 -0.09 0.00 -2.01 0.00 0.00 31.29 30.68 1rre h VAL 689 CO 0.04 0.05 -0.26 -1.28 -1.01 0.00 0.00 177.57 175.12 1rre h SER 690 N 0.29 -0.86 -0.49 3.17 0.87 -1.26 -1.88 113.55 113.39 1rre h SER 690 Ca 0.14 0.17 0.03 0.00 -1.23 0.00 0.00 61.79 60.90 1rre h SER 690 Cb 0.08 0.43 -0.03 0.00 -0.44 0.00 0.00 62.40 62.44 1rre h SER 690 CO -0.12 -0.28 0.29 0.00 -0.53 0.00 0.00 176.83 176.20 1rre h LEU 692 N 0.57 0.00 0.00 0.00 3.38 -1.18 -3.23 115.31 114.85 1rre h LEU 692 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1rre h LEU 692 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1rre h LEU 692 CO -0.10 0.00 -1.11 0.35 0.09 0.00 0.00 178.44 177.67 1rre n THR 693 N -2.65 0.00 -1.21 0.22 -2.24 -0.73 -4.88 114.28 102.79 1rre n THR 693 Ca 0.04 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.50 1rre n THR 693 Cb 0.44 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 69.25 1rre n THR 693 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rre n GLY 694 N 1.50 0.88 3.57 3.38 0.00 0.11 -5.00 105.19 109.65 1rre n GLY 694 Ca 0.00 -0.37 -0.42 0.00 0.00 0.00 0.00 46.02 45.23 1rre n GLY 694 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rre s ASN 695 N -2.60 6.51 0.38 1.61 3.84 -0.95 -4.93 114.94 118.80 1rre s ASN 695 Ca 0.00 0.22 -0.28 0.00 0.21 0.00 0.00 52.86 53.01 1rre s ASN 695 Cb 0.00 -2.40 -0.11 0.00 -0.55 0.00 0.00 41.25 38.19 1rre s ASN 695 CO 0.00 -0.80 1.50 -2.65 -2.79 0.00 0.00 177.10 172.36 1rre n PRO 696 N 6.54 2.69 -2.82 0.43 -0.02 -1.26 -4.50 135.00 136.06 1rre n PRO 696 Ca 0.03 0.94 -0.40 0.00 -2.02 0.00 0.00 63.50 62.05 1rre n PRO 696 Cb 0.48 -2.68 -0.05 0.00 -0.02 0.00 0.00 33.50 31.23 1rre n PRO 696 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1rre s VAL 697 N -1.08 4.44 0.06 -1.45 1.01 -0.76 -1.42 120.40 121.20 1rre s VAL 697 Ca 0.53 1.93 -0.30 0.00 0.00 0.00 0.00 61.98 64.14 1rre s VAL 697 Cb -0.47 -4.26 -0.09 0.00 0.00 0.00 0.00 36.38 31.56 1rre s VAL 697 CO 0.63 0.39 1.87 -0.13 0.00 0.00 0.00 175.10 177.87 1rre s ARG 698 N -0.41 4.15 0.49 2.72 3.00 0.70 -4.84 118.95 124.76 1rre s ARG 698 Ca 0.42 2.55 0.28 0.00 0.00 0.00 0.00 55.73 58.99 1rre s ARG 698 Cb -0.23 -3.91 0.84 0.00 0.00 0.00 0.00 34.95 31.65 1rre s ARG 698 CO 0.28 -0.89 1.79 0.00 0.00 0.00 0.00 175.30 176.48 1rre h ALA 699 N 9.65 0.99 -0.03 2.13 0.00 -1.93 -2.90 119.26 127.17 1rre h ALA 699 Ca -0.47 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1rre h ALA 699 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1rre h ALA 699 CO 0.94 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 179.82 1rre n ASP 700 N -3.11 0.42 -4.48 0.00 5.68 -1.26 -4.85 116.55 108.95 1rre n ASP 700 Ca 0.02 -1.40 -0.33 0.00 -0.50 0.00 0.00 54.79 52.58 1rre n ASP 700 Cb 0.43 -0.02 -0.13 0.00 -1.14 0.00 0.00 41.12 40.26 1rre n ASP 700 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1rre s VAL 701 N -1.96 3.64 0.33 2.12 1.01 -1.10 -1.95 120.40 122.49 1rre s VAL 701 Ca 0.33 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1rre s VAL 701 Cb 0.16 -2.56 0.02 0.00 0.00 0.00 0.00 36.38 33.99 1rre s VAL 701 CO 0.26 0.52 0.14 0.00 0.00 0.00 0.00 175.10 176.02 1rre n ALA 702 N 3.35 0.41 0.00 5.51 0.00 -0.06 -4.28 120.51 125.43 1rre n ALA 702 Ca -0.18 -1.41 0.00 0.00 0.00 0.00 0.00 53.44 51.85 1rre n ALA 702 Cb 0.53 0.67 0.00 0.00 0.00 0.00 0.00 19.45 20.65 1rre n ALA 702 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1rre n THR 704 N -1.08 0.00 0.00 0.00 5.66 -0.88 -1.37 114.28 116.61 1rre n THR 704 Ca -0.07 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1rre n THR 704 Cb 0.40 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.18 1rre n THR 704 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rre n GLY 705 N -0.13 3.07 3.75 1.09 0.00 -0.26 -3.92 105.19 108.78 1rre n GLY 705 Ca 0.00 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1rre n GLY 705 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rre s GLU 706 N -0.04 4.74 0.15 1.61 2.12 -0.94 -1.91 118.70 124.43 1rre s GLU 706 Ca 0.00 1.40 0.04 0.00 0.36 0.00 0.00 54.97 56.77 1rre s GLU 706 Cb 0.00 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 31.03 1rre s GLU 706 CO 0.00 0.40 0.14 -1.50 -0.54 0.00 0.00 175.26 173.77 1rre s ILE 707 N -0.68 4.59 0.30 -3.70 2.07 -1.26 -0.43 121.20 122.09 1rre s ILE 707 Ca 0.42 -0.99 0.11 0.00 -1.41 0.00 0.00 60.65 58.79 1rre s ILE 707 Cb -0.24 -3.33 -0.05 0.00 0.13 0.00 0.00 42.46 38.97 1rre s ILE 707 CO 0.30 -0.07 -0.17 0.42 -1.91 0.00 0.00 174.94 173.50 1rre s THR 708 N -1.70 2.42 0.48 4.00 -4.23 -0.79 -4.91 115.64 110.92 1rre s THR 708 Ca 0.31 -2.36 0.19 0.00 -1.18 0.00 0.00 61.69 58.65 1rre s THR 708 Cb -0.10 -2.39 0.35 0.00 1.34 0.00 0.00 72.50 71.70 1rre s THR 708 CO 0.24 -0.35 2.00 -0.07 -0.54 0.00 0.00 174.62 175.90 1rre h LEU 709 N 2.21 0.18 0.00 4.79 3.38 -1.90 0.19 115.31 124.15 1rre h LEU 709 Ca -0.40 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1rre h LEU 709 Cb 1.26 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.98 1rre h LEU 709 CO 0.63 0.10 0.00 0.54 0.09 0.00 0.00 178.44 179.80 1rre n ARG 710 N -4.44 0.49 -0.58 1.13 5.12 -1.26 -4.69 116.66 112.42 1rre n ARG 710 Ca 0.09 0.02 0.00 0.00 -1.93 0.00 0.00 57.85 56.03 1rre n ARG 710 Cb 0.45 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.25 1rre n ARG 710 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1rre n GLY 711 N 1.00 0.73 3.82 -0.13 0.00 0.67 -4.96 105.19 106.32 1rre n GLY 711 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1rre n GLY 711 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rre s GLN 712 N -0.42 3.63 -0.24 1.61 -0.21 -1.26 -0.16 119.66 122.61 1rre s GLN 712 Ca 0.00 1.09 -0.05 0.00 0.02 0.00 0.00 55.36 56.42 1rre s GLN 712 Cb 0.00 -2.08 -0.01 0.00 1.00 0.00 0.00 33.01 31.92 1rre s GLN 712 CO 0.00 -0.55 