#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 0.65 -0.03 2.12 2.12 -1.26 -5.11 118.70 117.19 3a0w s GLU 605 Ca 0.00 -0.88 -0.25 0.00 0.36 0.00 0.00 54.97 54.20 3a0w s GLU 605 Cb 0.00 -1.91 -0.04 0.00 0.26 0.00 0.00 34.13 32.44 3a0w s GLU 605 CO 0.00 -0.92 0.75 -0.06 -0.54 0.00 0.00 175.26 174.49 3a0w s PHE 606 N 1.72 3.63 0.07 5.30 0.40 -1.26 -4.18 117.98 123.66 3a0w s PHE 606 Ca 0.07 1.37 0.00 0.00 -0.60 0.00 0.00 56.93 57.78 3a0w s PHE 606 Cb -0.17 -2.85 -0.04 0.00 0.51 0.00 0.00 43.02 40.47 3a0w s PHE 606 CO -0.23 0.13 -0.05 0.95 0.70 0.00 0.00 175.22 176.72 3a0w s THR 607 N 0.57 0.45 -0.08 0.64 -4.23 -0.43 -4.87 115.64 107.69 3a0w s THR 607 Ca 0.40 -1.80 -0.22 0.00 -1.18 0.00 0.00 61.69 58.88 3a0w s THR 607 Cb -0.19 -1.51 -0.04 0.00 1.34 0.00 0.00 72.50 72.11 3a0w s THR 607 CO 0.21 -0.90 0.65 -0.70 -0.54 0.00 0.00 174.62 173.34 3a0w s GLU 608 N -3.69 4.41 0.12 3.99 2.12 -1.26 -1.74 118.70 122.65 3a0w s GLU 608 Ca 0.08 0.78 -0.09 0.00 0.36 0.00 0.00 54.97 56.09 3a0w s GLU 608 Cb 0.05 -3.45 -0.00 0.00 0.26 0.00 0.00 34.13 30.99 3a0w s GLU 608 CO -0.07 0.07 0.24 -0.59 -0.54 0.00 0.00 175.26 174.37 3a0w s PHE 609 N 0.81 0.20 -0.40 5.30 -0.71 -0.56 -4.98 117.98 117.65 3a0w s PHE 609 Ca 0.35 -0.60 -0.27 0.00 -1.04 0.00 0.00 56.93 55.36 3a0w s PHE 609 Cb -0.17 -0.03 0.02 0.00 -1.21 0.00 0.00 43.02 41.63 3a0w s PHE 609 CO 0.16 -0.62 1.01 1.21 -1.34 0.00 0.00 175.22 175.65 3a0w s ASN 610 N -2.89 6.70 0.34 1.98 3.84 -1.26 -1.81 114.94 121.83 3a0w s ASN 610 Ca 0.09 0.59 0.03 0.00 0.21 0.00 0.00 52.86 53.77 3a0w s ASN 610 Cb 0.04 -2.50 0.62 0.00 -0.55 0.00 0.00 41.25 38.86 3a0w s ASN 610 CO -0.07 -0.99 1.95 0.25 -2.79 0.00 0.00 177.10 175.45 3a0w h LEU 611 N 10.44 0.65 -0.99 3.21 5.85 -0.79 -2.31 115.31 131.36 3a0w h LEU 611 Ca -0.23 -0.06 -0.06 0.00 0.84 0.00 0.00 57.88 58.37 3a0w h LEU 611 Cb 1.07 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 3a0w h LEU 611 CO 1.04 0.55 0.05 0.78 -0.34 0.00 0.00 178.44 180.51 3a0w h ASN 612 N 0.73 0.74 -0.30 1.25 2.35 -1.85 -1.68 115.58 116.82 3a0w h ASN 612 Ca 0.18 -0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.72 3a0w h ASN 612 Cb 0.07 -0.19 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 3a0w h ASN 612 CO -0.03 0.78 0.03 -0.33 -1.65 0.00 0.00 177.43 176.23 3a0w h GLU 613 N 0.74 0.61 -0.38 0.81 4.39 -1.76 -0.83 114.58 118.16 3a0w h GLU 613 Ca 0.15 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.62 3a0w h GLU 613 Cb 0.38 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 3a0w h GLU 613 CO 0.01 0.61 -0.18 1.25 -1.16 0.00 0.00 179.01 179.54 3a0w h LEU 614 N 0.58 0.81 -0.46 1.33 5.85 -1.12 -0.48 115.31 121.82 3a0w h LEU 614 Ca 0.13 -0.40 0.02 0.00 0.84 0.00 0.00 57.88 58.46 3a0w h LEU 614 Cb 0.33 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3a0w h LEU 614 CO 0.01 1.04 0.27 0.40 -0.34 0.00 0.00 178.44 179.81 3a0w h ILE 615 N 0.59 1.04 -0.69 4.05 2.04 -0.99 -0.42 117.51 123.13 3a0w h ILE 615 Ca 0.08 -0.18 -0.00 0.00 1.00 0.00 0.00 64.86 65.76 3a0w h ILE 615 Cb 0.73 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 3a0w h ILE 615 CO 0.05 0.10 0.42 -0.09 0.00 0.00 0.00 178.15 178.64 3a0w h ARG 616 N 0.54 0.93 -0.99 2.37 2.43 -1.01 -0.10 114.38 118.55 3a0w h ARG 616 Ca 0.19 -0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.35 3a0w h ARG 616 Cb 0.02 -0.20 -0.07 0.00 -0.42 0.00 0.00 29.97 29.31 3a0w h ARG 616 CO -0.09 0.66 0.64 1.49 -1.51 0.00 0.00 179.97 181.16 3a0w h GLU 617 N 0.94 1.10 -0.22 0.20 4.81 -0.39 -0.25 114.58 120.77 3a0w h GLU 617 Ca 0.25 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 3a0w h GLU 617 Cb -0.04 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 29.09 3a0w h GLU 617 CO -0.05 0.73 -0.45 0.28 -0.73 0.00 0.00 179.01 178.79 3a0w h VAL 618 N 1.14 1.31 -0.78 0.32 2.07 -0.41 -2.86 116.25 117.04 3a0w h VAL 618 Ca 0.43 -1.67 0.11 0.00 0.82 0.00 0.00 66.70 66.40 3a0w h VAL 618 Cb 0.20 1.80 -0.08 0.00 -1.52 0.00 0.00 31.29 31.70 3a0w h VAL 618 CO -0.18 0.53 0.39 0.22 0.02 0.00 0.00 177.57 178.55 3a0w h TYR 619 N 0.41 0.70 -0.63 1.57 3.20 -0.48 -1.23 116.97 120.51 3a0w h TYR 619 Ca 0.01 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.96 3a0w h TYR 619 Cb 1.06 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 39.10 3a0w h TYR 619 CO 0.09 0.22 0.42 0.28 -1.64 0.00 0.00 178.16 177.52 3a0w h VAL 620 N 0.63 1.04 -0.45 1.81 2.07 -0.89 0.35 116.25 120.80 3a0w h VAL 620 Ca 0.40 -0.23 -0.05 0.00 0.82 0.00 0.00 66.70 67.64 3a0w h VAL 620 Cb 0.47 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3a0w h VAL 620 CO -0.30 0.12 0.09 -0.07 0.02 0.00 0.00 177.57 177.43 3a0w h LEU 621 N 0.67 0.64 -1.31 2.57 3.38 -1.01 -3.12 115.31 117.13 3a0w h LEU 621 Ca 0.26 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3a0w h LEU 621 Cb 0.19 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3a0w