#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zub s PRO 598 N 0.00 0.19 0.03 -0.41 0.04 -1.26 -4.93 135.00 128.66 1zub s PRO 598 Ca 0.00 0.31 -0.02 0.00 0.04 0.00 0.00 61.00 61.33 1zub s PRO 598 Cb 0.00 -1.73 -0.04 0.00 0.04 0.00 0.00 34.50 32.77 1zub s PRO 598 CO 0.00 -2.84 0.21 0.08 0.04 0.00 0.00 177.00 174.49 1zub s VAL 599 N -3.06 5.39 0.08 -0.36 1.01 -1.26 -4.99 120.40 117.20 1zub s VAL 599 Ca 0.66 -0.21 0.05 0.00 0.00 0.00 0.00 61.98 62.48 1zub s VAL 599 Cb -0.16 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1zub s VAL 599 CO 0.56 0.24 -0.14 0.42 0.00 0.00 0.00 175.10 176.18 1zub s THR 600 N -1.42 1.12 -0.15 3.92 -4.23 -1.25 -5.01 115.64 108.62 1zub s THR 600 Ca 0.31 -1.39 0.00 0.00 -1.18 0.00 0.00 61.69 59.43 1zub s THR 600 Cb -0.13 -1.16 0.03 0.00 1.34 0.00 0.00 72.50 72.59 1zub s THR 600 CO 0.23 -0.29 -0.10 0.26 -0.54 0.00 0.00 174.62 174.18 1zub s TRP 601 N -1.51 1.91 0.26 3.99 0.52 -1.26 -1.71 118.94 121.14 1zub s TRP 601 Ca 0.00 -1.10 0.10 0.00 0.02 0.00 0.00 56.10 55.12 1zub s TRP 601 Cb -0.09 -1.44 -0.04 0.00 -1.15 0.00 0.00 33.47 30.75 1zub s TRP 601 CO 0.02 -0.62 -0.07 1.14 0.02 0.00 0.00 176.95 177.43 1zub s GLN 602 N 1.57 2.08 0.37 4.98 -2.07 0.30 -4.87 119.66 122.02 1zub s GLN 602 Ca 0.03 -1.50 -0.25 0.00 -1.82 0.00 0.00 55.36 51.82 1zub s GLN 602 Cb -0.14 -2.04 -0.12 0.00 -1.09 0.00 0.00 33.01 29.62 1zub s GLN 602 CO -0.09 0.36 0.86 -0.35 -1.32 0.00 0.00 175.29 174.75 1zub n PRO 603 N -0.69 1.07 -1.09 9.60 -0.04 -1.26 -0.38 135.00 142.20 1zub n PRO 603 Ca -0.07 0.38 -0.16 0.00 -0.04 0.00 0.00 63.50 63.61 1zub n PRO 603 Cb 0.59 -1.78 0.11 0.00 -0.04 0.00 0.00 33.50 32.38 1zub n PRO 603 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1zub n SER 604 N 1.00 0.09 0.00 3.54 2.88 0.74 -4.57 113.62 117.30 1zub n SER 604 Ca 0.10 -1.29 0.12 0.00 -1.33 0.00 0.00 58.87 56.48 1zub n SER 604 Cb 0.36 -0.56 0.56 0.00 -0.75 0.00 0.00 64.21 63.82 1zub n SER 604 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 1zub n LYS 605 N -2.54 0.04 -0.01 -1.46 4.81 -1.26 -3.05 118.16 114.68 1zub n LYS 605 Ca 0.09 0.06 0.10 0.00 -0.87 0.00 0.00 58.31 57.69 1zub n LYS 605 Cb 0.32 -1.50 -0.16 0.00 0.02 0.00 0.00 35.03 33.71 1zub n LYS 605 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1zub n GLU 606 N -1.48 0.63 0.00 1.64 -0.58 -1.26 -5.00 120.64 114.58 1zub n GLU 606 Ca 0.07 -0.18 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 1zub n GLU 606 Cb 0.29 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.67 1zub n GLU 606 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1zub n GLY 607 N 1.36 2.38 0.32 0.62 0.00 -1.17 -4.73 105.19 103.95 1zub n GLY 607 Ca -0.05 -0.54 0.06 