0.01 0.08 -2.12 0.00 0.00 175.29 172.71 1rre s VAL 713 N -2.52 3.71 0.13 1.09 1.01 -0.22 -1.89 120.40 121.71 1rre s VAL 713 Ca 0.62 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 62.16 1rre s VAL 713 Cb -0.13 -2.75 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1rre s VAL 713 CO 0.34 0.34 0.27 -0.76 0.00 0.00 0.00 175.10 175.28 1rre s LEU 714 N 1.52 4.34 0.53 3.92 1.43 0.43 -4.70 118.68 126.15 1rre s LEU 714 Ca 0.05 0.22 -0.21 0.00 -1.03 0.00 0.00 54.13 53.16 1rre s LEU 714 Cb -0.15 -2.94 -0.05 0.00 0.03 0.00 0.00 46.19 43.07 1rre s LEU 714 CO -0.01 0.08 1.24 -2.16 0.23 0.00 0.00 176.35 175.74 1rre s PRO 715 N -3.02 3.30 0.45 1.29 0.04 -1.26 -2.20 135.00 133.59 1rre s PRO 715 Ca 0.35 1.95 0.02 0.00 0.04 0.00 0.00 61.00 63.35 1rre s PRO 715 Cb -0.12 -2.20 0.02 0.00 0.04 0.00 0.00 34.50 32.24 1rre s PRO 715 CO 0.28 -0.97 0.17 0.44 0.04 0.00 0.00 177.00 176.96 1rre n ILE 716 N -1.02 0.00 -4.06 0.56 -6.64 -1.26 -4.74 119.36 102.20 1rre n ILE 716 Ca 0.10 -1.96 -0.27 0.00 -1.77 0.00 0.00 62.75 58.86 1rre n ILE 716 Cb 0.47 0.17 -0.04 0.00 -1.44 0.00 0.00 39.64 38.81 1rre n ILE 716 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 1rre s GLY 717 N -3.60 2.45 -1.65 3.28 0.00 -1.26 -4.78 107.32 101.76 1rre s GLY 717 Ca 0.13 -1.36 -0.00 0.00 0.00 0.00 0.00 44.72 43.48 1rre s GLY 717 CO 0.08 -1.96 0.01 0.61 0.00 0.00 0.00 173.10 171.84 1rre n GLY 718 N -1.54 -0.43 0.26 0.20 0.00 -1.26 -4.91 105.19 97.51 1rre n GLY 718 Ca -0.04 -0.07 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 1rre n GLY 718 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rre h LEU 719 N -0.01 0.54 -0.80 0.99 5.85 -1.97 -1.07 115.31 118.83 1rre h LEU 719 Ca -0.46 0.03 0.07 0.00 0.84 0.00 0.00 57.88 58.37 1rre h LEU 719 Cb 1.34 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 42.23 1rre h LEU 719 CO 0.54 0.35 0.47 0.50 -0.34 0.00 0.00 178.44 179.96 1rre h LYS 720 N 0.67 0.82 -0.01 1.25 3.64 -1.90 0.55 116.57 121.58 1rre h LYS 720 Ca 0.29 -0.05 -0.24 0.00 -1.27 0.00 0.00 60.65 59.38 1rre h LYS 720 Cb 0.18 -0.18 0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1rre h LYS 720 CO -0.18 0.54 -0.97 0.93 -2.27 0.00 0.00 179.45 177.49 1rre h GLU 721 N 0.84 0.57 -0.60 1.90 3.07 -1.76 -2.63 114.58 115.97 1rre h GLU 721 Ca 0.37 -0.60 -0.05 0.00 -0.50 0.00 0.00 59.36 58.58 1rre h GLU 721 Cb 0.25 0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 28.30 1rre h GLU 721 CO -0.20 1.22 0.19 0.87 -1.40 0.00 0.00 179.01 179.69 1rre h LYS 722 N 0.33 0.94 -0.17 2.33 1.57 -0.70 -1.80 116.57 119.07 1rre h LYS 722 Ca -0.10 -0.20 -0.16 0.00 -1.87 0.00 0.00 60.65 58.32 1rre h LYS 722 Cb 1.62 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 33.78 1rre h LYS 722 CO 0.18 0.83 -0.55 -0.07 -0.57 0.00 0.00 179.45 179.27 1rre h LEU 723 N 0.86 0.55 -0.63 2.94 4.07 -0.92 -2.33 115.31 119.85 1rre h LEU 723 Ca 0.20 -0.29 -0.04 0.00 0.08 0.00 