#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a0w s GLU 605 N 0.00 1.98 -0.05 0.03 2.56 -1.26 -5.10 118.70 116.86 3a0w s GLU 605 Ca 0.00 -1.56 -0.20 0.00 0.00 0.00 0.00 54.97 53.22 3a0w s GLU 605 Cb 0.00 -3.08 -0.05 0.00 2.00 0.00 0.00 34.13 33.00 3a0w s GLU 605 CO 0.00 -0.74 0.56 -0.06 -0.56 0.00 0.00 175.26 174.46 3a0w s PHE 606 N 1.05 3.61 0.05 5.30 0.40 -1.26 -4.22 117.98 122.92 3a0w s PHE 606 Ca -0.00 1.09 -0.01 0.00 -0.60 0.00 0.00 56.93 57.41 3a0w s PHE 606 Cb -0.20 -2.60 -0.04 0.00 0.51 0.00 0.00 43.02 40.69 3a0w s PHE 606 CO -0.06 0.26 -0.03 0.95 0.70 0.00 0.00 175.22 177.05 3a0w s THR 607 N 0.20 0.23 -0.04 0.64 -4.23 -0.49 -4.88 115.64 107.06 3a0w s THR 607 Ca 0.30 -1.82 -0.23 0.00 -1.18 0.00 0.00 61.69 58.77 3a0w s THR 607 Cb -0.17 -1.55 -0.04 0.00 1.34 0.00 0.00 72.50 72.08 3a0w s THR 607 CO 0.15 -0.97 0.67 -0.70 -0.54 0.00 0.00 174.62 173.22 3a0w s GLU 608 N -3.92 4.42 0.11 3.99 2.12 -1.26 -2.22 118.70 121.93 3a0w s GLU 608 Ca 0.08 0.84 -0.11 0.00 0.36 0.00 0.00 54.97 56.14 3a0w s GLU 608 Cb 0.08 -3.41 0.01 0.00 0.26 0.00 0.00 34.13 31.07 3a0w s GLU 608 CO -0.09 0.16 0.28 -0.59 -0.54 0.00 0.00 175.26 174.47 3a0w s PHE 609 N 0.48 0.04 -0.38 5.30 -0.12 -0.16 -4.98 117.98 118.16 3a0w s PHE 609 Ca 0.36 -0.43 -0.28 0.00 -0.05 0.00 0.00 56.93 56.52 3a0w s PHE 609 Cb -0.18 0.06 0.02 0.00 -0.63 0.00 0.00 43.02 42.29 3a0w s PHE 609 CO 0.18 -0.62 1.05 1.21 -0.05 0.00 0.00 175.22 176.99 3a0w s ASN 610 N -2.85 6.78 0.34 1.98 3.84 -1.26 -1.68 114.94 122.08 3a0w s ASN 610 Ca 0.05 0.75 0.02 0.00 0.21 0.00 0.00 52.86 53.90 3a0w s ASN 610 Cb 0.04 -2.52 0.60 0.00 -0.55 0.00 0.00 41.25 38.81 3a0w s ASN 610 CO -0.10 -0.99 1.97 0.25 -2.79 0.00 0.00 177.10 175.44 3a0w h LEU 611 N 10.42 0.70 -0.78 3.21 5.85 -1.19 -2.45 115.31 131.07 3a0w h LEU 611 Ca -0.22 -0.05 -0.12 0.00 0.84 0.00 0.00 57.88 58.33 3a0w h LEU 611 Cb 1.06 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 3a0w h LEU 611 CO 1.05 0.56 -0.39 0.78 -0.34 0.00 0.00 178.44 180.10 3a0w h ASN 612 N 0.80 0.48 -0.80 1.25 2.35 -1.85 -0.97 115.58 116.83 3a0w h ASN 612 Ca 0.21 -0.20 0.02 0.00 -0.55 0.00 0.00 56.30 55.78 3a0w h ASN 612 Cb 0.01 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.21 3a0w h ASN 612 CO -0.03 0.82 0.53 -0.33 -1.65 0.00 0.00 177.43 176.77 3a0w h GLU 613 N 0.38 1.00 -0.15 0.81 5.08 -1.78 -1.27 114.58 118.65 3a0w h GLU 613 Ca 0.04 -0.06 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 3a0w h GLU 613 Cb 0.85 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3a0w h GLU 613 CO 0.07 0.66 -0.40 1.25 -1.00 0.00 0.00 179.01 179.59 3a0w h LEU 614 N 1.03 0.62 -0.60 1.33 5.85 -1.10 -1.88 115.31 120.55 3a0w h LEU 614 Ca 0.31 -0.58 0.08 0.00 0.84 0.00 0.00 57.88 58.52 3a0w h LEU 614 Cb -0.04 -0.18 -0.06 0.00 0.37 0.00 0.00 40.66 40.75 3a0w h LEU 614 CO -0.08 1.09 0.26 0.40 -0.34 0.00 0.00 178.44 179.77 3a0w h ILE 615 N 0.17 0.84 -0.38 4.05 2.04 -0.98 -1.47 117.51 121.79 3a0w h ILE 615 Ca -0.01 -0.16 -0.08 0.00 1.00 0.00 0.00 64.86 65.61 3a0w h ILE 615 Cb 1.02 0.32 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 3a0w h ILE 615 CO 0.09 0.09 -0.10 0.03 0.00 0.00 0.00 178.15 178.26 3a0w h ARG 616 N 0.48 0.65 -0.93 2.37 3.08 -1.11 -0.78 114.38 118.15 3a0w h ARG 616 Ca 0.29 -0.19 0.00 0.00 0.07 0.00 0.00 59.98 60.15 3a0w h ARG 616 Cb 0.30 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 3a0w h ARG 616 CO -0.26 0.74 0.59 1.49 -1.07 0.00 0.00 179.97 181.46 3a0w h GLU 617 N 0.60 1.24 -0.25 0.04 4.81 -0.78 -0.54 114.58 119.69 3a0w h GLU 617 Ca 0.11 -0.09 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 3a0w h GLU 617 Cb 0.52 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 3a0w h GLU 617 CO 0.03 0.84 -0.41 0.28 -0.73 0.00 0.00 179.01 179.02 3a0w h VAL 618 N 1.27 1.30 -0.66 0.32 2.07 -0.65 -2.75 116.25 117.16 3a0w h VAL 618 Ca 0.34 -1.61 0.08 0.00 0.82 0.00 0.00 66.70 66.33 3a0w h VAL 618 Cb -0.11 1.72 -0.07 0.00 -1.52 0.00 0.00 31.29 31.31 3a0w h VAL 618 CO -0.07 0.51 0.32 0.22 0.02 0.00 0.00 177.57 178.57 3a0w h TYR 619 N 0.45 0.57 -0.96 1.57 3.20 -0.65 -1.69 116.97 119.46 3a0w h TYR 619 Ca 0.02 0.03 0.02 0.00 3.14 0.00 0.00 58.73 61.94 3a0w h TYR 619 Cb 1.01 -0.16 -0.05 0.00 1.54 0.00 0.00 36.73 39.07 3a0w h TYR 619 CO 0.08 0.21 0.64 0.28 -1.64 0.00 0.00 178.16 177.73 3a0w h VAL 620 N 0.56 1.21 -0.93 1.81 2.07 -0.98 0.24 116.25 120.22 3a0w h VAL 620 Ca 0.32 -0.43 0.14 0.00 0.82 0.00 0.00 66.70 67.55 3a0w h VAL 620 Cb 0.32 -0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 29.85 3a0w h VAL 620 CO -0.25 0.23 0.59 -0.07 0.02 0.00 0.00 177.57 178.09 3a0w h LEU 621 N 1.26 0.74 -1.28 2.57 3.38 -1.01 -2.89 115.31 118.06 3a0w h LEU 621 Ca 0.37 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3a0w h LEU 621 Cb -0.07 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3a0w h LEU 621 CO -0.10 0.37 -0.33 0.49 0.09 0.00 0.00 178.44 178.96 3a0w n PHE 622 N -4.59 0.00 -0.26 1.13 3.72 0.15 -4.64 117.46 112.97 3a0w n PHE 622 Ca 0.18 0.00 0.02 0.00 -0.05 0.00 0.00 57.45 57.61 3a0w n PHE 622 Cb 0.44 0.00 0.15 0.00 -0.94 0.00 0.00 39.48 39.14 3a0w n PHE 622 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3a0w h GLU 623 N 