0.00 0.00 0.00 0.00 46.02 45.50 1zub n GLY 607 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1zub n ASP 608 N 1.67 0.93 -4.34 1.61 9.92 -1.26 -4.68 116.55 120.41 1zub n ASP 608 Ca 0.00 -1.78 -0.21 0.00 -0.53 0.00 0.00 54.79 52.26 1zub n ASP 608 Cb 0.00 -0.09 -0.11 0.00 -0.64 0.00 0.00 41.12 40.28 1zub n ASP 608 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1zub s ARG 609 N -1.82 1.29 -0.17 -1.24 3.52 -1.26 -5.04 118.95 114.22 1zub s ARG 609 Ca 0.21 -1.44 0.01 0.00 -0.13 0.00 0.00 55.73 54.38 1zub s ARG 609 Cb 0.11 -1.32 0.01 0.00 -1.56 0.00 0.00 34.95 32.19 1zub s ARG 609 CO 0.16 0.26 -0.18 -1.17 -0.81 0.00 0.00 175.30 173.56 1zub s LEU 610 N -2.75 2.26 0.02 -0.88 1.98 -1.26 -0.19 118.68 117.85 1zub s LEU 610 Ca 0.17 -0.59 0.01 0.00 -2.89 0.00 0.00 54.13 50.83 1zub s LEU 610 Cb -0.05 -1.51 -0.04 0.00 0.66 0.00 0.00 46.19 45.25 1zub s LEU 610 CO 0.07 0.02 0.07 -0.63 -1.89 0.00 0.00 176.35 173.99 1zub s ILE 611 N 1.16 4.58 0.09 6.68 -1.09 0.49 -1.83 121.20 131.28 1zub s ILE 611 Ca 0.02 -0.54 0.00 0.00 -2.23 0.00 0.00 60.65 57.90 1zub s ILE 611 Cb -0.14 -3.11 -0.04 0.00 -1.58 0.00 0.00 42.46 37.59 1zub s ILE 611 CO -0.08 0.29 -0.04 -0.83 -1.23 0.00 0.00 174.94 173.05 1zub s GLY 612 N -1.88 0.70 -0.20 6.18 0.00 -1.22 0.11 107.32 111.01 1zub s GLY 612 Ca 0.24 -1.32 -0.03 0.00 0.00 0.00 0.00 44.72 43.61 1zub s GLY 612 CO 0.15 -1.40 -0.08 1.09 0.00 0.00 0.00 173.10 172.87 1zub s ARG 613 N -3.89 3.32 -0.09 2.90 1.70 -0.70 -3.21 118.95 118.98 1zub s ARG 613 Ca 0.12 -0.66 0.04 0.00 -0.47 0.00 0.00 55.73 54.75 1zub s ARG 613 Cb 0.07 -2.90 -0.01 0.00 -0.57 0.00 0.00 34.95 31.54 1zub s ARG 613 CO -0.06 -0.15 -0.21 0.08 -1.08 0.00 0.00 175.30 173.88 1zub s VAL 614 N 1.30 2.34 -0.17 4.99 1.01 0.65 -3.96 120.40 126.57 1zub s VAL 614 Ca 0.04 -0.93 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 1zub s VAL 614 Cb -0.14 -1.91 -0.00 0.00 0.00 0.00 0.00 36.38 34.33 1zub s VAL 614 CO -0.04 0.56 -0.12 -0.63 0.00 0.00 0.00 175.10 174.87 1zub s ILE 615 N 0.16 2.91 0.12 2.22 -1.09 -1.26 0.14 121.20 124.40 1zub s ILE 615 Ca -0.12 -0.68 0.08 0.00 -2.23 0.00 0.00 60.65 57.71 1zub s ILE 615 Cb -0.16 -2.26 -0.04 0.00 -1.58 0.00 0.00 42.46 38.42 1zub s ILE 615 CO 0.06 0.49 -0.21 -0.76 -1.23 0.00 0.00 174.94 173.30 1zub s LEU 616 N 0.96 2.33 -0.19 2.97 1.43 0.17 -4.72 118.68 121.64 1zub s LEU 616 Ca -0.02 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.35 1zub s LEU 616 Cb -0.15 -0.89 0.02 0.00 0.03 0.00 0.00 46.19 45.20 1zub s LEU 616 CO -0.01 0.04 -0.18 0.20 0.23 0.00 0.00 176.35 176.64 1zub s ASN 617 N -2.09 3.32 -1.10 2.29 0.01 -1.26 0.14 114.94 116.24 1zub s ASN 617 Ca 0.09 -0.62 -0.10 0.00 -0.71 0.00 