0.00 57.88 57.82 1rre h LEU 723 Cb 0.28 -0.16 -0.03 0.00 1.08 0.00 0.00 40.66 41.84 1rre h LEU 723 CO -0.01 0.99 0.22 0.25 -1.08 0.00 0.00 178.44 178.82 1rre h LEU 724 N 0.38 0.89 -0.61 1.67 5.85 -1.40 0.17 115.31 122.27 1rre h LEU 724 Ca 0.01 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.61 1rre h LEU 724 Cb 1.08 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.82 1rre h LEU 724 CO 0.10 0.84 0.28 0.00 -0.34 0.00 0.00 178.44 179.32 1rre h ALA 725 N 1.08 0.80 -0.32 1.25 0.00 -1.04 -1.65 119.26 119.38 1rre h ALA 725 Ca 0.21 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 55.08 1rre h ALA 725 Cb 0.25 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1rre h ALA 725 CO -0.01 -0.11 -0.17 0.00 0.00 0.00 0.00 179.25 178.95 1rre h ALA 726 N 1.38 1.11 0.09 0.00 0.00 -0.80 -0.97 119.26 120.08 1rre h ALA 726 Ca 0.29 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1rre h ALA 726 Cb 0.30 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1rre h ALA 726 CO -0.25 0.55 -0.04 1.25 0.00 0.00 0.00 179.25 180.76 1rre h HIS 727 N 0.52 -0.12 -0.69 0.00 6.17 -0.27 -2.33 115.15 118.43 1rre h HIS 727 Ca 0.09 -0.00 0.01 0.00 0.71 0.00 0.00 60.37 61.18 1rre h HIS 727 Cb 0.60 0.04 -0.04 0.00 2.52 0.00 0.00 27.41 30.53 1rre h HIS 727 CO 0.02 0.30 0.46 -0.09 0.71 0.00 0.00 177.93 179.33 1rre h ARG 728 N -0.58 0.88 -0.10 5.26 2.43 -1.31 -3.20 114.38 117.77 1rre h ARG 728 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 1rre h ARG 728 Cb 0.47 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 1rre h ARG 728 CO 0.02 0.58 0.00 0.41 -1.51 0.00 0.00 179.97 179.48 1rre n GLY 729 N -1.43 0.22 1.05 2.80 0.00 -0.37 -4.94 105.19 102.53 1rre n GLY 729 Ca 0.08 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1rre n GLY 729 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rre n GLY 730 N 1.17 0.74 3.77 -0.02 0.00 -1.11 -5.02 105.19 104.72 1rre n GLY 730 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.80 1rre n GLY 730 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rre s ILE 731 N -2.47 3.24 -0.18 -0.61 1.01 -0.90 -4.97 121.20 116.32 1rre s ILE 731 Ca 0.00 1.16 0.04 0.00 0.00 0.00 0.00 60.65 61.85 1rre s ILE 731 Cb 0.00 -3.71 -0.22 0.00 0.01 0.00 0.00 42.46 38.54 1rre s ILE 731 CO 0.00 0.21 0.11 0.29 0.00 0.00 0.00 174.94 175.55 1rre n LYS 732 N 0.69 0.69 -4.97 2.79 5.02 -0.89 -4.75 118.16 116.73 1rre n LYS 732 Ca 0.01 0.17 -0.28 0.00 -2.02 0.00 0.00 58.31 56.19 1rre n LYS 732 Cb 0.45 -1.61 -0.16 0.00 -0.02 0.00 0.00 35.03 33.69 1rre n LYS 732 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1rre s THR 733 N -2.54 1.66 -0.07 -0.18 2.01 -0.82 -0.34 115.64 115.35 1rre s THR 733 Ca -0.23 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 60.97 1rre s THR 733 Cb 0.08 -1.43 0.01 0.00 0.01 0.00 0.00 72.50 71.17 1rre s THR 733 CO 0.72 0.47 -0.13 -0.69 -0.69 0.00 0.00 174.62 174.30 1rre s VAL 