3.12 0.60 -0.19 -1.08 4.81 -0.43 0.42 114.58 121.84 3a0w h GLU 623 Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 3a0w h GLU 623 Cb 0.83 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 3a0w h GLU 623 CO 0.00 0.40 -0.02 1.49 -0.73 0.00 0.00 179.01 180.15 3a0w h GLU 624 N 0.62 0.34 -0.29 1.92 4.81 -1.82 -1.27 114.58 118.89 3a0w h GLU 624 Ca 0.37 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.48 3a0w h GLU 624 Cb 0.41 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3a0w h GLU 624 CO -0.28 0.57 0.15 -0.22 -0.73 0.00 0.00 179.01 178.50 3a0w h LYS 625 N 0.08 0.41 -0.31 1.92 1.63 -1.70 0.35 116.57 118.95 3a0w h LYS 625 Ca 0.05 -0.05 0.04 0.00 -0.85 0.00 0.00 60.65 59.84 3a0w h LYS 625 Cb 0.43 -0.08 -0.04 0.00 -0.60 0.00 0.00 32.23 31.94 3a0w h LYS 625 CO 0.01 0.36 0.05 0.82 -3.45 0.00 0.00 179.45 177.25 3a0w h ILE 626 N 0.34 0.84 -0.58 2.00 2.04 -0.85 -1.51 117.51 119.80 3a0w h ILE 626 Ca 0.10 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 3a0w h ILE 626 Cb 0.08 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 3a0w h ILE 626 CO -0.02 0.03 0.16 -0.09 0.00 0.00 0.00 178.15 178.24 3a0w h ARG 627 N 0.16 0.92 -0.78 2.37 2.43 -0.99 -1.42 114.38 117.07 3a0w h ARG 627 Ca 0.14 -0.21 0.05 0.00 -0.81 0.00 0.00 59.98 59.16 3a0w h ARG 627 Cb 0.16 -0.13 -0.05 0.00 -0.42 0.00 0.00 29.97 29.54 3a0w h ARG 627 CO -0.20 0.84 0.51 -0.22 -1.51 0.00 0.00 179.97 179.39 3a0w h LYS 628 N 0.83 0.85 -0.01 0.20 3.64 -0.67 -1.18 116.57 120.22 3a0w h LYS 628 Ca 0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3a0w h LYS 628 Cb 0.32 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 3a0w h LYS 628 CO -0.00 0.56 -0.05 -1.33 -2.27 0.00 0.00 179.45 176.36 3a0w n MET 629 N -4.47 1.44 -3.58 1.90 2.81 -0.59 -4.93 117.12 109.70 3a0w n MET 629 Ca 0.11 -0.80 -0.23 0.00 -1.81 0.00 0.00 57.70 54.97 3a0w n MET 629 Cb 0.19 -1.48 0.08 0.00 -0.71 0.00 0.00 33.22 31.29 3a0w n MET 629 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 3a0w n ASN 630 N -0.08 -5.97 -4.75 7.83 5.15 -0.45 -0.59 115.26 116.40 3a0w n ASN 630 Ca 0.18 -0.55 -0.38 0.00 -0.60 0.00 0.00 54.58 53.23 3a0w n ASN 630 Cb 0.34 -5.03 -0.06 0.00 -0.53 0.00 0.00 39.78 34.50 3a0w n ASN 630 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3a0w s ILE 631 N -3.32 5.07 -0.32 -1.44 1.01 -0.58 -3.51 121.20 118.11 3a0w s ILE 631 Ca 0.53 1.04 -0.27 0.00 0.00 0.00 0.00 60.65 61.94 3a0w s ILE 631 Cb -0.23 -3.84 0.01 0.00 0.01 0.00 0.00 42.46 38.41 3a0w s ILE 631 CO 0.73 0.40 0.99 -1.81 0.00 0.00 0.00 174.94 175.25 3a0w s ASP 632 N 0.08 6.84 -0.04 3.58 1.01 -0.34 -4.70 116.67 123.10 3a0w s ASP 632 Ca 0.27 0.91 0.06 0.00 0.71 0.00 0.00 52.55 54.50 3a0w s ASP 632 Cb -0.16 -2.50 -0.02 0.00 1.01 0.00 0.00 42.92 41.24 3a0w s ASP 632 CO 0.13 -0.82 -0.21 0.12 0.21 0.00 0.00 175.17 174.61 3a0w s PHE 633 N 3.47 2.50 -0.01 4.23 2.19 -1.26 -0.89 117.98 128.22 3a0w s PHE 633 Ca 0.42 -0.38 -0.04 0.00 0.33 0.00 0.00 56.93 57.25 3a0w s PHE 633 Cb -0.13 -1.58 -0.00 0.00 -1.31 0.00 0.00 43.02 40.01 3a0w s PHE 633 CO 0.15 0.01 0.08 0.00 1.83 0.00 0.00 175.22 177.30 3a0w s PHE 635 N -0.88 1.39 0.05 0.00 5.36 -1.26 -0.66 117.98 121.97 3a0w s PHE 635 Ca -0.10 -0.57 0.05 0.00 -0.96 0.00 0.00 56.93 55.36 3a0w s PHE 635 Cb -0.06 -1.08 -0.02 0.00 -0.34 0.00 0.00 43.02 41.52 3a0w s PHE 635 CO 0.00 -0.35 -0.15 -1.21 -1.46 0.00 0.00 175.22 172.05 3a0w s GLU 636 N 1.07 0.99 0.09 10.12 2.02 -0.68 -4.99 118.70 127.32 3a0w s GLU 636 Ca -0.07 -0.83 0.04 0.00 0.02 0.00 0.00 54.97 54.13 3a0w s GLU 636 Cb -0.14 -1.03 -0.03 0.00 0.10 0.00 0.00 34.13 33.02 3a0w s GLU 636 CO -0.01 0.25 -0.12 -0.08 0.02 0.00 0.00 175.26 175.32 3a0w s THR 637 N -0.92 1.04 -2.59 3.63 -1.32 -1.26 -1.75 115.64 112.47 3a0w s THR 637 Ca 0.02 -1.50 0.24 0.00 -1.21 0.00 0.00 61.69 59.24 3a0w s THR 637 Cb -0.08 -1.24 0.40 0.00 -1.51 0.00 0.00 72.50 70.07 3a0w s THR 637 CO 0.02 -0.41 1.49 -0.90 -2.21 0.00 0.00 174.62 172.61 3a0w n ASP 638 N 0.85 2.35 -3.18 8.08 5.68 -0.96 -4.79 116.55 124.59 3a0w n ASP 638 Ca -0.18 -1.79 0.02 0.00 -0.50 0.00 0.00 54.79 52.34 3a0w n ASP 638 Cb 0.56 -0.07 -0.01 0.00 -1.14 0.00 0.00 41.12 40.45 3a0w n ASP 638 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 3a0w s ASN 639 N -1.80 -1.24 0.28 -1.12 2.47 -1.26 -4.91 114.94 107.37 3a0w s ASN 639 Ca 0.34 0.47 0.00 0.00 0.42 0.00 0.00 52.86 54.09 3a0w s ASN 639 Cb 0.20 1.96 0.51 0.00 -1.45 0.00 0.00 41.25 42.47 3a0w s ASN 639 CO 0.30 -0.29 1.87 -0.08 -3.72 0.00 0.00 177.10 175.19 3a0w h GLU 640 N 8.03 1.03 -2.32 0.43 4.57 -1.98 -2.91 114.58 121.43 3a0w h GLU 640 Ca -0.13 -0.06 -0.71 0.00 -1.18 0.00 0.00 59.36 57.28 3a0w h GLU 640 Cb 1.17 -0.23 -0.19 0.00 -0.16 0.00 0.00 28.75 29.34 3a0w h GLU 640 CO 0.22 0.68 1.47 -3.47 -1.18 0.00 0.00 179.01 176.73 3a0w n ASP 641 N -4.54 7.47 -4.57 1.04 2.03 -1.26 -4.73 116.55 111.99 3a0w n ASP 641 Ca 0.17 -3.38 -0.43 0.00 0.52 0.00 0.00 54.79 51.67 3a0w n ASP 641 Cb 0.26 -1.25 -0.05 0.00 -0.72 0.00 0.00 41.12 39.36 3a0w n ASP 641 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3a0w s LEU 642 N -2.93 4.16 0.05 -2.67 2.96 -1.10 -5.02 118.68 114.14 3a0w s LEU 642 Ca 0.51 0.14 0.09 0.00 -0.22 0.00 0.00 