h LEU 621 CO -0.08 0.66 -0.25 0.49 0.09 0.00 0.00 178.44 179.35 3a0w n PHE 622 N -4.29 0.00 -0.18 1.13 3.72 -0.34 -4.67 117.46 112.84 3a0w n PHE 622 Ca 0.03 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.42 3a0w n PHE 622 Cb 0.22 0.00 0.08 0.00 -0.94 0.00 0.00 39.48 38.84 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 3.02 0.11 -0.37 -1.08 4.81 -0.31 0.06 114.58 120.82 3a0w h GLU 623 Ca 0.00 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 3a0w h GLU 623 Cb 0.77 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.11 3a0w h GLU 623 CO 0.00 0.07 -0.35 1.49 -0.73 0.00 0.00 179.01 179.50 3a0w h GLU 624 N 0.12 0.85 -0.35 1.92 4.57 -1.83 -0.95 114.58 118.90 3a0w h GLU 624 Ca 0.28 -0.42 -0.03 0.00 -1.18 0.00 0.00 59.36 58.02 3a0w h GLU 624 Cb 0.44 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 3a0w h GLU 624 CO -0.47 1.06 0.11 -0.22 -1.18 0.00 0.00 179.01 178.31 3a0w h LYS 625 N 0.70 0.55 -0.79 1.92 3.64 -1.74 -0.29 116.57 120.55 3a0w h LYS 625 Ca 0.07 -0.12 0.06 0.00 -1.27 0.00 0.00 60.65 59.39 3a0w h LYS 625 Cb 0.91 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 32.59 3a0w h LYS 625 CO 0.08 0.56 0.48 0.82 -2.27 0.00 0.00 179.45 179.13 3a0w h ILE 626 N 0.42 1.02 -0.24 2.00 2.04 -0.85 -2.01 117.51 119.88 3a0w h ILE 626 Ca 0.11 -0.30 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 3a0w h ILE 626 Cb 0.24 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 3a0w h ILE 626 CO -0.00 0.16 -0.06 -0.09 0.00 0.00 0.00 178.15 178.15 3a0w h ARG 627 N 0.87 0.47 -0.61 2.37 2.43 -0.79 -1.71 114.38 117.42 3a0w h ARG 627 Ca 0.35 -0.18 0.05 0.00 -0.81 0.00 0.00 59.98 59.38 3a0w h ARG 627 Cb 0.17 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.66 3a0w h ARG 627 CO -0.17 0.70 0.40 0.87 -1.51 0.00 0.00 179.97 180.26 3a0w h LYS 628 N 0.21 0.64 -0.04 0.20 1.79 -0.90 -1.86 116.57 116.62 3a0w h LYS 628 Ca 0.06 -0.04 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 3a0w h LYS 628 Cb 0.53 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 3a0w h LYS 628 CO 0.02 0.42 0.00 -1.33 -1.08 0.00 0.00 179.45 177.49 3a0w n MET 629 N -4.47 1.66 -2.94 3.15 2.81 -0.77 -4.93 117.12 111.63 3a0w n MET 629 Ca 0.08 -0.97 -0.19 0.00 -1.81 0.00 0.00 57.70 54.81 3a0w n MET 629 Cb 0.18 -1.47 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 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 0.18 -4.49 -4.72 7.83 5.15 -0.70 -0.21 115.26 118.30 3a0w n ASN 630 Ca 0.19 -0.16 -0.42 0.00 -0.60 0.00 0.00 54.58 53.59 3a0w n ASN 630 Cb 0.35 -3.72 -0.03 0.00 -0.53 0.00 0.00 39.78 35.85 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 -2.90 4.23 -0.05 -1.44 1.01 -0.68 -3.72 121.20 117.64 3a0w s ILE 631 Ca 0.23 1.66 -0.30 0.00 0.00 0.00 0.00 60.65 62.23 3a0w s ILE 631 Cb -0.11 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3a0w s ILE 631 CO 0.28 0.16 1.21 -1.81 0.00 0.00 0.00 174.94 174.78 3a0w s ASP 632 N 0.81 7.05 -0.07 3.58 1.01 0.01 -4.77 116.67 124.28 3a0w s ASP 632 Ca 0.55 1.83 0.05 0.00 0.71 0.00 0.00 52.55 55.69 3a0w s ASP 632 Cb -0.27 -2.56 -0.00 0.00 1.01 0.00 0.00 42.92 41.10 3a0w s ASP 632 CO 0.30 -0.58 -0.22 0.12 0.21 0.00 0.00 175.17 174.99 3a0w s PHE 633 N 2.17 2.26 0.06 4.23 5.36 -1.26 -0.94 117.98 129.86 3a0w s PHE 633 Ca 0.56 -0.76 -0.00 0.00 -0.96 0.00 0.00 56.93 55.77 3a0w s PHE 633 Cb -0.25 -1.50 -0.04 0.00 -0.34 0.00 0.00 43.02 40.89 3a0w s PHE 633 CO 0.22 -0.27 -0.04 0.00 -1.46 0.00 0.00 175.22 173.68 3a0w s PHE 635 N -3.62 0.54 0.02 0.00 5.36 -1.26 -1.09 117.98 117.93 3a0w s PHE 635 Ca 0.06 -0.11 0.02 0.00 -0.96 0.00 0.00 56.93 55.94 3a0w s PHE 635 Cb 0.06 -0.47 -0.01 0.00 -0.34 0.00 0.00 43.02 42.26 3a0w s PHE 635 CO -0.08 -0.11 -0.08 -1.21 -1.46 0.00 0.00 175.22 172.28 3a0w s GLU 636 N 0.56 0.57 0.05 10.12 2.02 -0.48 -4.99 118.70 126.55 3a0w s GLU 636 Ca -0.07 -0.48 0.01 0.00 0.02 0.00 0.00 54.97 54.45 3a0w s GLU 636 Cb -0.10 -0.49 -0.03 0.00 0.10 0.00 0.00 34.13 33.61 3a0w s GLU 636 CO -0.00 0.12 -0.05 -0.08 0.02 0.00 0.00 175.26 175.27 3a0w s THR 637 N -0.66 0.36 -2.20 3.63 -1.32 -1.26 -1.54 115.64 112.64 3a0w s THR 637 Ca -0.02 -1.30 0.23 0.00 -1.21 0.00 0.00 61.69 59.39 3a0w s THR 637 Cb -0.06 -0.84 0.52 0.00 -1.51 0.00 0.00 72.50 70.61 3a0w s THR 637 CO 0.00 -0.62 1.45 -0.90 -2.21 0.00 0.00 174.62 172.35 3a0w n ASP 638 N 1.01 3.67 -3.16 8.08 5.68 -0.93 -4.80 116.55 126.11 3a0w n ASP 638 Ca -0.20 -1.99 0.03 0.00 -0.50 0.00 0.00 54.79 52.14 3a0w n ASP 638 Cb 0.57 -0.35 -0.01 0.00 -1.14 0.00 0.00 41.12 40.18 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 -1.25 -1.33 0.12 -1.12 3.84 -1.26 -4.84 114.94 109.09 3a0w s ASN 639 Ca 0.43 0.83 -0.21 0.00 0.21 0.00 0.00 52.86 54.12 3a0w s ASN 639 Cb 0.24 2.13 -0.04 0.00 -0.55 0.00 0.00 41.25 43.02 3a0w s ASN 639 CO 0.32 -0.26 1.70 -0.33 -2.79 0.00 0.00 177.10 175.74 3a0w h GLU 640 N 8.01 -0.05 -4.19 0.43 5.08 -1.98 -3.27 114.58 118.61 3a0w h GLU 640 Ca -0.22 0.00 -0.76 0.00 -1.00 0.00 0.00 59.36 57.38 3a0w h GLU 640 Cb 1.16 0.01 -0.23 0.00 0.50 0.00 0.00 28.75 30.19 3a0w h GLU 640 CO 0.26 -0.03 0.65 0.34 -1.00 0.00 0.00 179.01 179.22 3a0w s ASP 641 N -5.16 6.99 -0.64 1.42 2.15 -1.26 -4.71 116.67 115.46 3a0w s ASP 641 Ca -0.14 -2.94 -0.13 0.00 0.43 0.00 0.00 52.55 49.78 3a0w s ASP 641 Cb 0.10 -2.29 0.16 0.00 -0.30 0.00 0.00 42.92 40.59 3a0w s ASP 641 CO 0.68 -0.61 0.56 -0.22 -0.17 0.00 0.00 175.17 175.41 3a0w s LEU 642 N 0.51 6.21 0.02 -1.34 2.96 -1.24 -5.04 118.68 120.76 3a0w s LEU 642 Ca 0.31 -2.25 -0.17 0.00 -0.22 0.00 0.00 54.13 51.79 3a0w s LEU 642 Cb -0.07 -2.14 -0.06 0.00 0.50 0.00 0.00 46.19 44.42 3a0w s LEU 642 CO -0.07 -0.67 0.49 -0.13 -1.32 0.00 0.00 176.35 174.65 3a0w s ARG 643 N 0.86 4.09 0.07 1.98 1.81 -1.26 -0.02 118.95 126.48 3a0w s ARG 643 Ca 0.10 0.56 0.02 0.00 -1.72 0.00 0.00 55.73 54.69 3a0w s ARG 643 Cb -0.21 -3.25 -0.03 0.00 -0.45 0.00 0.00 34.95 31.00 3a0w s ARG 643 CO -0.03 0.61 -0.07 0.14 -0.68 0.00 0.00 175.30 175.28 3a0w s VAL 644 N -0.90 0.59 -0.25 3.52 -7.23 -0.75 -4.92 120.40 110.46 3a0w s VAL 644 Ca 0.26 -1.58 -0.07 0.00 -1.81 0.00 0.00 61.98 58.78 3a0w s VAL 644 Cb -0.18 -1.24 -0.02 0.00 0.56 0.00 0.00 36.38 35.51 3a0w s VAL 644 CO 0.16 -0.69 0.05 -1.61 -0.31 0.00 0.00 175.10 172.70 3a0w s GLU 645 N -2.94 3.56 0.28 4.82 2.02 0.37 -1.49 118.70 125.32 3a0w s GLU 645 Ca 0.03 -0.53 -0.19 0.00 0.02 0.00 0.00 54.97 54.29 3a0w s GLU 645 Cb -0.01 -3.28 0.06 0.00 0.10 0.00 0.00 34.13 31.00 3a0w s GLU 645 CO -0.03 -0.21 0.88 0.00 0.02 0.00 0.00 175.26 175.91 3a0w s ALA 646 N 1.59 -1.17 -0.56 5.21 0.00 -0.71 -4.33 121.76 121.78 3a0w s ALA 646 Ca 0.06 -0.47 -0.22 0.00 0.00 0.00 0.00 51.96 51.33 3a0w s ALA 646 Cb -0.15 0.72 0.06 0.00 0.00 0.00 0.00 23.12 23.74 3a0w s ALA 646 CO 0.02 -1.02 0.83 0.34 0.00 0.00 0.00 175.76 175.93 3a0w s ASP 647 N -3.14 6.26 0.24 0.00 -1.08 -1.26 -1.31 116.67 116.38 3a0w s ASP 647 Ca 0.16 -0.74 -0.07 0.00 -0.52 0.00 0.00 52.55 51.39 3a0w s ASP 647 Cb -0.04 -2.38 0.24 0.00 -1.46 0.00 0.00 42.92 39.28 3a0w s ASP 647 CO 0.08 -1.15 1.92 -0.09 0.52 0.00 0.00 175.17 176.44 3a0w h ARG 648 N 9.25 1.27 -0.67 4.34 2.43 -1.88 -0.48 114.38 128.65 3a0w h ARG 648 Ca -0.27 -0.08 0.06 0.00 -0.81 0.00 0.00 59.98 58.88 3a0w h ARG 648 Cb 1.08 -0.28 -0.06 0.00 -0.42 0.00 0.00 29.97 30.29 3a0w h ARG 648 CO 1.07 0.85 0.37 1.15 -1.51 0.00 0.00 179.97 181.89 3a0w h THR 649 N 1.31 0.96 0.01 0.20 2.02 -1.91 0.40 112.91 115.90 3a0w h THR 649 Ca 0.35 -0.23 -0.20 0.00 0.77 0.00 0.00 66.41 67.10 3a0w h THR 649 Cb -0.14 0.22 0.02 0.00 -1.74 0.00 0.00 68.15 66.51 3a0w h THR 649 CO -0.07 0.12 -0.77 0.03 0.37 0.00 0.00 175.52 175.20 3a0w h ARG 650 N 0.68 0.51 -0.79 6.66 2.47 -1.80 -1.77 114.38 120.35 3a0w h ARG 650 Ca 0.30 -0.56 -0.04 0.00 -1.26 0.00 0.00 59.98 58.42 3a0w h ARG 650 Cb 0.19 0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.64 3a0w h ARG 650 CO -0.18 1.19 0.34 0.82 0.56 0.00 0.00 179.97 182.70 3a0w h ILE 651 N 0.06 1.25 -0.69 2.04 1.08 -1.01 -2.32 117.51 117.92 3a0w h ILE 651 Ca -0.10 -0.77 0.05 0.00 -0.39 0.00 0.00 64.86 63.66 3a0w h ILE 651 Cb 1.47 0.29 -0.05 0.00 -3.07 0.00 0.00 36.82 35.46 3a0w h ILE 651 CO 0.15 0.32 0.40 0.50 -0.69 0.00 0.00 178.15 178.83 3a0w h LYS 652 N 1.13 0.72 -0.92 2.37 3.64 -0.80 -1.22 116.57 121.49 3a0w h LYS 652 Ca 0.27 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 3a0w h LYS 652 Cb 0.17 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 31.78 3a0w h LYS 652 CO -0.03 0.47 0.59 1.96 -2.27 0.00 0.00 179.45 180.18 3a0w h GLN 653 N 0.74 1.12 0.21 1.90 4.20 -0.81 -0.14 115.11 122.32 3a0w h GLN 653 Ca 0.30 -0.07 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 3a0w h GLN 653 Cb 0.16 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3a0w h GLN 653 CO -0.17 0.74 -0.10 0.28 -0.67 0.00 0.00 178.83 178.91 3a0w h VAL 654 N 1.15 0.84 -0.59 -0.54 2.07 -0.91 -1.19 116.25 117.08 3a0w h VAL 654 Ca 0.37 -0.26 0.08 0.00 0.82 0.00 0.00 66.70 67.71 3a0w h VAL 654 Cb 0.02 1.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.72 3a0w h VAL 654 CO -0.12 0.06 0.25 -0.07 0.02 0.00 0.00 177.57 177.70 3a0w h LEU 655 N -0.41 0.29 -0.55 2.57 3.38 -0.92 -0.09 115.31 119.57 3a0w h LEU 655 Ca -0.03 0.06 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 3a0w h LEU 655 Cb 0.31 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 3a0w h LEU 655 CO 0.05 0.18 0.34 0.40 0.09 0.00 0.00 178.44 179.50 3a0w h ILE 656 N 0.46 1.16 -0.55 1.22 2.04 -0.90 -0.63 117.51 120.30 3a0w h ILE 656 Ca 0.29 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 3a0w h ILE 656 Cb 0.31 0.40 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 3a0w h ILE 656 CO -0.26 0.16 0.18 -1.13 0.00 0.00 0.00 178.15 177.11 3a0w h ASN 657 N 0.75 0.80 -0.45 1.72 -1.24 -0.51 -0.53 115.58 116.12 3a0w h ASN 657 Ca 0.20 -0.20 -0.13 0.00 0.71 0.00 0.00 56.30 56.88 3a0w h ASN 657 Cb -0.03 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.80 3a0w h ASN 657 CO -0.04 0.79 -0.23 -0.07 -1.29 0.00 0.00 177.43 176.59 3a0w h LEU 658 N 0.77 0.99 -0.30 0.34 3.38 -0.66 -1.74 115.31 118.10 3a0w h LEU 658 Ca 0.18 -0.38 -0.07 0.00 0.09 0.00 0.00 57.88 57.70 3a0w h LEU 658 Cb 0.27 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3a0w h LEU 658 CO -0.01 1.17 -0.10 0.58 0.09 0.00 0.00 178.44 180.17 3a0w h VAL 659 N 0.83 1.29 -0.03 1.22 2.07 -0.92 -0.87 116.25 119.84 3a0w h VAL 659 Ca 0.11 -1.17 0.03 0.00 0.82 0.00 0.00 66.70 66.49 3a0w h VAL 659 Cb 0.80 1.