734 N 0.17 1.22 -0.21 3.82 1.01 -0.22 -0.88 120.40 125.31 1rre s VAL 734 Ca -0.09 -0.52 -0.13 0.00 0.00 0.00 0.00 61.98 61.24 1rre s VAL 734 Cb -0.14 -1.12 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 1rre s VAL 734 CO 0.04 0.38 0.27 -0.76 0.00 0.00 0.00 175.10 175.03 1rre s LEU 735 N 0.72 4.15 0.14 3.92 1.43 -0.47 -1.10 118.68 127.47 1rre s LEU 735 Ca -0.13 0.33 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 1rre s LEU 735 Cb -0.16 -2.30 -0.04 0.00 0.03 0.00 0.00 46.19 43.72 1rre s LEU 735 CO 0.03 0.02 -0.13 0.27 0.23 0.00 0.00 176.35 176.77 1rre s ILE 736 N 1.04 1.37 0.31 -0.59 -4.36 -0.88 -2.08 121.20 116.01 1rre s ILE 736 Ca 0.13 -1.87 -0.29 0.00 -0.26 0.00 0.00 60.65 58.37 1rre s ILE 736 Cb -0.14 -1.68 -0.10 0.00 1.25 0.00 0.00 42.46 41.79 1rre s ILE 736 CO 0.05 -0.51 1.27 -2.84 0.24 0.00 0.00 174.94 173.15 1rre s PRO 737 N -3.04 4.41 0.31 0.37 0.02 -1.25 0.26 135.00 136.08 1rre s PRO 737 Ca 0.13 2.13 0.07 0.00 0.02 0.00 0.00 61.00 63.34 1rre s PRO 737 Cb -0.03 -3.10 0.86 0.00 0.02 0.00 0.00 34.50 32.25 1rre s PRO 737 CO 0.03 -0.11 1.64 0.35 -0.33 0.00 0.00 177.00 178.58 1rre h PHE 738 N 3.57 0.52 0.00 6.54 3.57 -1.09 -0.38 116.94 129.67 1rre h PHE 738 Ca -0.48 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.06 1rre h PHE 738 Cb 1.22 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.88 1rre h PHE 738 CO 0.57 -0.23 0.00 -1.91 -2.23 0.00 0.00 178.31 174.51 1rre n GLU 739 N -5.19 0.39 0.00 1.11 4.07 -1.26 -2.04 120.64 117.72 1rre n GLU 739 Ca 0.25 0.03 0.14 0.00 -0.06 0.00 0.00 57.16 57.52 1rre n GLU 739 Cb 0.81 -1.50 0.57 0.00 -0.06 0.00 0.00 31.44 31.26 1rre n GLU 739 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1rre n ASN 740 N -1.29 0.97 -0.23 4.31 4.13 -0.15 -4.35 115.26 118.64 1rre n ASN 740 Ca 0.13 -1.09 0.04 0.00 1.68 0.00 0.00 54.58 55.34 1rre n ASN 740 Cb 0.22 0.01 0.15 0.00 -1.54 0.00 0.00 39.78 38.62 1rre n ASN 740 CO 0.00 0.00 0.00 0.50 0.28 0.00 0.00 177.26 178.04 1rre h LYS 741 N 1.39 0.16 -0.21 3.52 3.11 -1.49 -0.21 116.57 122.84 1rre h LYS 741 Ca 0.00 -0.01 0.06 0.00 -2.81 0.00 0.00 60.65 57.89 1rre h LYS 741 Cb 0.40 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 31.59 1rre h LYS 741 CO 0.00 0.11 0.36 0.07 -2.81 0.00 0.00 179.45 177.17 1rre h ARG 742 N 0.17 0.00 0.00 1.90 0.11 -1.83 -2.01 114.38 112.71 1rre h ARG 742 Ca 0.38 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.46 1rre h ARG 742 Cb 0.65 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.73 1rre h ARG 742 CO -0.56 0.00 -0.34 -0.44 0.10 0.00 0.00 179.97 178.74 1rre h ASP 743 N 0.00 0.00 0.35 0.08 3.45 -1.33 -3.22 116.42 115.76 1rre h ASP 743 Ca 0.10 -0.00 -0.03 0.00 0.43 0.00 0.00 57.03 57.53 1rre h ASP 743 Cb 0.81 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 39.58 1rre h ASP 743 CO -0.00 0.00 -0.14 -0.07 -1.57 0.00 0.00 179.24 177.46 1rre h LEU 744 N 0.00 0.00 -0.95 1.55 