54.13 54.65 3a0w s LEU 642 Cb 0.26 -3.02 -0.03 0.00 0.50 0.00 0.00 46.19 43.90 3a0w s LEU 642 CO -0.17 -0.84 -0.23 -0.13 -1.32 0.00 0.00 176.35 173.66 3a0w s ARG 643 N 3.26 1.87 0.11 1.98 0.52 -1.26 -0.57 118.95 124.85 3a0w s ARG 643 Ca 0.31 -1.08 0.01 0.00 -0.52 0.00 0.00 55.73 54.45 3a0w s ARG 643 Cb -0.12 -2.06 -0.04 0.00 0.52 0.00 0.00 34.95 33.25 3a0w s ARG 643 CO 0.20 0.52 -0.04 0.14 0.02 0.00 0.00 175.30 176.14 3a0w s VAL 644 N -0.89 0.58 -0.31 3.52 -7.23 -0.68 -4.92 120.40 110.48 3a0w s VAL 644 Ca 0.13 -1.93 -0.08 0.00 -1.81 0.00 0.00 61.98 58.29 3a0w s VAL 644 Cb -0.10 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.07 3a0w s VAL 644 CO 0.04 -0.78 0.13 -1.61 -0.31 0.00 0.00 175.10 172.56 3a0w s GLU 645 N -3.88 3.16 0.34 4.82 2.02 -0.17 -0.99 118.70 124.00 3a0w s GLU 645 Ca 0.14 -0.83 -0.18 0.00 0.02 0.00 0.00 54.97 54.13 3a0w s GLU 645 Cb 0.06 -3.50 0.05 0.00 0.10 0.00 0.00 34.13 30.84 3a0w s GLU 645 CO -0.03 -0.47 0.79 0.00 0.02 0.00 0.00 175.26 175.57 3a0w s ALA 646 N 1.55 -0.95 -0.62 5.21 0.00 -0.94 -4.21 121.76 121.80 3a0w s ALA 646 Ca 0.03 -0.58 -0.25 0.00 0.00 0.00 0.00 51.96 51.16 3a0w s ALA 646 Cb -0.17 0.72 0.04 0.00 0.00 0.00 0.00 23.12 23.71 3a0w s ALA 646 CO 0.05 -1.01 1.07 0.34 0.00 0.00 0.00 175.76 176.21 3a0w s ASP 647 N -3.05 6.29 0.25 0.00 -1.08 -1.26 -1.40 116.67 116.42 3a0w s ASP 647 Ca 0.15 -0.41 -0.05 0.00 -0.52 0.00 0.00 52.55 51.72 3a0w s ASP 647 Cb -0.05 -2.48 0.34 0.00 -1.46 0.00 0.00 42.92 39.27 3a0w s ASP 647 CO 0.10 -1.46 1.86 -0.09 0.52 0.00 0.00 175.17 176.10 3a0w h ARG 648 N 9.57 1.00 -0.84 4.34 2.43 -1.88 -0.55 114.38 128.46 3a0w h ARG 648 Ca -0.27 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 58.87 3a0w h ARG 648 Cb 1.06 -0.23 -0.05 0.00 -0.42 0.00 0.00 29.97 30.34 3a0w h ARG 648 CO 1.17 0.66 0.54 1.15 -1.51 0.00 0.00 179.97 181.99 3a0w h THR 649 N 1.03 1.16 -0.01 0.20 2.02 -1.90 0.26 112.91 115.67 3a0w h THR 649 Ca 0.38 -0.37 -0.20 0.00 0.77 0.00 0.00 66.41 66.99 3a0w h THR 649 Cb 0.15 -0.01 0.02 0.00 -1.74 0.00 0.00 68.15 66.57 3a0w h THR 649 CO -0.17 0.20 -0.79 0.03 0.37 0.00 0.00 175.52 175.16 3a0w h ARG 650 N 1.07 0.55 -0.54 6.66 2.47 -1.84 -1.91 114.38 120.84 3a0w h ARG 650 Ca 0.32 -0.58 -0.06 0.00 -1.26 0.00 0.00 59.98 58.40 3a0w h ARG 650 Cb -0.04 0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.42 3a0w h ARG 650 CO -0.10 1.20 0.08 0.82 0.56 0.00 0.00 179.97 182.53 3a0w h ILE 651 N 0.13 1.24 -0.95 2.04 1.08 -0.99 -2.05 117.51 118.02 3a0w h ILE 651 Ca -0.10 -0.92 0.03 0.00 -0.39 0.00 0.00 64.86 63.48 3a0w h ILE 651 Cb 1.48 0.74 -0.05 0.00 -3.07 0.00 0.00 36.82 35.92 3a0w h ILE 651 CO 0.16 0.34 0.62 0.50 -0.69 0.00 0.00 178.15 179.07 3a0w h LYS 652 N 0.81 1.18 -0.73 2.37 3.64 -0.80 -0.99 116.57 122.05 3a0w h LYS 652 Ca 0.17 -0.07 0.01 0.00 -1.27 0.00 0.00 60.65 59.48 3a0w h LYS 652 Cb 0.38 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.89 3a0w h LYS 652 CO 0.01 0.78 0.48 1.96 -2.27 0.00 0.00 179.45 180.41 3a0w h GLN 653 N 1.22 0.97 -0.01 1.90 4.20 -0.67 -0.31 115.11 122.40 3a0w h GLN 653 Ca 0.37 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 59.02 3a0w h GLN 653 Cb -0.03 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 27.53 3a0w h GLN 653 CO -0.11 0.65 0.00 0.28 -0.67 0.00 0.00 178.83 178.98 3a0w h VAL 654 N 1.00 1.19 -0.66 -0.54 2.07 -0.89 -1.01 116.25 117.41 3a0w h VAL 654 Ca 0.27 -0.57 0.07 0.00 0.82 0.00 0.00 66.70 67.28 3a0w h VAL 654 Cb -0.10 1.56 -0.06 0.00 -1.52 0.00 0.00 31.29 31.16 3a0w h VAL 654 CO -0.06 0.15 0.35 -0.07 0.02 0.00 0.00 177.57 177.97 3a0w h LEU 655 N -0.21 0.50 -0.49 2.57 3.38 -0.87 -0.28 115.31 119.91 3a0w h LEU 655 Ca 0.00 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3a0w h LEU 655 Cb 0.24 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3a0w h LEU 655 CO 0.00 0.32 0.22 0.40 0.09 0.00 0.00 178.44 179.47 3a0w h ILE 656 N 0.64 1.20 -0.48 1.22 2.04 -0.90 -0.46 117.51 120.77 3a0w h ILE 656 Ca 0.31 -0.59 -0.03 0.00 1.00 0.00 0.00 64.86 65.55 3a0w h ILE 656 Cb 0.23 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.97 3a0w h ILE 656 CO -0.21 0.23 0.19 -1.13 0.00 0.00 0.00 178.15 177.23 3a0w h ASN 657 N 0.65 0.67 -0.37 1.72 -1.24 -0.60 -0.87 115.58 115.53 3a0w h ASN 657 Ca 0.17 -0.17 -0.11 0.00 0.71 0.00 0.00 56.30 56.90 3a0w h ASN 657 Cb 0.15 -0.17 -0.02 0.00 0.73 0.00 0.00 38.32 39.01 3a0w h ASN 657 CO -0.02 0.66 -0.16 -0.07 -1.29 0.00 0.00 177.43 176.55 3a0w h LEU 658 N 0.64 0.85 -0.31 0.34 3.38 -0.79 -0.60 115.31 118.83 3a0w h LEU 658 Ca 0.16 -0.29 -0.13 0.00 0.09 0.00 0.00 57.88 57.72 3a0w h LEU 658 Cb 0.20 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.71 3a0w h LEU 658 CO -0.01 1.01 -0.30 0.58 0.09 0.00 0.00 178.44 179.80 3a0w h VAL 659 N 0.75 1.29 -0.39 1.22 2.07 -0.89 -0.53 116.25 119.78 3a0w h VAL 659 Ca 0.11 -1.47 0.05 0.00 0.82 0.00 0.00 66.70 66.21 3a0w h VAL 659 Cb 0.68 1.54 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 3a0w h VAL 659 CO 0.05 0.48 0.14 -0.61 0.02 0.00 0.00 177.57 177.65 3a0w h GLN 660 N 0.51 0.29 -0.66 1.57 5.75 -1.05 -0.97 115.11 120.56 3a0w h GLN 660 Ca 0.05 -0.02 -0.08 0.00 -0.15 0.00 0.00 58.65 58.45 3a0w h GLN 660 Cb 0.88 