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 3a0w h VAL 659 CO 0.07 0.37 -0.26 -0.61 0.02 0.00 0.00 177.57 177.16 3a0w h GLN 660 N 0.35 -0.37 -0.60 1.57 4.15 -1.05 0.22 115.11 119.38 3a0w h GLN 660 Ca 0.07 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.55 3a0w h GLN 660 Cb 0.61 0.08 -0.04 0.00 0.21 0.00 0.00 27.48 28.34 3a0w h GLN 660 CO 0.04 -0.25 0.34 -0.91 -1.93 0.00 0.00 178.83 176.12 3a0w h ASN 661 N -0.39 0.54 -0.57 -0.69 2.35 -1.22 -2.07 115.58 113.53 3a0w h ASN 661 Ca 0.07 0.01 0.03 0.00 -0.55 0.00 0.00 56.30 55.87 3a0w h ASN 661 Cb 0.49 -0.10 -0.04 0.00 0.05 0.00 0.00 38.32 38.72 3a0w h ASN 661 CO -0.25 0.37 0.34 0.00 -1.65 0.00 0.00 177.43 176.23 3a0w h ALA 662 N 1.28 0.74 -0.32 -0.83 0.00 -0.69 -0.60 119.26 118.84 3a0w h ALA 662 Ca 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.16 3a0w h ALA 662 Cb 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3a0w h ALA 662 CO -0.13 0.05 0.20 0.82 0.00 0.00 0.00 179.25 180.19 3a0w h ILE 663 N 0.66 1.09 -0.37 0.00 2.04 -0.57 -0.29 117.51 120.06 3a0w h ILE 663 Ca 0.24 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.87 3a0w h ILE 663 Cb 0.05 0.65 -0.02 0.00 -0.74 0.00 0.00 36.82 36.77 3a0w h ILE 663 CO -0.11 0.09 0.10 -0.33 0.00 0.00 0.00 178.15 177.90 3a0w h GLU 664 N 0.42 0.59 -0.53 2.37 5.08 -1.13 -2.52 114.58 118.86 3a0w h GLU 664 Ca 0.12 -0.14 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 3a0w h GLU 664 Cb -0.03 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.12 3a0w h GLU 664 CO -0.02 0.62 0.09 0.00 -1.00 0.00 0.00 179.01 178.69 3a0w h ALA 665 N 0.95 0.71 0.03 3.43 0.00 -1.01 -3.31 119.26 120.05 3a0w h ALA 665 Ca 0.12 -0.24 -0.23 0.00 0.00 0.00 0.00 54.91 54.56 3a0w h ALA 665 Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3a0w h ALA 665 CO -0.00 0.45 -0.99 0.00 0.00 0.00 0.00 179.25 178.70 3a0w h THR 666 N 0.77 1.44 -0.99 0.00 1.03 -0.95 -3.43 112.91 110.78 3a0w h THR 666 Ca 0.16 -2.61 0.08 0.00 -0.01 0.00 0.00 66.41 64.03 3a0w h THR 666 Cb 0.40 2.54 -0.02 0.00 -1.07 0.00 0.00 68.15 70.00 3a0w h THR 666 CO 0.01 0.77 -0.11 0.61 -0.01 0.00 0.00 175.52 176.79 3a0w n GLY 667 N 1.06 -1.95 3.72 2.99 0.00 -0.96 -4.26 105.19 105.79 3a0w n GLY 667 Ca -0.06 -1.35 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 3a0w n GLY 667 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a0w n GLU 668 N -1.58 2.10 -1.42 1.61 1.02 -1.26 -1.21 120.64 119.89 3a0w n GLU 668 Ca 0.00 0.74 -0.15 0.00 -0.02 0.00 0.00 57.16 57.74 3a0w n GLU 668 Cb 0.14 -2.45 -0.06 0.00 -0.02 0.00 0.00 31.44 29.05 3a0w n GLU 668 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3a0w n ASN 669 N 0.26 -5.35 -2.15 1.62 3.02 0.71 -4.97 115.26 108.40 3a0w n ASN 669 Ca 0.05 0.36 0.00 0.00 -0.03 0.00 0.00 54.58 54.96 3a0w n ASN 669 Cb 0.39 -4.12 0.00 0.00 -0.61 0.00 0.00 39.78 35.44 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 -0.40 -1.41 3.07 7.41 0.00 -0.35 -4.74 105.19 108.76 3a0w n GLY 670 Ca -0.15 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.13 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 -2.89 0.22 -0.03 1.61 1.02 -1.26 -0.81 119.74 117.60 3a0w s LYS 671 Ca 0.00 0.47 0.01 0.00 0.02 0.00 0.00 55.97 56.48 3a0w s LYS 671 Cb 0.00 -0.06 0.01 0.00 -0.52 0.00 0.00 37.83 37.27 3a0w s LYS 671 CO 0.00 -0.13 -0.05 0.42 -0.92 0.00 0.00 175.35 174.67 3a0w s ILE 672 N 0.96 0.49 -0.05 2.17 1.01 -0.11 -1.04 121.20 124.63 3a0w s ILE 672 Ca -0.07 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.44 3a0w s ILE 672 Cb -0.08 -0.48 0.01 0.00 0.01 0.00 0.00 42.46 41.92 3a0w s ILE 672 CO -0.06 0.18 -0.11 -0.75 0.00 0.00 0.00 174.94 174.20 3a0w s LYS 673 N 0.49 1.36 -0.10 2.79 2.20 -0.12 -1.62 119.74 124.73 3a0w s LYS 673 Ca -0.06 -0.37 0.02 0.00 -0.36 0.00 0.00 55.97 55.20 3a0w s LYS 673 Cb -0.10 -1.19 -0.01 0.00 -1.51 0.00 0.00 37.83 35.02 3a0w s LYS 673 CO -0.00 0.08 -0.16 0.42 -0.36 0.00 0.00 175.35 175.32 3a0w s ILE 674 N 0.44 2.79 0.06 5.43 1.01 -0.25 -0.43 121.20 130.25 3a0w s ILE 674 Ca -0.09 -0.77 0.08 0.00 0.00 0.00 0.00 60.65 59.87 3a0w s ILE 674 Cb -0.13 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.19 3a0w s