3.38 -1.40 -3.19 115.31 114.70 1rre h LEU 744 Ca 0.00 0.00 0.09 0.00 0.09 0.00 0.00 57.88 58.06 1rre h LEU 744 Cb 0.99 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 1rre h LEU 744 CO 0.00 0.14 0.59 -0.08 0.09 0.00 0.00 178.44 179.18 1rre h GLU 745 N 0.00 0.98 -0.60 1.13 4.57 -1.71 -2.42 114.58 116.53 1rre h GLU 745 Ca -0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 1rre h GLU 745 Cb 0.36 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.72 1rre h GLU 745 CO 0.02 0.65 0.00 0.39 -1.18 0.00 0.00 179.01 178.89 1rre n GLU 746 N -4.61 4.13 -3.57 1.92 4.71 -1.20 -4.91 120.64 117.10 1rre n GLU 746 Ca 0.16 -2.99 -0.38 0.00 -0.01 0.00 0.00 57.16 53.95 1rre n GLU 746 Cb 0.26 -2.02 -0.06 0.00 -1.01 0.00 0.00 31.44 28.61 1rre n GLU 746 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1rre s ILE 747 N -2.23 5.12 0.35 -3.67 1.01 -0.91 -5.04 121.20 115.83 1rre s ILE 747 Ca 0.52 0.70 -0.29 0.00 0.00 0.00 0.00 60.65 61.58 1rre s ILE 747 Cb 0.36 -3.65 -0.11 0.00 0.01 0.00 0.00 42.46 39.07 1rre s ILE 747 CO 0.21 0.57 1.53 -2.65 0.00 0.00 0.00 174.94 174.59 1rre n PRO 748 N 1.78 2.71 -0.27 2.79 -0.02 -1.26 -4.90 135.00 135.83 1rre n PRO 748 Ca -0.15 0.95 0.04 0.00 -2.02 0.00 0.00 63.50 62.33 1rre n PRO 748 Cb 0.53 -2.71 0.18 0.00 -0.02 0.00 0.00 33.50 31.48 1rre n PRO 748 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1rre h ASP 749 N 3.51 0.47 0.38 2.55 3.32 -1.95 -2.59 116.42 122.11 1rre h ASP 749 Ca -0.50 0.08 -0.07 0.00 0.02 0.00 0.00 57.03 56.56 1rre h ASP 749 Cb 1.24 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.78 1rre h ASP 749 CO 0.69 0.23 -0.32 -0.55 -1.72 0.00 0.00 179.24 177.57 1rre h ASN 750 N 0.60 0.00 0.35 6.45 -1.07 -1.99 0.37 115.58 120.29 1rre h ASN 750 Ca 0.40 0.00 -0.17 0.00 0.07 0.00 0.00 56.30 56.60 1rre h ASN 750 Cb 0.50 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.75 1rre h ASN 750 CO -0.32 0.32 -0.71 1.62 0.07 0.00 0.00 177.43 178.41 1rre h VAL 751 N 0.00 1.40 0.00 6.14 3.04 -1.84 -3.28 116.25 121.71 1rre h VAL 751 Ca -0.00 -2.17 0.00 0.00 -1.01 0.00 0.00 66.70 63.52 1rre h VAL 751 Cb 0.60 2.14 0.00 0.00 -2.01 0.00 0.00 31.29 32.01 1rre h VAL 751 CO 0.04 0.64 -1.08 -0.38 -1.01 0.00 0.00 177.57 175.78 1rre n ILE 752 N -3.82 0.33 0.17 3.17 2.08 -0.90 -4.20 119.36 116.18 1rre n ILE 752 Ca -0.03 -0.38 0.02 0.00 0.56 0.00 0.00 62.75 62.92 1rre n ILE 752 Cb 0.69 -0.05 0.37 0.00 -0.75 0.00 0.00 39.64 39.91 1rre n ILE 752 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1rre h ALA 753 N 2.29 1.43 0.00 -1.39 0.00 -0.34 -2.65 119.26 118.59 1rre h ALA 753 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1rre h ALA 753 Cb 0.85 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1rre h ALA 753 CO 0.00 0.42 -0.24 -3.47 0.00 0.00 0.00 179.25 175.96 1rre n ASP 754 N -4.16 0.56 -4.71 0.00 2.03 -1.26 -4.90 116.55 104.12 1rre n ASP 754 Ca -0.02 0.33 -0.35 0.00 0.52 