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.34 3a0w h GLN 660 CO 0.08 0.19 0.10 -0.91 -2.65 0.00 0.00 178.83 175.63 3a0w h ASN 661 N 0.30 1.06 -0.57 -0.69 2.35 -0.97 -1.79 115.58 115.27 3a0w h ASN 661 Ca 0.18 -0.27 0.03 0.00 -0.55 0.00 0.00 56.30 55.69 3a0w h ASN 661 Cb 0.15 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.20 3a0w h ASN 661 CO -0.18 1.06 0.34 0.00 -1.65 0.00 0.00 177.43 177.00 3a0w h ALA 662 N 1.04 0.74 -0.21 -0.83 0.00 -0.70 0.42 119.26 119.72 3a0w h ALA 662 Ca 0.20 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3a0w h ALA 662 Cb 0.46 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3a0w h ALA 662 CO 0.02 0.07 0.10 0.82 0.00 0.00 0.00 179.25 180.25 3a0w h ILE 663 N 0.68 1.14 -0.56 0.00 2.04 -0.98 -0.86 117.51 118.96 3a0w h ILE 663 Ca 0.23 -0.40 -0.03 0.00 1.00 0.00 0.00 64.86 65.66 3a0w h ILE 663 Cb 0.03 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 3a0w h ILE 663 CO -0.10 0.14 0.25 -0.33 0.00 0.00 0.00 178.15 178.10 3a0w h GLU 664 N 0.21 0.81 -0.50 2.37 5.08 -1.09 -0.98 114.58 120.48 3a0w h GLU 664 Ca 0.07 -0.13 -0.09 0.00 -1.00 0.00 0.00 59.36 58.21 3a0w h GLU 664 Cb 0.13 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 3a0w h GLU 664 CO -0.01 0.69 -0.05 0.00 -1.00 0.00 0.00 179.01 178.64 3a0w h ALA 665 N 1.09 0.96 0.00 3.43 0.00 -0.80 -3.24 119.26 120.69 3a0w h ALA 665 Ca 0.19 -0.30 -0.25 0.00 0.00 0.00 0.00 54.91 54.54 3a0w h ALA 665 Cb 0.16 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3a0w h ALA 665 CO -0.02 0.62 -1.43 0.00 0.00 0.00 0.00 179.25 178.42 3a0w h THR 666 N 0.81 1.09 -1.62 0.00 1.03 -1.00 -3.45 112.91 109.78 3a0w h THR 666 Ca 0.14 -2.86 0.02 0.00 -0.01 0.00 0.00 66.41 63.71 3a0w h THR 666 Cb 0.55 2.52 -0.01 0.00 -1.07 0.00 0.00 68.15 70.15 3a0w h THR 666 CO 0.03 0.62 -0.03 0.61 -0.01 0.00 0.00 175.52 176.74 3a0w n GLY 667 N 1.47 -1.24 3.60 2.99 0.00 -0.39 -4.21 105.19 107.41 3a0w n GLY 667 Ca -0.10 -1.10 -0.47 0.00 0.00 0.00 0.00 46.02 44.35 3a0w n GLY 667 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3a0w n GLU 668 N -1.69 1.41 -1.24 1.61 4.07 -1.26 -1.97 120.64 121.57 3a0w n GLU 668 Ca 0.00 0.50 -0.08 0.00 -0.06 0.00 0.00 57.16 57.52 3a0w n GLU 668 Cb 0.04 -2.00 -0.04 0.00 -0.06 0.00 0.00 31.44 29.38 3a0w n GLU 668 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 3a0w n ASN 669 N 1.82 -4.74 -2.30 4.31 3.02 0.25 -5.00 115.26 112.62 3a0w n ASN 669 Ca 0.13 0.21 0.00 0.00 -0.03 0.00 0.00 54.58 54.88 3a0w n ASN 669 Cb 0.28 -2.98 0.00 0.00 -0.61 0.00 0.00 39.78 36.48 3a0w n ASN 669 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3a0w n GLY 670 N -0.99 -0.61 3.16 7.41 0.00 -0.83 -4.79 105.19 108.54 3a0w n GLY 670 Ca -0.08 -1.70 -0.13 0.00 0.00 0.00 0.00 46.02 44.11 3a0w n GLY 670 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a0w s LYS 671 N -1.36 0.34 -0.02 1.61 1.02 -1.26 -1.20 119.74 118.87 3a0w s LYS 671 Ca 0.00 0.31 0.01 0.00 0.02 0.00 0.00 55.97 56.31 3a0w s LYS 671 Cb 0.00 0.16 0.01 0.00 -0.52 0.00 0.00 37.83 37.49 3a0w s LYS 671 CO 0.00 -0.05 -0.02 0.42 -0.92 0.00 0.00 175.35 174.78 3a0w s ILE 672 N -0.01 0.28 -0.06 2.17 1.01 -0.06 -1.22 121.20 123.31 3a0w s ILE 672 Ca -0.01 -0.05 0.02 0.00 0.00 0.00 0.00 60.65 60.61 3a0w s ILE 672 Cb -0.02 -0.30 0.01 0.00 0.01 0.00 0.00 42.46 42.16 3a0w s ILE 672 CO 0.01 0.13 -0.12 -0.75 0.00 0.00 0.00 174.94 174.21 3a0w s LYS 673 N 0.51 1.60 -0.08 2.79 2.20 -0.14 -1.53 119.74 125.08 3a0w s LYS 673 Ca -0.05 -0.39 0.01 0.00 -0.36 0.00 0.00 55.97 55.18 3a0w s LYS 673 Cb -0.08 -1.34 -0.03 0.00 -1.51 0.00 0.00 37.83 34.87 3a0w s LYS 673 CO -0.01 0.03 -0.10 0.42 -0.36 0.00 0.00 175.35 175.34 3a0w s ILE 674 N 0.63 3.43 0.06 5.43 1.01 0.16 -0.34 121.20 131.58 3a0w s ILE 674 Ca -0.13 -0.57 0.07 0.00 0.00 0.00 0.00 60.65 60.02 3a0w s ILE 674 Cb -0.15 -2.40 -0.03 0.00 0.01 0.00 0.00 42.46 39.89 3a0w s ILE 674 CO 0.03 0.57 -0.20 0.42 0.00 0.00 0.00 174.94 175.77 3a0w s THR 675 N -0.49 1.58 -0.03 2.92 -4.23 -0.18 -1.69 115.64 113.51 3a0w s THR 675 Ca 0.07 -1.25 0.06 0.00 -1.18 0.00 0.00 61.69 59.39 3a0w s THR 675 Cb -0.12 -1.40 -0.01 0.00 1.34 0.00 0.00 72.50 72.31 3a0w s THR 675 CO 0.02 0.11 -0.23 -0.94 -0.54 0.00 0.00 174.62 173.03 3a0w s SER 676 N -1.35 2.79 -0.02 3.99 1.04 -0.72 -1.29 113.70 118.14 3a0w s SER 676 Ca 0.06 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.08 3a0w s SER 676 Cb -0.09 -0.53 -0.00 0.00 0.10 0.00 0.00 66.02 65.50 3a0w s SER 676 CO 0.02 0.26 -0.10 -1.61 0.98 0.00 0.00 173.24 172.79 3a0w s GLU 677 N -0.34 0.96 -0.39 4.02 2.02 0.26 -2.28 118.70 122.95 3a0w s GLU 677 Ca 0.03 -0.36 -0.20 0.00 0.02 0.00 0.00 54.97 54.46 3a0w s GLU 677 Cb -0.11 -0.91 0.01 0.00 0.10 0.00 0.00 34.13 33.22 3a0w s GLU 677 CO 0.01 0.17 0.63 0.34 0.02 0.00 0.00 175.26 176.44 3a0w s ASP 678 N -0.01 6.37 0.25 -0.19 -1.08 -1.26 -1.35 116.67 119.39 3a0w s ASP 678 Ca 0.00 -0.07 0.02 0.00 -0.52 0.00 0.00 52.55 51.98 3a0w s ASP 678 Cb -0.07 -2.32 0.02 0.00 -1.46 0.00 0.00 42.92 39.10 3a0w s ASP 678 CO 0.00 -0.67 0.19 0.23 0.52 0.00 0.00 175.17 175.45 3a0w n MET 679 N 6.13 1.11 0.00 4.34 2.81 -0.28 -5.02 117.12 126.21 3a0w n MET 679 Ca -0.02 -1.53 0.00 0.00 -1.81 0.00 0.00 57.70 54.34 3a0w n