ILE 674 CO 0.02 0.55 -0.22 0.42 0.00 0.00 0.00 174.94 175.71 3a0w s THR 675 N 0.07 1.77 -0.01 2.92 -4.23 -0.36 -1.38 115.64 114.42 3a0w s THR 675 Ca -0.07 -1.30 0.06 0.00 -1.18 0.00 0.00 61.69 59.20 3a0w s THR 675 Cb -0.15 -1.55 -0.02 0.00 1.34 0.00 0.00 72.50 72.13 3a0w s THR 675 CO 0.05 0.19 -0.20 -0.94 -0.54 0.00 0.00 174.62 173.18 3a0w s SER 676 N -1.32 2.32 -0.01 3.99 1.04 -0.59 -1.14 113.70 117.98 3a0w s SER 676 Ca 0.08 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.16 3a0w s SER 676 Cb -0.09 -0.25 0.00 0.00 0.10 0.00 0.00 66.02 65.77 3a0w s SER 676 CO 0.02 0.24 -0.06 -1.61 0.98 0.00 0.00 173.24 172.81 3a0w s GLU 677 N -0.51 0.59 -0.34 4.02 2.02 0.16 -2.18 118.70 122.45 3a0w s GLU 677 Ca 0.08 -0.21 -0.23 0.00 0.02 0.00 0.00 54.97 54.63 3a0w s GLU 677 Cb -0.08 -0.58 0.01 0.00 0.10 0.00 0.00 34.13 33.58 3a0w s GLU 677 CO -0.01 0.10 0.79 0.34 0.02 0.00 0.00 175.26 176.50 3a0w s ASP 678 N 0.07 6.60 -0.15 -0.19 -1.08 -1.26 -1.14 116.67 119.51 3a0w s ASP 678 Ca -0.00 0.49 0.16 0.00 -0.52 0.00 0.00 52.55 52.67 3a0w s ASP 678 Cb -0.05 -2.40 0.50 0.00 -1.46 0.00 0.00 42.92 39.51 3a0w s ASP 678 CO -0.00 -0.68 1.40 0.23 0.52 0.00 0.00 175.17 176.64 3a0w n MET 679 N 6.33 2.93 0.00 4.34 2.81 0.09 -5.00 117.12 128.63 3a0w n MET 679 Ca 0.03 -2.73 0.00 0.00 -1.81 0.00 0.00 57.70 53.20 3a0w n MET 679 Cb 0.48 -1.76 0.00 0.00 -0.71 0.00 0.00 33.22 31.23 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 -0.35 0.00 0.11 2.03 9.36 -1.26 -3.89 117.16 123.16 3a0w n TYR 680 Ca 0.20 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.44 3a0w n TYR 680 Cb 0.83 0.00 -0.00 0.00 -0.63 0.00 0.00 39.34 39.53 3a0w n TYR 680 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3a0w h THR 681 N 0.00 0.74 -3.99 2.97 1.03 -1.97 -3.45 112.91 108.23 3a0w h THR 681 Ca 0.00 -2.11 -0.12 0.00 -0.01 0.00 0.00 66.41 64.16 3a0w h THR 681 Cb 0.00 2.30 -0.12 0.00 -1.07 0.00 0.00 68.15 69.25 3a0w h THR 681 CO 0.00 0.42 -0.34 -1.59 -0.01 0.00 0.00 175.52 174.00 3a0w s LYS 682 N -2.97 1.25 0.12 0.00 -2.85 -1.25 -1.50 119.74 112.55 3a0w s LYS 682 Ca 0.02 -1.30 0.10 0.00 -1.00 0.00 0.00 55.97 53.80 3a0w s LYS 682 Cb 0.08 0.37 -0.04 0.00 -2.06 0.00 0.00 37.83 36.18 3a0w s LYS 682 CO 0.76 -0.46 -0.26 0.14 0.10 0.00 0.00 175.35 175.63 3a0w s VAL 683 N -4.02 2.15 -0.06 1.79 -7.23 -0.35 -0.73 120.40 111.94 3a0w s VAL 683 Ca 0.23 -1.69 0.04 0.00 -1.81 0.00 0.00 61.98 58.75 3a0w s VAL 683 Cb 0.03 -1.91 -0.00 0.00 0.56 0.00 0.00 36.38 35.06 3a0w s VAL 683 CO 0.05 0.08 -0.19 -0.60 -0.31 0.00 0.00 175.10 174.13 3a0w s ARG 684 N -1.97 2.20 -0.12 4.82 3.52 -0.29 -2.09 118.95 125.01 3a0w s ARG 684 Ca 0.12 -0.69 0.02 0.00 -0.13 0.00 0.00 55.73 55.05 3a0w s ARG 684 Cb -0.10 -1.81 -0.00 0.00 -1.56 0.00 0.00 34.95 31.48 3a0w s ARG 684 CO 0.05 0.22 -0.20 0.08 -0.81 0.00 0.00 175.30 174.65 3a0w s VAL 685 N 0.16 2.35 -0.13 7.11 1.01 0.06 -0.67 120.40 130.30 3a0w s VAL 685 Ca -0.09 -0.90 0.01 0.00 0.00 0.00 0.00 61.98 61.00 3a0w s VAL 685 Cb -0.14 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.29 3a0w s VAL 685 CO 0.04 0.54 -0.15 -0.44 0.00 0.00 0.00 175.10 175.09 3a0w s SER 686 N 0.49 3.78 -0.28 3.32 0.01 -0.29 -0.99 113.70 119.72 3a0w s SER 686 Ca -0.13 -0.40 0.03 0.00 1.31 0.00 0.00 55.95 56.76 3a0w s SER 686 Cb -0.17 -1.56 0.07 0.00 0.21 0.00 0.00 66.02 64.57 3a0w s SER 686 CO 0.05 0.15 -0.06 -0.69 0.41 0.00 0.00 173.24 173.10 3a0w s VAL 687 N 0.43 2.27 -0.02 3.43 1.01 0.12 -1.22 120.40 126.43 3a0w s VAL 687 Ca -0.12 -1.80 0.01 0.00 0.00 0.00 0.00 61.98 60.08 3a0w s VAL 687 Cb -0.16 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 3a0w s VAL 687 CO 0.05 -0.18 -0.03 0.86 0.00 0.00 0.00 175.10 175.80 3a0w s TRP 688 N 1.06 3.01 -0.01 5.22 -0.00 0.43 -0.75 118.94 127.91 3a0w s TRP 688 Ca -0.04 0.05 0.02 0.00 -0.00 0.00 0.00 56.10 56.14 3a0w s TRP 688 Cb -0.20 -1.67 -0.00 0.00 -0.00 0.00 0.00 33.47 31.59 3a0w s TRP 688 CO -0.05 0.42 -0.06 0.54 -0.00 0.00 0.00 176.95 177.79 3a0w s ASN 689 N -1.32 0.75 0.42 5.86 4.22 -0.37 -0.95 114.94 123.55 3a0w s ASN 689 Ca 0.17 -0.12 -0.26 0.00 -2.14 0.00 0.00 52.86 50.52 3a0w s ASN 689 Cb -0.11 -0.09 -0.08 0.00 1.28 0.00 0.00 41.25 42.25 3a0w s ASN 689 CO 0.07 0.08 1.32 -0.94 -2.04 0.00 0.00 177.10 175.59 3a0w s SER 690 N -0.14 6.21 0.00 3.54 1.04 -0.21 -1.48 113.70 122.66 3a0w s SER 690 Ca 0.02 2.69 0.00 0.00 0.48 0.00 0.00 55.95 59.14 3a0w s SER 690 Cb -0.03 -2.64 0.00 0.00 0.10 0.00 0.00 66.02 63.45 3a0w s SER 690 CO -0.00 -0.93 0.00 0.61 0.98 0.00 0.00 173.24 173.90 3a0w n GLY 691 N 0.65 -0.30 3.77 7.32 0.00 -0.29 -3.89 105.19 112.46 3a0w n GLY 691 Ca 0.04 -1.39 -0.36 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.88 3.42 0.70 1.61 0.04 -1.26 -3.62 135.00 134.01 3a0w s PRO 692 Ca 0.00 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 62.58 3a0w s PRO 692 Cb 0.00 