0.00 0.00 54.79 55.27 1rre n ASP 754 Cb 0.37 -0.33 -0.09 0.00 -0.72 0.00 0.00 41.12 40.34 1rre n ASP 754 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1rre s LEU 755 N -3.91 3.66 -0.64 -2.67 1.43 -1.00 -4.87 118.68 110.67 1rre s LEU 755 Ca 0.10 0.15 -0.22 0.00 -1.03 0.00 0.00 54.13 53.13 1rre s LEU 755 Cb 0.15 -1.90 0.08 0.00 0.03 0.00 0.00 46.19 44.54 1rre s LEU 755 CO 0.63 0.36 0.91 -0.62 0.23 0.00 0.00 176.35 177.86 1rre s ASP 756 N -1.07 6.17 -0.28 2.29 2.15 0.53 -4.99 116.67 121.47 1rre s ASP 756 Ca 0.15 -1.08 -0.11 0.00 0.43 0.00 0.00 52.55 51.94 1rre s ASP 756 Cb -0.11 -2.39 -0.04 0.00 -0.30 0.00 0.00 42.92 40.07 1rre s ASP 756 CO 0.05 -1.38 0.18 -0.63 -0.17 0.00 0.00 175.17 173.22 1rre s ILE 757 N 3.78 5.20 -0.40 4.11 1.01 -1.26 -1.05 121.20 132.58 1rre s ILE 757 Ca 0.20 0.10 -0.05 0.00 0.00 0.00 0.00 60.65 60.90 1rre s ILE 757 Cb -0.18 -3.49 0.09 0.00 0.01 0.00 0.00 42.46 38.89 1rre s ILE 757 CO 0.09 0.24 0.20 -1.00 0.00 0.00 0.00 174.94 174.47 1rre s HIS 758 N 1.74 3.47 0.16 3.97 3.76 -0.26 -4.99 115.29 123.15 1rre s HIS 758 Ca 0.07 -2.08 -0.30 0.00 -0.15 0.00 0.00 55.06 52.59 1rre s HIS 758 Cb -0.16 -3.02 -0.08 0.00 1.11 0.00 0.00 32.58 30.43 1rre s HIS 758 CO 0.10 -0.92 1.22 -2.14 -0.85 0.00 0.00 174.74 172.15 1rre s PRO 759 N 1.24 4.46 0.05 8.40 0.02 -1.26 -2.07 135.00 145.84 1rre s PRO 759 Ca 0.05 1.89 0.05 0.00 0.02 0.00 0.00 61.00 63.01 1rre s PRO 759 Cb -0.23 -3.25 -0.02 0.00 0.02 0.00 0.00 34.50 31.01 1rre s PRO 759 CO -0.02 -0.15 -0.15 0.14 -0.33 0.00 0.00 177.00 176.49 1rre s VAL 760 N 0.22 1.16 -0.18 3.83 -7.23 0.14 -4.71 120.40 113.63 1rre s VAL 760 Ca 0.55 -1.12 0.16 0.00 -1.81 0.00 0.00 61.98 59.76 1rre s VAL 760 Cb -0.33 -1.07 -0.22 0.00 0.56 0.00 0.00 36.38 35.32 1rre s VAL 760 CO 0.35 -0.05 0.05 0.29 -0.31 0.00 0.00 175.10 175.43 1rre n LYS 761 N 1.68 1.03 -4.07 4.82 5.02 -1.26 -0.53 118.16 124.86 1rre n LYS 761 Ca -0.19 -0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 55.99 1rre n LYS 761 Cb 0.54 -1.46 -0.11 0.00 -0.02 0.00 0.00 35.03 33.98 1rre n LYS 761 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1rre s ARG 762 N -2.44 0.54 0.50 1.97 0.52 -1.26 -1.06 118.95 117.73 1rre s ARG 762 Ca -0.10 -0.87 0.17 0.00 -0.52 0.00 0.00 55.73 54.41 1rre s ARG 762 Cb 0.05 -0.13 1.23 0.00 0.52 0.00 0.00 34.95 36.62 1rre s ARG 762 CO 0.74 -0.00 2.11 0.97 0.02 0.00 0.00 175.30 179.13 1rre h ILE 763 N 4.12 1.00 -0.67 1.52 6.09 -0.88 -2.69 117.51 126.00 1rre h ILE 763 Ca -0.35 -0.19 -0.00 0.00 -1.37 0.00 0.00 64.86 62.96 1rre h ILE 763 Cb 1.19 1.10 -0.03 0.00 0.47 0.00 0.00 36.82 39.55 1rre h ILE 763 CO 0.48 0.05 0.41 -0.33 -3.07 0.00 0.00 178.15 175.69 1rre h GLU 764 N 0.00 0.90 0.01 2.19 3.07 -1.97 0.34 114.58 119.12 1rre h GLU 764 Ca -0.00 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 58.78 1rre h GLU 764 Cb 0.10 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1rre