0.00 52.86 51.53 1zub s ASN 617 Cb -0.09 -1.52 -0.07 0.00 0.41 0.00 0.00 41.25 39.98 1zub s ASN 617 CO 0.05 -0.00 2.29 0.29 -1.51 0.00 0.00 177.10 178.21 1zub n LYS 618 N 4.65 2.43 -0.15 -0.60 5.02 -1.26 -4.58 118.16 123.67 1zub n LYS 618 Ca -0.21 -1.77 -0.02 0.00 -2.02 0.00 0.00 58.31 54.29 1zub n LYS 618 Cb 0.50 -2.67 0.21 0.00 -0.02 0.00 0.00 35.03 33.05 1zub n LYS 618 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1zub h ARG 619 N 6.22 0.86 -1.02 1.97 2.47 -1.87 -3.46 114.38 119.55 1zub h ARG 619 Ca 0.58 -0.14 -0.34 0.00 -1.26 0.00 0.00 59.98 58.81 1zub h ARG 619 Cb 0.30 -0.15 -0.14 0.00 -1.65 0.00 0.00 29.97 28.34 1zub h ARG 619 CO 1.64 0.72 -0.31 0.25 0.56 0.00 0.00 179.97 182.83 1zub n THR 620 N -4.31 0.00 -2.79 2.04 -2.24 -1.19 -4.80 114.28 100.99 1zub n THR 620 Ca 0.05 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.73 1zub n THR 620 Cb 0.18 -1.68 0.06 0.00 -2.10 0.00 0.00 70.33 66.79 1zub n THR 620 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1zub n THR 621 N -2.18 -0.05 -2.25 4.28 -2.24 -0.87 -4.68 114.28 106.29 1zub n THR 621 Ca -0.17 -1.79 -0.42 0.00 -2.27 0.00 0.00 64.05 59.40 1zub n THR 621 Cb 0.59 1.22 -0.03 0.00 -2.10 0.00 0.00 70.33 70.01 1zub n THR 621 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1zub s MET 622 N 0.26 4.39 0.49 -0.78 -1.94 -0.57 -4.89 119.30 116.25 1zub s MET 622 Ca 0.28 2.01 0.32 0.00 -1.71 0.00 0.00 55.69 56.59 1zub s MET 622 Cb 0.26 -3.23 1.38 0.00 2.01 0.00 0.00 34.83 35.25 1zub s MET 622 CO -0.15 -0.27 1.95 -1.00 -0.01 0.00 0.00 175.02 175.54 1zub h PRO 623 N 5.76 0.00 0.06 2.03 0.13 -1.97 -2.66 132.00 135.35 1zub h PRO 623 Ca -0.44 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.43 1zub h PRO 623 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1zub h PRO 623 CO 0.79 0.00 -1.28 1.57 -0.23 0.00 0.00 178.00 178.85 1zub h LYS 624 N 0.00 0.13 0.00 0.86 -0.00 -1.91 -3.47 116.57 112.18 1zub h LYS 624 Ca 0.00 -0.22 0.00 0.00 -0.00 0.00 0.00 60.65 60.43 1zub h LYS 624 Cb 0.41 0.08 0.00 0.00 -0.00 0.00 0.00 32.23 32.72 1zub h LYS 624 CO 0.00 1.01 0.00 -0.85 -0.00 0.00 0.00 179.45 179.61 1zub n GLU 625 N -3.38 0.00 0.00 0.07 0.28 -1.04 -5.10 120.64 111.47 1zub n GLU 625 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.92 1zub n GLU 625 Cb 1.00 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.87 1zub n GLU 625 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1zub n SER 626 N -0.79 0.00 -1.37 -1.84 7.64 -1.03 -4.76 113.62 111.47 1zub n SER 626 Ca 0.00 0.00 0.16 0.00 1.01 0.00 0.00 58.87 60.04 1zub n SER 626 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 1zub n SER 626 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1zub