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.46 3a0w s PRO 692 CO 0.00 -0.81 1.09 -1.25 0.04 0.00 0.00 177.00 176.07 3a0w s PRO 693 N -3.14 2.69 -0.23 0.56 0.04 -1.26 -4.74 135.00 128.91 3a0w s PRO 693 Ca 0.71 1.24 -0.24 0.00 0.04 0.00 0.00 61.00 62.75 3a0w s PRO 693 Cb -0.26 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.33 3a0w s PRO 693 CO 0.29 -1.32 0.79 0.42 0.04 0.00 0.00 177.00 177.22 3a0w s ILE 694 N -2.64 4.88 0.26 0.56 1.01 -1.26 -5.01 121.20 119.00 3a0w s ILE 694 Ca 0.63 1.49 -0.29 0.00 0.00 0.00 0.00 60.65 62.48 3a0w s ILE 694 Cb -0.18 -4.08 -0.14 0.00 0.01 0.00 0.00 42.46 38.07 3a0w s ILE 694 CO 0.48 -0.03 1.01 -2.65 0.00 0.00 0.00 174.94 173.74 3a0w n PRO 695 N 5.81 1.24 -0.34 2.79 -0.02 -1.26 -4.84 135.00 138.38 3a0w n PRO 695 Ca 0.04 0.44 0.22 0.00 -2.02 0.00 0.00 63.50 62.18 3a0w n PRO 695 Cb 0.48 -1.81 0.47 0.00 -0.02 0.00 0.00 33.50 32.62 3a0w n PRO 695 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3a0w h GLU 696 N 2.20 0.42 0.00 -0.52 4.39 -2.02 -0.83 114.58 118.23 3a0w h GLU 696 Ca -0.39 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.28 3a0w h GLU 696 Cb 1.35 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 3a0w h GLU 696 CO 0.62 0.28 0.00 0.39 -1.16 0.00 0.00 179.01 179.14 3a0w n GLU 697 N -4.77 0.15 -0.00 2.33 4.71 -1.26 -2.67 120.64 119.13 3a0w n GLU 697 Ca 0.27 0.34 0.05 0.00 -0.01 0.00 0.00 57.16 57.81 3a0w n GLU 697 Cb 0.88 -1.76 0.04 0.00 -1.01 0.00 0.00 31.44 29.58 3a0w n GLU 697 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 3a0w n LEU 698 N -2.04 1.78 -0.33 -4.62 4.77 -0.32 -4.61 117.00 111.62 3a0w n LEU 698 Ca 0.03 -1.01 0.11 0.00 -0.03 0.00 0.00 56.01 55.11 3a0w n LEU 698 Cb 0.25 -0.00 0.29 0.00 -2.33 0.00 0.00 43.42 41.62 3a0w n LEU 698 CO 0.20 0.35 1.15 0.50 -1.33 0.00 0.00 177.39 178.26 3a0w h LYS 699 N 1.79 0.66 0.00 3.23 3.64 -1.46 -0.09 116.57 124.34 3a0w h LYS 699 Ca 0.00 -0.04 -0.35 0.00 -1.27 0.00 0.00 60.65 58.99 3a0w h LYS 699 Cb 0.39 -0.15 -0.07 0.00 -0.41 0.00 0.00 32.23 31.99 3a0w h LYS 699 CO 0.00 0.43 -2.33 0.39 -2.27 0.00 0.00 179.45 175.68 3a0w n GLU 700 N -4.83 0.84 0.18 1.90 -0.58 -1.26 -4.51 120.64 112.37 3a0w n GLU 700 Ca 0.21 0.00 0.06 0.00 -0.42 0.00 0.00 57.16 57.01 3a0w n GLU 700 Cb 0.54 -1.49 0.53 0.00 -0.57 0.00 0.00 31.44 30.45 3a0w n GLU 700 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 3a0w h LYS 701 N 0.00 0.13 0.00 3.49 1.57 -1.65 -1.68 116.57 118.44 3a0w h LYS 701 Ca -0.52 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.24 3a0w h LYS 701 Cb 2.16 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 34.45 3a0w h LYS 701 CO 0.02 0.17 -0.00 -0.84 -0.57 0.00 0.00 179.45 178.23 3a0w h ILE 702 N 0.13 0.03 -0.00 1.86 3.07 -1.27 -0.46 117.51 120.87 3a0w h ILE 702 Ca 0.03 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.31 3a0w h ILE 702 Cb 0.14 1.12 0.00 0.00 -0.27 0.00 0.00 36.82 37.81 3a0w h ILE 702 CO 0.00 0.00 -0.36 0.49 -1.05 0.00 0.00 178.15 177.24 3a0w n PHE 703 N -3.12 0.00 -2.87 0.16 3.72 -0.63 -4.49 117.46 110.23 3a0w n PHE 703 Ca -0.02 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.98 3a0w n PHE 703 Cb 0.13 -0.19 -0.05 0.00 -0.94 0.00 0.00 39.48 38.42 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 -2.74 7.39 0.17 4.37 0.15 -0.18 -3.40 113.70 119.46 3a0w s SER 704 Ca 0.18 1.66 0.16 0.00 0.70 0.00 0.00 55.95 58.65 3a0w s SER 704 Cb 0.18 -2.53 0.75 0.00 -1.71 0.00 0.00 66.02 62.72 3a0w s SER 704 CO 0.60 0.05 1.49 -0.81 1.20 0.00 0.00 173.24 175.77 3a0w n PRO 705 N 2.38 0.10 0.22 5.44 -0.04 -1.26 -1.39 135.00 140.44 3a0w n PRO 705 Ca -0.02 0.48 0.11 0.00 -0.04 0.00 0.00 63.50 64.04 3a0w n PRO 705 Cb 0.49 -1.75 0.26 0.00 -0.04 0.00 0.00 33.50 32.46 3a0w n PRO 705 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3a0w h PHE 706 N 0.00 0.00 -3.20 0.54 0.04 -1.92 -3.47 116.94 108.93 3a0w h PHE 706 Ca 0.00 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.24 3a0w h PHE 706 Cb 0.14 0.00 0.07 0.00 2.20 0.00 0.00 35.95 38.36 3a0w h PHE 706 CO 0.00 0.10 0.88 0.12 -0.60 0.00 0.00 178.31 178.81 3a0w s PHE 707 N -3.29 2.85 0.03 -0.55 5.36 -0.49 -5.02 117.98 116.87 3a0w s PHE 707 Ca 0.05 0.75 -0.01 0.00 -0.96 0.00 0.00 56.93 56.76 3a0w s PHE 707 Cb 0.07 -4.02 -0.02 0.00 -0.34 0.00 0.00 43.02 38.70 3a0w s PHE 707 CO 0.66 -3.53 -0.02 -0.08 -1.46 0.00 0.00 175.22 170.80 3a0w s THR 708 N 0.27 0.14 -1.04 0.12 -1.32 -1.26 -5.03 115.64 107.52 3a0w s THR 708 Ca 0.65 -1.15 -0.16 0.00 -1.21 0.00 0.00 61.69 59.83 3a0w s THR 708 Cb -0.47 -0.63 -0.01 0.00 -1.51 0.00 0.00 72.50 69.88 3a0w s THR 708 CO 0.43 -0.63 0.75 0.41 -2.21 0.00 0.00 174.62 173.38 3a0w n THR 709 N 1.15 -5.99 0.00 5.08 -1.04 -1.26 -5.18 114.28 107.04 3a0w n THR 709 Ca -0.21 -0.73 0.00 0.00 -2.04 0.00 0.00 64.05 61.07 3a0w n THR 709 Cb 0.57 -4.43 0.00 0.00 -1.82 0.00 0.00 70.33 64.64 3a0w n THR 709 