h GLU 764 CO 0.01 0.63 -0.00 0.93 -1.40 0.00 0.00 179.01 179.18 1rre h GLU 765 N 0.91 -0.01 -0.73 2.33 5.08 -1.90 -1.84 114.58 118.42 1rre h GLU 765 Ca 0.24 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.74 1rre h GLU 765 Cb -0.05 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.11 1rre h GLU 765 CO -0.05 0.03 0.26 0.28 -1.00 0.00 0.00 179.01 178.53 1rre h VAL 766 N -0.04 0.63 -0.05 3.13 2.07 -1.21 -2.11 116.25 118.67 1rre h VAL 766 Ca -0.00 -0.13 -0.24 0.00 0.82 0.00 0.00 66.70 67.15 1rre h VAL 766 Cb 0.04 0.20 0.02 0.00 -1.52 0.00 0.00 31.29 30.03 1rre h VAL 766 CO 0.00 0.07 -0.89 -0.07 0.02 0.00 0.00 177.57 176.70 1rre h LEU 767 N 0.39 0.87 -0.63 2.57 3.38 -0.80 -1.41 115.31 119.69 1rre h LEU 767 Ca 0.40 -0.70 0.11 0.00 0.09 0.00 0.00 57.88 57.78 1rre h LEU 767 Cb 0.63 -0.26 -0.09 0.00 0.09 0.00 0.00 40.66 41.03 1rre h LEU 767 CO -0.42 1.45 0.17 0.74 0.09 0.00 0.00 178.44 180.47 1rre h THR 768 N 0.37 0.66 0.00 0.22 2.02 -1.12 -2.27 112.91 112.79 1rre h THR 768 Ca -0.10 -0.11 -0.04 0.00 0.77 0.00 0.00 66.41 66.94 1rre h THR 768 Cb 1.55 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1rre h THR 768 CO 0.18 0.06 -0.27 -0.07 0.37 0.00 0.00 175.52 175.78 1rre h LEU 769 N 0.31 0.00 0.01 2.58 3.38 -1.30 -3.37 115.31 116.92 1rre h LEU 769 Ca 0.33 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.94 1rre h LEU 769 Cb 0.48 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.17 1rre h LEU 769 CO -0.39 0.17 -2.26 0.00 0.09 0.00 0.00 178.44 176.04 1rre n ALA 770 N -2.15 1.41 -2.45 1.53 0.00 -0.54 -4.93 120.51 113.38 1rre n ALA 770 Ca 0.03 -1.09 -0.28 0.00 0.00 0.00 0.00 53.44 52.09 1rre n ALA 770 Cb 0.60 -0.32 -0.03 0.00 0.00 0.00 0.00 19.45 19.71 1rre n ALA 770 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rre s LEU 771 N -6.08 3.98 -0.06 0.00 1.43 -0.86 -0.21 118.68 116.87 1rre s LEU 771 Ca -0.18 0.78 -0.25 0.00 -1.03 0.00 0.00 54.13 53.45 1rre s LEU 771 Cb 0.07 -3.63 -0.23 0.00 0.03 0.00 0.00 46.19 42.43 1rre s LEU 771 CO 0.75 -0.27 1.01 -0.61 0.23 0.00 0.00 176.35 177.46 1rre h GLN 772 N 1.39 0.12 -5.93 1.70 4.15 -1.54 -3.45 115.11 111.55 1rre h GLN 772 Ca -0.48 -0.12 -0.65 0.00 0.77 0.00 0.00 58.65 58.17 1rre h GLN 772 Cb 1.19 0.03 -0.08 0.00 0.21 0.00 0.00 27.48 28.84 1rre h GLN 772 CO 0.65 0.87 -0.55 -0.80 -1.93 0.00 0.00 178.83 177.08 1rre s ASN 773 N -6.21 5.92 0.04 -0.69 0.01 -1.26 -5.03 114.94 107.72 1rre s ASN 773 Ca -0.16 0.22 -0.35 0.00 -0.71 0.00 0.00 52.86 51.85 1rre s ASN 773 Cb 0.00 -1.76 -0.14 0.00 0.41 0.00 0.00 41.25 39.76 1rre s ASN 773 CO 0.72 0.27 1.59 -0.62 -1.51 0.00 0.00 177.10 177.55 1rre n GLU 774 N 1.11 1.75 0.00 -0.60 -0.58 -1.26 -4.99 120.64 116.06 1rre n GLU 774 Ca -0.12 0.63 0.00 0.00 -0.42 0.00 0.00 57.16 57.25 1rre n GLU 774 Cb 0.53 -2.37 0.00 0.00 -0.57 0.00 0.00 31.44 29.02 1rre n GLU 774 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35