MET 679 Cb 0.48 0.15 0.00 0.00 -0.71 0.00 0.00 33.22 33.14 3a0w n MET 679 CO 0.00 0.00 0.00 0.98 1.51 0.00 0.00 175.97 178.46 3a0w n TYR 680 N -1.11 0.00 -0.51 2.03 4.19 -1.26 -3.90 117.16 116.60 3a0w n TYR 680 Ca -0.00 0.00 0.09 0.00 3.31 0.00 0.00 57.90 61.30 3a0w n TYR 680 Cb 0.28 -0.38 0.29 0.00 0.49 0.00 0.00 39.34 40.03 3a0w n TYR 680 CO 0.00 0.00 0.00 0.25 0.91 0.00 0.00 176.86 178.02 3a0w n THR 681 N -1.63 1.51 -4.03 2.97 -2.24 -1.26 -4.98 114.28 104.62 3a0w n THR 681 Ca 0.00 -1.18 -0.10 0.00 -2.27 0.00 0.00 64.05 60.50 3a0w n THR 681 Cb 0.00 0.26 -0.05 0.00 -2.10 0.00 0.00 70.33 68.43 3a0w n THR 681 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 3a0w s LYS 682 N -1.57 1.57 0.16 -0.78 -2.85 -1.25 -1.25 119.74 113.76 3a0w s LYS 682 Ca 0.43 -1.35 0.09 0.00 -1.00 0.00 0.00 55.97 54.14 3a0w s LYS 682 Cb 0.27 0.45 -0.04 0.00 -2.06 0.00 0.00 37.83 36.45 3a0w s LYS 682 CO 0.23 -0.64 -0.19 0.14 0.10 0.00 0.00 175.35 174.99 3a0w s VAL 683 N -3.88 1.82 -0.06 1.79 -7.23 -0.30 -1.12 120.40 111.42 3a0w s VAL 683 Ca 0.25 -1.86 0.03 0.00 -1.81 0.00 0.00 61.98 58.59 3a0w s VAL 683 Cb 0.00 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 35.14 3a0w s VAL 683 CO 0.11 -0.27 -0.15 -0.60 -0.31 0.00 0.00 175.10 173.88 3a0w s ARG 684 N -2.66 1.88 -0.09 4.82 3.52 -0.46 -1.95 118.95 124.01 3a0w s ARG 684 Ca 0.14 -0.52 0.04 0.00 -0.13 0.00 0.00 55.73 55.26 3a0w s ARG 684 Cb -0.06 -1.55 -0.00 0.00 -1.56 0.00 0.00 34.95 31.78 3a0w s ARG 684 CO 0.06 0.11 -0.23 0.08 -0.81 0.00 0.00 175.30 174.51 3a0w s VAL 685 N 0.44 1.98 -0.07 7.11 1.01 0.21 -0.58 120.40 130.50 3a0w s VAL 685 Ca -0.12 -0.98 0.05 0.00 0.00 0.00 0.00 61.98 60.93 3a0w s VAL 685 Cb -0.15 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.53 3a0w s VAL 685 CO 0.04 0.54 -0.23 -0.44 0.00 0.00 0.00 175.10 175.02 3a0w s SER 686 N 0.25 2.86 -0.25 3.32 0.01 -0.41 -0.98 113.70 118.49 3a0w s SER 686 Ca -0.15 -0.49 0.01 0.00 1.31 0.00 0.00 55.95 56.63 3a0w s SER 686 Cb -0.17 -1.00 0.06 0.00 0.21 0.00 0.00 66.02 65.13 3a0w s SER 686 CO 0.07 0.19 -0.06 -0.69 0.41 0.00 0.00 173.24 173.17 3a0w s VAL 687 N 0.09 1.71 0.03 3.43 1.01 0.48 -1.01 120.40 126.14 3a0w s VAL 687 Ca -0.10 -1.39 0.04 0.00 0.00 0.00 0.00 61.98 60.53 3a0w s VAL 687 Cb -0.15 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3a0w s VAL 687 CO 0.05 -0.13 -0.06 0.86 0.00 0.00 0.00 175.10 175.83 3a0w s TRP 688 N 1.30 2.89 0.03 5.22 -0.00 0.54 -1.08 118.94 127.84 3a0w s TRP 688 Ca -0.05 -0.05 0.03 0.00 -0.00 0.00 0.00 56.10 56.03 3a0w s TRP 688 Cb -0.19 -1.57 -0.02 0.00 -0.00 0.00 0.00 33.47 31.69 3a0w s TRP 688 CO -0.07 0.40 -0.10 0.54 -0.00 0.00 0.00 176.95 177.72 3a0w s ASN 689 N -1.71 1.20 0.34 5.86 4.22 0.04 -0.97 114.94 123.92 3a0w s ASN 689 Ca 0.19 -0.42 -0.27 0.00 -2.14 0.00 0.00 52.86 50.22 3a0w s ASN 689 Cb -0.11 -0.05 -0.09 0.00 1.28 0.00 0.00 41.25 42.27 3a0w s ASN 689 CO 0.10 -0.04 1.14 -0.94 -2.04 0.00 0.00 177.10 175.33 3a0w s SER 690 N -1.09 6.91 0.00 3.54 1.04 -0.35 -1.10 113.70 122.65 3a0w s SER 690 Ca -0.02 2.33 0.00 0.00 0.48 0.00 0.00 55.95 58.74 3a0w s SER 690 Cb -0.07 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3a0w s SER 690 CO 0.01 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.44 3a0w n GLY 691 N 0.86 -0.74 3.77 7.32 0.00 -0.92 -4.04 105.19 111.44 3a0w n GLY 691 Ca 0.01 -1.29 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 3a0w n GLY 691 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3a0w s PRO 692 N -2.00 3.33 0.67 1.61 0.04 -1.26 -3.41 135.00 133.98 3a0w s PRO 692 Ca 0.00 1.64 -0.16 0.00 0.04 0.00 0.00 61.00 62.52 3a0w s PRO 692 Cb 0.00 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.54 3a0w s PRO 692 CO 0.00 -0.87 1.16 -1.25 0.04 0.00 0.00 177.00 176.08 3a0w s PRO 693 N -3.27 2.62 0.00 0.56 0.04 -1.26 -4.74 135.00 128.95 3a0w s PRO 693 Ca 0.73 1.60 -0.30 0.00 0.04 0.00 0.00 61.00 63.06 3a0w s PRO 693 Cb -0.25 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.35 3a0w s PRO 693 CO 0.28 -1.43 1.08 0.42 0.04 0.00 0.00 177.00 177.38 3a0w s ILE 694 N -2.07 4.53 0.44 0.56 1.01 -1.26 -5.00 121.20 119.41 3a0w s ILE 694 Ca 0.71 1.82 -0.25 0.00 0.00 0.00 0.00 60.65 62.93 3a0w s ILE 694 Cb -0.25 -4.16 -0.08 0.00 0.01 0.00 0.00 42.46 37.97 3a0w s ILE 694 CO 0.41 0.11 1.36 -2.84 0.00 0.00 0.00 174.94 173.97 3a0w s PRO 695 N 1.29 3.77 0.31 2.79 0.02 -1.26 -4.87 135.00 137.05 3a0w s PRO 695 Ca 0.54 2.27 0.04 0.00 0.02 0.00 0.00 61.00 63.88 3a0w s PRO 695 Cb -0.24 -2.66 0.67 0.00 0.02 0.00 0.00 34.50 32.29 3a0w s PRO 695 CO 0.26 -0.70 1.85 1.49 -0.33 0.00 0.00 177.00 179.58 3a0w h GLU 696 N 2.40 0.84 0.00 5.54 4.57 -2.02 -0.31 114.58 125.60 3a0w h GLU 696 Ca -0.50 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 57.63 3a0w h GLU 696 Cb 1.26 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 3a0w h GLU 696 CO 0.61 0.56 0.00 1.05 -1.18 0.00 0.00 179.01 180.05 3a0w h GLU 697 N 0.87 0.00 -0.01 1.92 9.09 -2.04 -3.02 114.58 121.40 3a0w h GLU 697 Ca 0.47 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.88 3a0w h GLU 697 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 3a0w h GLU 697 CO -0.24 0.00 -0.55 1.28 0.05 0.00 0.00 179.01 179.55 