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 3a0w n LEU 716 N -3.67 0.00 -2.35 -4.42 7.94 -1.26 -5.25 117.00 107.99 3a0w n LEU 716 Ca -0.11 0.00 -0.05 0.00 -1.11 0.00 0.00 56.01 54.74 3a0w n LEU 716 Cb 0.59 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.48 3a0w n LEU 716 CO 0.65 0.00 0.97 0.61 -1.11 0.00 0.00 177.39 178.51 3a0w n GLY 717 N -0.51 1.79 0.21 -3.96 0.00 -1.26 -4.49 105.19 96.98 3a0w n GLY 717 Ca 0.00 -0.46 -0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 5.79 0.23 -0.87 0.99 3.38 -1.91 -0.18 115.31 122.73 3a0w h LEU 718 Ca 0.08 -0.07 0.01 0.00 0.09 0.00 0.00 57.88 57.99 3a0w h LEU 718 Cb 0.55 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 3a0w h LEU 718 CO 0.44 0.52 0.58 0.77 0.09 0.00 0.00 178.44 180.84 3a0w h SER 719 N 0.21 0.99 -0.35 -0.43 4.64 -1.78 0.14 113.55 116.96 3a0w h SER 719 Ca 0.03 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.19 3a0w h SER 719 Cb 0.63 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3a0w h SER 719 CO 0.05 0.71 -0.32 0.40 -0.87 0.00 0.00 176.83 176.80 3a0w h ILE 720 N 1.17 1.28 -0.44 0.95 2.04 -1.72 -0.30 117.51 120.51 3a0w h ILE 720 Ca 0.32 -1.49 0.08 0.00 1.00 0.00 0.00 64.86 64.78 3a0w h ILE 720 Cb -0.12 1.44 -0.07 0.00 -0.74 0.00 0.00 36.82 37.33 3a0w h ILE 720 CO -0.08 0.49 0.00 0.00 0.00 0.00 0.00 178.15 178.57 3a0w h ARG 722 N 0.12 0.92 -0.46 0.00 2.43 -0.60 -0.83 114.38 115.95 3a0w h ARG 722 Ca 0.22 -0.14 0.09 0.00 -0.81 0.00 0.00 59.98 59.34 3a0w h ARG 722 Cb 0.31 -0.16 -0.08 0.00 -0.42 0.00 0.00 29.97 29.62 3a0w h ARG 722 CO -0.36 0.73 -0.02 -0.22 -1.51 0.00 0.00 179.97 178.60 3a0w h LYS 723 N 0.87 0.09 0.09 0.20 3.64 -0.27 0.20 116.57 121.40 3a0w h LYS 723 Ca 0.22 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3a0w h LYS 723 Cb 0.12 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3a0w h LYS 723 CO -0.03 0.06 -0.04 0.82 -2.27 0.00 0.00 179.45 177.99 3a0w h ILE 724 N 0.09 1.04 -0.07 2.00 2.04 -0.42 -0.39 117.51 121.80 3a0w h ILE 724 Ca 0.23 -0.49 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 3a0w h ILE 724 Cb 0.34 1.35 -0.00 0.00 -0.74 0.00 0.00 36.82 37.77 3a0w h ILE 724 CO -0.39 0.12 -0.02 0.40 0.00 0.00 0.00 178.15 178.26 3a0w h ILE 725 N -0.35 1.30 0.08 -0.67 1.08 -1.00 -2.13 117.51 115.83 3a0w h ILE 725 Ca -0.01 -0.94 -0.31 0.00 -0.39 0.00 0.00 64.86 63.20 3a0w h ILE 725 Cb 0.29 1.78 -0.02 0.00 -3.07 0.00 0.00 36.82 35.80 3a0w h ILE 725 CO 0.02 0.26 -1.68 -0.33 -0.69 0.00 0.00 178.15 175.73 3a0w h GLU 726 N -0.20 0.17 0.03 2.37 5.08 -0.66 -0.15 114.58 121.22 3a0w h GLU 726 Ca 0.02 -0.30 -0.16 0.00 -1.00 0.00 0.00 59.36 57.92 3a0w h GLU 726 Cb 0.42 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 3a0w h GLU 726 CO 0.01 1.14 -0.84 -0.44 -1.00 0.00 0.00 179.01 177.88 3a0w h ASP 727 N -0.35 0.11 0.73 1.42 3.32 -1.17 -2.62 116.42 117.86 3a0w h ASP 727 Ca -0.39 -0.78 -0.23 0.00 0.02 0.00 0.00 57.03 55.66 3a0w h ASP 727 Cb 1.75 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 41.25 3a0w h ASP 727 CO -0.02 1.35 -1.03 -0.33 -1.72 0.00 0.00 179.24 177.49 3a0w h GLU 728 N -0.81 0.16 -0.01 3.56 5.08 -1.04 -3.38 114.58 118.15 3a0w h GLU 728 Ca -0.21 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 3a0w h GLU 728 Cb 1.32 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.65 3a0w h GLU 728 CO -0.06 1.05 -0.08 0.72 -1.00 0.00 0.00 179.01 179.64 3a0w n HIS 729 N -3.52 0.00 -1.98 4.33 8.25 -0.81 -5.01 115.22 116.48 3a0w n HIS 729 Ca -0.04 0.00 -0.10 0.00 -0.26 0.00 0.00 57.72 57.32 3a0w n HIS 729 Cb 0.92 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.01 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 0.57 0.24 0.00 -1.41 0.00 -0.99 -4.24 105.19 99.37 3a0w n GLY 730 Ca 0.03 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.19 2.74 3.19 -0.02 0.00 -0.10 -4.69 105.19 105.12 3a0w n GLY 731 Ca -0.12 -1.90 -0.13 0.00 0.00 0.00 0.00 46.02 43.88 3a0w n GLY 731 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3a0w s LYS 732 N 3.40 0.37 0.01 1.61 2.20 -0.64 -4.33 119.74 122.36 3a0w s LYS 732 Ca 0.00 0.36 0.03 0.00 -0.36 0.00 0.00 55.97 55.99 3a0w s LYS 732 Cb 0.00 0.18 -0.01 0.00 -1.51 0.00 0.00 37.83 36.49 3a0w s LYS 732 CO 0.00 -0.05 -0.09 -1.50 -0.36 0.00 0.00 175.35 173.35 3a0w s ILE 733 N 0.02 0.71 0.29 5.43 2.07 -1.26 -1.13 121.20 127.33 3a0w s ILE 733 Ca -0.01 -0.61 -0.20 0.00 -1.41 0.00 0.00 60.65 58.42 3a0w s ILE 733 Cb -0.02 -0.64 0.04 0.00 0.13 0.00 0.00 42.46 41.97 3a0w s ILE 733 CO 0.01 0.04 0.81 -1.66 -1.91 0.00 0.00 174.94 172.23 3a0w s TRP 734 N -0.54 -0.05 0.06 3.50 -2.14 -0.48 -5.00 118.94 114.28 3a0w s TRP 734 Ca 0.00 -0.45 0.05 0.00 2.66 0.00 0.00 56.10 58.37 3a0w s TRP 734 Cb -0.05 0.74 -0.03 0.00 -3.10 0.00 0.00 33.47 31.03 3a0w s TRP 734 CO 0.00 -1.26 -0.15 -0.08 -2.66 0.00 0.00 176.95 172.81 3a0w s THR 735 N -3.12 1.15 0.05 0.66 -1.32 -1.26 -0.68 