3a0w n LEU 698 N -2.32 1.26 -0.33 3.06 4.77 -0.14 -4.51 117.00 118.79 3a0w n LEU 698 Ca 0.01 -0.64 0.02 0.00 -0.03 0.00 0.00 56.01 55.37 3a0w n LEU 698 Cb 0.17 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.43 3a0w n LEU 698 CO 0.17 0.26 1.21 0.11 -1.33 0.00 0.00 177.39 177.82 3a0w h LYS 699 N 1.00 0.99 0.03 3.23 1.57 -1.45 -1.38 116.57 120.56 3a0w h LYS 699 Ca 0.00 -0.06 -0.35 0.00 -1.87 0.00 0.00 60.65 58.37 3a0w h LYS 699 Cb 0.49 -0.22 -0.05 0.00 0.08 0.00 0.00 32.23 32.52 3a0w h LYS 699 CO 0.00 0.65 -2.09 0.39 -0.57 0.00 0.00 179.45 177.83 3a0w n GLU 700 N -4.60 0.68 -0.06 3.15 -0.58 -1.26 -4.38 120.64 113.59 3a0w n GLU 700 Ca 0.14 0.18 0.11 0.00 -0.42 0.00 0.00 57.16 57.17 3a0w n GLU 700 Cb 0.21 -1.65 0.50 0.00 -0.57 0.00 0.00 31.44 29.93 3a0w n GLU 700 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 3a0w h LYS 701 N 0.02 0.39 0.00 3.49 1.63 -1.75 -0.96 116.57 119.39 3a0w h LYS 701 Ca -0.44 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.34 3a0w h LYS 701 Cb 2.06 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.61 3a0w h LYS 701 CO 0.04 0.26 0.01 -0.84 -3.45 0.00 0.00 179.45 175.47 3a0w h ILE 702 N 0.40 0.00 -0.05 2.00 3.07 -1.46 -1.59 117.51 119.88 3a0w h ILE 702 Ca 0.26 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.67 3a0w h ILE 702 Cb 0.48 0.83 0.00 0.00 -0.27 0.00 0.00 36.82 37.86 3a0w h ILE 702 CO -0.07 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 177.52 3a0w n PHE 703 N -2.82 0.05 -2.78 0.16 3.72 -0.36 -4.47 117.46 110.95 3a0w n PHE 703 Ca -0.03 -0.02 -0.38 0.00 -0.05 0.00 0.00 57.45 56.97 3a0w n PHE 703 Cb 0.07 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 38.54 3a0w n PHE 703 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 3a0w s SER 704 N -1.92 7.40 0.42 4.37 0.15 -0.60 -3.50 113.70 120.01 3a0w s SER 704 Ca 0.35 1.85 0.28 0.00 0.70 0.00 0.00 55.95 59.13 3a0w s SER 704 Cb 0.20 -2.58 1.52 0.00 -1.71 0.00 0.00 66.02 63.46 3a0w s SER 704 CO 0.32 -0.02 1.86 1.55 1.20 0.00 0.00 173.24 178.15 3a0w h PRO 705 N 3.39 0.00 -0.15 5.44 0.13 -1.91 -2.28 132.00 136.61 3a0w h PRO 705 Ca -0.46 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 3a0w h PRO 705 Cb 1.19 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 3a0w h PRO 705 CO 0.66 0.00 -0.08 1.19 -0.23 0.00 0.00 178.00 179.54 3a0w n PHE 706 N -2.49 0.52 -2.63 1.56 3.72 -1.26 -4.90 117.46 111.98 3a0w n PHE 706 Ca -0.02 -1.14 -0.43 0.00 -0.05 0.00 0.00 57.45 55.81 3a0w n PHE 706 Cb 0.05 -0.29 -0.02 0.00 -0.94 0.00 0.00 39.48 38.28 3a0w n PHE 706 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 3a0w s PHE 707 N -2.98 3.40 0.00 1.38 5.36 -0.86 -4.86 117.98 119.41 3a0w s PHE 707 Ca 0.39 1.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.84 3a0w s PHE 707 Cb 0.34 -3.26 0.00 0.00 -0.34 0.00 0.00 43.02 39.76 3a0w s PHE 707 CO 0.03 -0.52 0.37 -2.37 -1.46 0.00 0.00 175.22 171.27 3a0w n THR 708 N 4.74 0.00 0.51 0.12 5.66 -1.26 -4.79 114.28 119.26 3a0w n THR 708 Ca 0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 3a0w n THR 708 Cb 0.48 0.14 0.00 0.00 -1.55 0.00 0.00 70.33 69.39 3a0w n THR 708 CO 0.00 0.00 0.00 1.07 -3.05 0.00 0.00 175.07 173.09 3a0w n THR 709 N 0.00 0.69 -4.33 1.09 5.66 -1.26 -4.76 114.28 111.37 3a0w n THR 709 Ca 0.00 -0.04 -0.25 0.00 -3.05 0.00 0.00 64.05 60.72 3a0w n THR 709 Cb 0.52 -0.87 -0.17 0.00 -1.55 0.00 0.00 70.33 68.27 3a0w n THR 709 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 3a0w s LYS 710 N 0.42 1.52 0.00 1.09 0.00 -1.26 -5.09 119.74 116.42 3a0w s LYS 710 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 55.97 55.65 3a0w s LYS 710 Cb 0.00 -1.37 0.00 0.00 0.00 0.00 0.00 37.83 36.46 3a0w s LYS 710 CO 0.00 -0.07 0.00 0.25 0.00 0.00 0.00 175.35 175.53 3a0w n THR 711 N 4.17 0.00 -1.84 3.79 -2.24 -1.26 -4.33 114.28 112.58 3a0w n THR 711 Ca -0.20 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.51 3a0w n THR 711 Cb 0.51 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.72 3a0w n THR 711 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 3a0w n GLN 712 N 0.00 -1.86 0.00 -0.78 7.27 -1.26 -2.21 117.38 118.54 3a0w n GLN 712 Ca 0.00 0.38 0.00 0.00 0.07 0.00 0.00 57.00 57.45 3a0w n GLN 712 Cb 0.00 -4.73 0.00 0.00 2.41 0.00 0.00 30.24 27.92 3a0w n GLN 712 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3a0w n GLY 713 N -0.40 3.28 3.16 1.69 0.00 -1.26 -5.06 105.19 106.59 3a0w n GLY 713 Ca -0.08 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.71 3a0w n GLY 713 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3a0w s THR 714 N -2.93 1.28 0.77 2.61 -4.23 -0.94 -5.15 115.64 107.06 3a0w s THR 714 Ca 0.00 -0.86 -0.11 0.00 -1.18 0.00 0.00 61.69 59.54 3a0w s THR 714 Cb 0.00 -1.10 0.06 0.00 1.34 0.00 0.00 72.50 72.80 3a0w s THR 714 CO 0.00 0.22 1.08 -0.83 -0.54 0.00 0.00 174.62 174.56 3a0w s GLY 715 N -0.74 1.66 0.36 3.99 0.00 -1.26 -3.98 107.32 107.35 3a0w s GLY 715 Ca 0.05 0.14 0.18 0.00 0.00 0.00 0.00 44.72 45.09 3a0w s GLY 715 CO 0.00 0.50 1.69 1.41 0.00 0.00 0.00 173.10 176.71 3a0w h LEU 716 N -1.09 0.00 0.00 0.66 3.38 -1.86 -3.47 115.31 112.92 3a0w h LEU 716 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 3a0w h LEU 716 Cb 1.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.99 3a0w h LEU 716 CO 0.54 0.40 0.00 0.61 0.09 0.00 0.00 178.44 180.08 3a0w n GLY 717 N 0.36 0.37 0.19 0.83 0.00 -1.26 -4.91 105.19 100.77 3a0w n GLY 717 Ca -0.00 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 3a0w n GLY 717 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3a0w h LEU 718 N 0.00 0.00 -1.08 0.99 3.38 -1.91 -2.26 115.31 114.43 3a0w h LEU 718 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3a0w h LEU 718 Cb 0.29 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3a0w h LEU 718 CO 0.00 0.34 0.01 0.77 0.09 0.00 0.00 178.44 179.65 3a0w h SER 719 N 0.00 0.62 -0.11 -0.43 4.64 -1.78 -0.13 113.55 116.36 3a0w h SER 719 Ca -0.00 -0.13 -0.22 0.00 -0.47 0.00 0.00 61.79 60.97 3a0w h SER 719 Cb 0.87 -0.16 0.01 0.00 -0.31 0.00 0.00 62.40 62.81 3a0w h SER 719 CO 0.04 0.69 -0.76 0.40 -0.87 0.00 0.00 176.83 176.33 3a0w h ILE 720 N 0.62 1.29 -0.58 0.95 2.04 -1.78 -1.58 117.51 118.46 3a0w h ILE 720 Ca 0.13 -1.97 0.08 0.00 1.00 0.00 0.00 64.86 64.10 3a0w h ILE 720 Cb 0.38 1.97 -0.07 0.00 -0.74 0.00 0.00 36.82 38.36 3a0w h ILE 720 CO 0.01 0.62 0.23 0.00 0.00 0.00 0.00 178.15 179.02 3a0w h ARG 722 N 0.43 0.85 -0.49 0.00 2.43 -0.93 0.32 114.38 116.99 3a0w h ARG 722 Ca 0.29 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.44 3a0w h ARG 722 Cb 0.32 -0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 3a0w h ARG 722 CO -0.27 0.61 0.19 -0.22 -1.51 0.00 0.00 179.97 178.76 3a0w h LYS 723 N 0.85 0.36 0.24 0.20 3.64 -0.70 0.10 116.57 121.27 3a0w h LYS 723 Ca 0.23 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 3a0w h LYS 723 Cb -0.03 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 3a0w h LYS 723 CO -0.04 0.24 -0.12 0.82 -2.27 0.00 0.00 179.45 178.08 3a0w h ILE 724 N 0.37 0.80 -0.10 2.00 2.04 -0.99 0.11 117.51 121.74 3a0w h ILE 724 Ca 0.23 -0.30 -0.07 0.00 1.00 0.00 0.00 64.86 65.73 3a0w h ILE 724 Cb 0.23 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.28 3a0w h ILE 724 CO -0.22 0.07 -0.19 0.40 0.00 0.00 0.00 178.15 178.20 3a0w h ILE 725 N -0.48 1.39 0.00 -0.67 1.08 -0.79 -2.27 117.51 115.76 3a0w h ILE 725 Ca -0.03 -1.46 -0.20 0.00 -0.39 0.00 0.00 64.86 62.78 3a0w h ILE 725 Cb 0.36 2.09 -0.03 0.00 -3.07 0.00 0.00 36.82 36.17 3a0w h ILE 725 CO 0.06 0.42 -1.13 -0.33 -0.69 0.00 0.00 178.15 176.47 3a0w h GLU 726 N -0.12 0.00 -0.02 2.37 5.08 -0.90 0.63 114.58 121.62 3a0w h GLU 726 Ca 0.01 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 3a0w h GLU 726 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 3a0w h GLU 726 CO 0.04 0.89 -0.18 -0.44 -1.00 0.00 0.00 179.01 178.32 3a0w h ASP 727 N -1.00 0.19 0.61 1.42 3.32 -1.23 -1.05 116.42 118.67 3a0w h ASP 727 Ca -0.30 -0.72 -0.28 0.00 0.02 0.00 0.00 57.03 55.75 3a0w h ASP 727 Cb 1.20 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 3a0w h ASP 727 CO -0.18 0.88 -1.33 -0.33 -1.72 0.00 0.00 179.24 176.56 3a0w h GLU 728 N -0.49 0.22 -0.00 3.56 5.08 -1.02 -3.37 114.58 118.55 3a0w h GLU 728 Ca -0.02 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 57.96 3a0w h GLU 728 Cb 0.89 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3a0w h GLU 728 CO 0.04 1.13 -0.39 0.72 -1.00 0.00 0.00 179.01 179.50 3a0w n HIS 729 N -3.46 0.00 -1.72 4.33 8.25 -0.86 -5.01 115.22 116.74 3a0w n HIS 729 Ca -0.11 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.24 3a0w n HIS 729 Cb 1.02 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 32.10 3a0w n HIS 729 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3a0w n GLY 730 N 1.12 0.65 0.00 -1.41 0.00 -0.40 -4.36 105.19 100.79 3a0w n GLY 730 Ca 0.04 -0.47 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3a0w n GLY 730 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a0w n GLY 731 N -1.34 1.88 3.01 -0.02 0.00 0.18 -4.72 105.19 104.19 3a0w n GLY 731 Ca -0.12 -2.01 -0.12 0.00 0.00 0.00 0.00 46.02 43.77 3a0w n GLY 731 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a0w s LYS 732 N 3.12 0.20 -0.04 1.61 -0.14 -0.51 -4.12 119.74 119.86 3a0w s LYS 732 Ca 0.00 0.02 0.02 0.00 -1.36 0.00 0.00 55.97 54.66 3a0w s LYS 732 Cb 0.00 0.09 0.01 0.00 -1.68 0.00 0.00 37.83 36.25 3a0w s LYS 732 CO 0.00 -0.03 -0.09 -1.50 -0.76 0.00 0.00 175.35 172.96 3a0w s ILE 733 N -0.26 0.83 0.34 2.17 2.07 -1.26 -0.81 121.20 124.28 3a0w s ILE 733 Ca -0.03 -0.35 -0.07 0.00 -1.41 0.00 0.00 60.65 58.78 3a0w s ILE 733 Cb -0.02 -0.76 0.01 0.00 0.13 0.00 0.00 42.46 41.82 3a0w s ILE 733 CO 0.00 0.27 0.55 -1.66 -1.91 0.00 0.00 174.94 172.19 3a0w s TRP 734 N 0.40 0.75 0.10 3.50 -2.14 -0.59 -5.01 118.94 115.95 3a0w s TRP 734 Ca -0.07 -1.10 0.06 0.00 2.66 0.00 0.00 56.10 57.66 3a0w s TRP 734 Cb -0.11 0.17 -0.03 0.00 -3.10 0.00 0.00 33.47 30.39 3a0w s TRP 734 CO 0.01 -1.22 -0.16 -0.08 -2.66 0.00 0.00 176.95 172.85 3a0w s THR 735 N -3.02 1.35 0.05 0.66 -1.32 -1.26 -1.02 115.64 111.08 3a0w s THR 735 Ca 0.26 -1.53 -0.03 0.00 -1.21 0.00 0.00 61.69 59.18 3a0w s THR 735 Cb -0.02 -1.37 -0.03 0.00 -1.51 0.00 0.00 72.50 69.58 3a0w s THR 735 CO 0.17 -0.26 0.03 -1.61 -2.21 0.00 0.00 174.62 170.73 3a0w s GLU 736 N -2.14 0.61 -0.16 7.08 2.02 -0.57 -5.01 118.70 120.53 3a0w s GLU 736 Ca 0.04 -1.04 -0.14 0.00 0.02 0.00 0.00 54.97 53.86 3a0w s GLU 736 Cb -0.08 0.22 -0.05 0.00 0.10 0.00 0.00 34.13 34.33 3a0w s GLU 736 CO 0.03 -0.13 0.30 -0.80 0.02 0.00 0.00 175.26 174.67 3a0w s ASN 737 N -2.62 6.44 -0.04 -0.19 0.01 -1.26 -0.57 114.94 116.71 3a0w s ASN 737 Ca 0.02 0.51 -0.27 0.00 -0.71 0.00 0.00 52.86 52.42 3a0w s ASN 737 Cb 0.04 -2.18 0.06 0.00 0.41 0.00 0.00 41.25 39.58 3a0w s ASN 737 CO -0.08 0.09 0.59 0.00 -1.51 0.00 0.00 177.10 176.20 3a0w s ARG 738 N 0.48 0.97 -1.55 -0.60 1.70 -0.38 -4.96 118.95 114.61 3a0w s ARG 738 Ca 0.17 0.14 -0.09 0.00 -0.47 0.00 0.00 55.73 55.48 3a0w s ARG 738 Cb -0.13 0.45 0.07 0.00 -0.57 0.00 0.00 34.95 34.78 3a0w s ARG 738 CO 0.04 -0.30 0.58 0.39 -1.08 0.00 0.00 175.30 174.93 3a0w n GLU 739 N 0.97 -3.20 -2.37 3.89 -0.58 -1.26 -0.75 120.64 117.34 3a0w n GLU 739 Ca -0.20 0.38 -0.11 0.00 -0.42 0.00 0.00 57.16 56.82 3a0w n GLU 739 Cb 0.57 -4.76 0.00 0.00 -0.57 0.00 0.00 31.44 26.68 3a0w n GLU 739 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3a0w n ASN 740 N -2.83 -3.67 0.00 1.62 5.03 -1.26 -4.93 115.26 109.22 3a0w n ASN 740 Ca -0.13 -0.06 0.00 0.00 0.87 0.00 0.00 54.58 55.26 3a0w n ASN 740 Cb 0.60 -2.78 0.00 0.00 -1.02 0.00 0.00 39.78 36.58 3a0w n ASN 740 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3a0w n GLY 741 N -1.06 1.94 2.95 7.41 0.00 0.07 -2.16 105.19 114.33 3a0w n GLY 741 Ca -0.10 -0.63 -0.14 0.00 0.00 0.00 0.00 46.02 45.15 3a0w n GLY 741 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a0w s VAL 742 N -2.29 0.31 0.02 1.61 1.01 -0.26 -1.25 120.40 119.55 3a0w s VAL 742 Ca 0.00 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 61.78 3a0w s VAL 742 Cb 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 36.38 36.07 3a0w s VAL 742 CO 0.00 0.02 -0.23 0.54 0.00 0.00 0.00 175.10 175.43 3a0w s VAL 743 N -0.27 1.81 -0.13 2.92 0.11 0.26 -0.78 120.40 124.33 3a0w s VAL 743 Ca -0.00 -1.16 -0.00 0.00 -2.93 0.00 0.00 61.98 57.88 3a0w s VAL 743 Cb -0.03 -1.55 -0.02 0.00 -1.53 0.00 0.00 36.38 33.26 3a0w s VAL 743 CO -0.00 0.35 -0.12 -0.36 -3.33 0.00 0.00 175.10 171.63 3a0w s PHE 744 N -0.71 2.83 -0.04 1.54 0.40 -0.24 -1.52 117.98 120.24 3a0w s PHE 744 Ca 0.09 -0.58 0.05 0.00 -0.60 0.00 0.00 56.93 55.88 3a0w s PHE 744 Cb -0.09 -1.85 -0.01 0.00 0.51 0.00 0.00 43.02 41.59 3a0w s PHE 744 CO 0.01 -0.17 -0.19 0.42 0.70 0.00 0.00 175.22 175.99 3a0w s ILE 745 N 0.30 1.57 0.09 0.64 1.01 -0.19 -0.39 121.20 124.23 3a0w s ILE 745 Ca -0.09 -0.80 0.07 0.00 0.00 0.00 0.00 60.65 59.83 3a0w s ILE 745 Cb -0.16 -1.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.94 3a0w s ILE 745 CO 0.05 0.45 -0.19 0.72 0.00 0.00 0.00 174.94 175.97 3a0w s PHE 746 N -0.06 1.65 -0.01 3.97 -0.12 -0.15 -1.54 117.98 121.71 3a0w s PHE 746 Ca -0.03 -0.42 0.07 0.00 -0.05 0.00 0.00 56.93 56.50 3a0w s PHE 746 Cb -0.12 -0.92 -0.02 0.00 -0.63 0.00 0.00 43.02 41.34 3a0w s PHE 746 CO 0.02 0.15 -0.21 -1.21 -0.05 0.00 0.00 175.22 173.93 3a0w s GLU 747 N -1.75 1.68 0.06 1.99 2.02 0.01 -0.62 118.70 122.09 3a0w s GLU 747 Ca 0.05 -0.76 0.04 0.00 0.02 0.00 0.00 54.97 54.32 3a0w s GLU 747 Cb -0.10 -1.64 -0.03 0.00 0.10 0.00 0.00 34.13 32.47 3a0w s GLU 747 CO 0.03 0.45 -0.13 0.96 0.02 0.00 0.00 175.26 176.59 3a0w s ILE 748 N -0.51 1.00 0.55 -1.63 -4.36 -0.82 -1.43 121.20 113.99 3a0w s ILE 748 Ca 0.08 -1.16 -0.21 0.00 -0.26 0.00 0.00 60.65 59.09 3a0w s ILE 748 Cb -0.08 -0.96 -0.05 0.00 1.25 0.00 0.00 42.46 42.62 3a0w s ILE 748 CO -0.01 -0.18 1.29 -2.65 0.24 0.00 0.00 174.94 173.63 3a0w n PRO 749 N 1.51 1.56 0.21 0.37 -0.02 -1.26 -1.15 135.00 136.22 3a0w n PRO 749 Ca -0.20 0.57 0.06 0.00 -2.02 0.00 0.00 63.50 61.91 3a0w n PRO 749 Cb 0.54 -2.49 0.53 0.00 -0.02 0.00 0.00 33.50 32.07 3a0w n PRO 749 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3a0w h LYS 750 N 1.30 0.05 -3.73 -0.52 1.57 -1.48 -3.43 116.57 110.32 3a0w h LYS 750 Ca -0.50 -0.01 -0.13 0.00 -1.87 0.00 0.00 60.65 58.14 3a0w h LYS 750 Cb 1.31 -0.01 -0.19 0.00 0.08 0.00 0.00 32.23 33.43 3a0w h LYS 750 CO 0.56 0.15 -0.53 0.95 -0.57 0.00 0.00 179.45 180.02 3a0w s THR 751 N -4.83 0.12 0.59 -0.16 -4.23 -1.26 -0.99 115.64 104.87 3a0w s THR 751 Ca -0.05 -0.96 0.29 0.00 -1.18 0.00 0.00 61.69 59.79 3a0w s THR 751 Cb 0.16 -0.71 0.37 0.00 1.34 0.00 0.00 72.50 73.66 3a0w s THR 751 CO 0.69 -0.53 2.00 -0.65 -0.54 0.00 0.00 174.62 175.59 3a0w h PRO 752 N 3.92 0.00 0.00 3.99 0.11 -1.84 -0.82 132.00 137.36 3a0w h PRO 752 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 3a0w h PRO 752 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3a0w h PRO 752 CO 0.47 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.19 3a0w h GLU 753 N 0.00 0.00 -0.64 1.05 5.08 -1.96 -3.10 114.58 115.02 3a0w h GLU 753 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3a0w h GLU 753 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 3a0w h GLU 753 CO -0.00 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.64 3a0w n LYS 754 N -2.70 4.10 0.00 2.33 5.02 -0.31 -5.16 118.16 121.43 3a0w n LYS 754 Ca 0.03 -2.90 0.10 0.00 -2.02 0.00 0.00 58.31 53.52 3a0w n LYS 754 Cb 0.40 -2.02 0.58 0.00 -0.02 0.00 0.00 35.03 33.96 3a0w n LYS 754 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75