115.64 111.12 3a0w s THR 735 Ca 0.14 -1.23 0.01 0.00 -1.21 0.00 0.00 61.69 59.39 3a0w s THR 735 Cb -0.05 -1.08 -0.03 0.00 -1.51 0.00 0.00 72.50 69.83 3a0w s THR 735 CO 0.08 -0.15 -0.05 -1.61 -2.21 0.00 0.00 174.62 170.68 3a0w s GLU 736 N -1.57 0.57 -0.13 7.08 2.02 -0.51 -5.01 118.70 121.15 3a0w s GLU 736 Ca -0.00 -0.97 -0.21 0.00 0.02 0.00 0.00 54.97 53.81 3a0w s GLU 736 Cb -0.09 -0.06 -0.03 0.00 0.10 0.00 0.00 34.13 34.04 3a0w s GLU 736 CO 0.02 -0.03 0.60 -0.80 0.02 0.00 0.00 175.26 175.07 3a0w s ASN 737 N -2.21 6.78 -0.04 -0.19 0.01 -1.26 -0.92 114.94 117.11 3a0w s ASN 737 Ca -0.02 0.94 -0.02 0.00 -0.71 0.00 0.00 52.86 53.05 3a0w s ASN 737 Cb -0.02 -2.35 0.03 0.00 0.41 0.00 0.00 41.25 39.32 3a0w s ASN 737 CO -0.04 -0.12 0.08 -0.13 -1.51 0.00 0.00 177.10 175.38 3a0w s ARG 738 N 1.10 0.04 3.52 -0.60 0.52 -0.44 -4.95 118.95 118.14 3a0w s ARG 738 Ca 0.30 0.22 0.00 0.00 -0.52 0.00 0.00 55.73 55.74 3a0w s ARG 738 Cb -0.16 -0.14 0.00 0.00 0.52 0.00 0.00 34.95 35.17 3a0w s ARG 738 CO 0.13 -0.12 0.00 0.39 0.02 0.00 0.00 175.30 175.72 3a0w n GLU 739 N 3.86 0.00 -1.34 3.54 -0.58 -1.26 -1.15 120.64 123.71 3a0w n GLU 739 Ca -0.23 0.00 -0.26 0.00 -0.42 0.00 0.00 57.16 56.25 3a0w n GLU 739 Cb 0.53 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 31.40 3a0w n GLU 739 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 3a0w n ASN 740 N -0.33 6.74 0.00 1.62 6.94 -1.26 -4.90 115.26 124.07 3a0w n ASN 740 Ca 0.00 -3.31 0.00 0.00 -0.02 0.00 0.00 54.58 51.25 3a0w n ASN 740 Cb 0.00 -1.13 0.00 0.00 -2.36 0.00 0.00 39.78 36.29 3a0w n ASN 740 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3a0w n GLY 741 N 0.34 2.24 2.86 4.83 0.00 -0.30 -1.14 105.19 114.04 3a0w n GLY 741 Ca 0.45 -0.48 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.52 0.10 -0.06 1.61 1.01 -0.55 -1.32 120.40 119.66 3a0w s VAL 742 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 61.98 62.01 3a0w s VAL 742 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 36.38 36.23 3a0w s VAL 742 CO 0.00 0.06 -0.10 0.54 0.00 0.00 0.00 175.10 175.60 3a0w s VAL 743 N 0.32 3.40 -0.16 2.92 0.11 -0.10 -1.23 120.40 125.65 3a0w s VAL 743 Ca -0.03 -0.59 -0.05 0.00 -2.93 0.00 0.00 61.98 58.38 3a0w s VAL 743 Cb -0.05 -2.37 -0.03 0.00 -1.53 0.00 0.00 36.38 32.40 3a0w s VAL 743 CO -0.01 0.59 0.01 -0.36 -3.33 0.00 0.00 175.10 172.00 3a0w s PHE 744 N -0.70 3.13 -0.05 1.54 0.40 0.07 -1.43 117.98 120.94 3a0w s PHE 744 Ca 0.11 -0.11 0.04 0.00 -0.60 0.00 0.00 56.93 56.37 3a0w s PHE 744 Cb -0.11 -2.00 0.00 0.00 0.51 0.00 0.00 43.02 41.42 3a0w s PHE 744 CO 0.01 0.08 -0.17 0.42 0.70 0.00 0.00 175.22 176.26 3a0w s ILE 745 N 0.30 1.43 0.09 0.64 1.01 0.14 -0.70 121.20 124.11 3a0w s ILE 745 Ca -0.00 -0.70 0.08 0.00 0.00 0.00 0.00 60.65 60.03 3a0w s ILE 745 Cb -0.13 -1.24 -0.03 0.00 0.01 0.00 0.00 42.46 41.06 3a0w s ILE 745 CO 0.02 0.41 -0.20 0.72 0.00 0.00 0.00 174.94 175.89 3a0w s PHE 746 N 0.19 1.73 0.02 3.97 -0.12 -0.16 -1.39 117.98 122.21 3a0w s PHE 746 Ca -0.07 -0.41 0.05 0.00 -0.05 0.00 0.00 56.93 56.44 3a0w s PHE 746 Cb -0.13 -0.96 -0.02 0.00 -0.63 0.00 0.00 43.02 41.28 3a0w s PHE 746 CO 0.03 0.17 -0.15 -1.21 -0.05 0.00 0.00 175.22 174.01 3a0w s GLU 747 N -1.77 1.13 0.07 1.99 2.02 -0.28 -0.76 118.70 121.10 3a0w s GLU 747 Ca 0.06 -0.68 0.04 0.00 0.02 0.00 0.00 54.97 54.40 3a0w s GLU 747 Cb -0.10 -1.13 -0.03 0.00 0.10 0.00 0.00 34.13 32.97 3a0w s GLU 747 CO 0.04 0.30 -0.11 0.96 0.02 0.00 0.00 175.26 176.46 3a0w s ILE 748 N -0.61 0.88 0.55 -1.63 -4.36 -0.89 -1.63 121.20 113.51 3a0w s ILE 748 Ca 0.04 -1.36 -0.22 0.00 -0.26 0.00 0.00 60.65 58.85 3a0w s ILE 748 Cb -0.07 -1.04 -0.05 0.00 1.25 0.00 0.00 42.46 42.55 3a0w s ILE 748 CO 0.00 -0.40 1.37 -2.84 0.24 0.00 0.00 174.94 173.32 3a0w s PRO 749 N -2.08 3.11 0.44 0.37 0.02 -1.26 -1.22 135.00 134.38 3a0w s PRO 749 Ca -0.02 2.27 0.10 0.00 0.02 0.00 0.00 61.00 63.38 3a0w s PRO 749 Cb -0.07 -2.26 0.96 0.00 0.02 0.00 0.00 34.50 33.15 3a0w s PRO 749 CO 0.01 -1.23 2.06 0.87 -0.33 0.00 0.00 177.00 178.38 3a0w h LYS 750 N 1.44 0.32 -3.95 5.54 1.57 -1.56 -3.43 116.57 116.50 3a0w h LYS 750 Ca -0.51 -0.03 -0.20 0.00 -1.87 0.00 0.00 60.65 58.04 3a0w h LYS 750 Cb 1.30 -0.07 -0.24 0.00 0.08 0.00 0.00 32.23 33.31 3a0w h LYS 750 CO 0.57 0.26 -0.71 0.95 -0.57 0.00 0.00 179.45 179.95 3a0w s THR 751 N -5.22 0.11 1.15 -0.16 -4.23 -1.26 -0.48 115.64 105.55 3a0w s THR 751 Ca -0.07 -0.61 -0.18 0.00 -1.18 0.00 0.00 61.69 59.66 3a0w s THR 751 Cb 0.17 -0.21 0.26 0.00 1.34 0.00 0.00 72.50 74.07 3a0w s THR 751 CO 0.71 -0.31 1.13 -2.16 -0.54 0.00 0.00 174.62 173.45 3a0w s PRO 752 N -0.95 -0.81 0.00 3.99 0.04 -1.26 -5.03 135.00 130.98 3a0w s PRO 752 Ca -0.10 -0.02 0.00 0.00 0.04 0.00 0.00 61.00 60.92 3a0w s PRO 752 Cb -0.07 -1.64 0.00 0.00 0.04 0.00 0.00 34.50 32.83 3a0w s PRO 752 CO -0.01 -3.45 0.30 0.39 0.04 0.00 0.00 177.00 174.28