n GLY 627 N 0.00 -2.68 0.33 0.23 0.00 -1.26 -1.52 105.19 100.29 1zub n GLY 627 Ca 0.00 -0.94 -0.02 0.00 0.00 0.00 0.00 46.02 45.06 1zub n GLY 627 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zub n ALA 628 N -3.67 2.26 -1.72 4.61 0.00 -1.26 -4.44 120.51 116.29 1zub n ALA 628 Ca -0.06 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1zub n ALA 628 Cb 0.65 0.45 0.00 0.00 0.00 0.00 0.00 19.45 20.55 1zub n ALA 628 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1zub n LEU 629 N -2.76 0.00 -0.00 0.00 7.99 -1.26 -4.46 117.00 116.50 1zub n LEU 629 Ca -0.04 0.00 -0.01 0.00 -0.01 0.00 0.00 56.01 55.95 1zub n LEU 629 Cb 0.54 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.85 1zub n LEU 629 CO 0.02 0.00 -0.53 0.00 -1.51 0.00 0.00 177.39 175.37 1zub n LEU 630 N 0.00 1.76 0.00 2.23 -0.00 -1.26 -3.18 117.00 116.55 1zub n LEU 630 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1zub n LEU 630 Cb 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 43.42 43.39 1zub n LEU 630 CO 0.00 0.31 0.00 0.61 -0.00 0.00 0.00 177.39 178.31 1zub n GLY 631 N 3.24 -0.28 3.51 1.47 0.00 -1.26 -0.93 105.19 110.94 1zub n GLY 631 Ca -0.02 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.84 1zub n GLY 631 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1zub s LEU 632 N 0.00 -0.62 -0.18 0.99 2.34 -1.26 -1.25 118.68 118.70 1zub s LEU 632 Ca 0.00 0.59 -0.09 0.00 0.06 0.00 0.00 54.13 54.70 1zub s LEU 632 Cb 0.00 2.49 -0.05 0.00 -0.56 0.00 0.00 46.19 48.07 1zub s LEU 632 CO 0.00 -0.64 0.10 -0.75 -1.06 0.00 0.00 176.35 174.01 1zub s LYS 633 N -1.54 4.01 0.17 1.48 2.20 0.25 -4.99 119.74 121.32 1zub s LYS 633 Ca -0.09 -0.26 0.11 0.00 -0.36 0.00 0.00 55.97 55.37 1zub s LYS 633 Cb -0.00 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 1zub s LYS 633 CO 0.06 0.35 -0.23 0.08 -0.36 0.00 0.00 175.35 175.25 1zub s VAL 634 N 0.18 2.18 0.21 4.02 1.01 -1.26 0.50 120.40 127.24 1zub s VAL 634 Ca 0.07 -1.93 0.09 0.00 0.00 0.00 0.00 61.98 60.21 1zub s VAL 634 Cb -0.12 -2.00 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1zub s VAL 634 CO -0.01 -0.12 -0.06 -0.69 0.00 0.00 0.00 175.10 174.23 1zub s VAL 635 N -1.60 3.30 0.06 2.92 1.01 0.32 -4.85 120.40 121.56 1zub s VAL 635 Ca 0.18 -1.73 0.07 0.00 0.00 0.00 0.00 61.98 60.50 1zub s VAL 635 Cb -0.08 -2.68 -0.03 0.00 0.00 0.00 0.00 36.38 33.59 1zub s VAL 635 CO 0.08 -0.19 -0.19 -0.83 0.00 0.00 0.00 175.10 173.96 1zub s GLY 636 N -3.10 1.08 0.00 4.51 0.00 -1.26 -2.37 107.32 106.18 1zub s GLY 636 Ca 0.27 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.93 1zub s GLY 636 CO 0.17 -1.02 0.00 0.61 0.00 0.00 0.00 173.10 172.86 1zub n GLY 637 N 1.64 0.18 2.80 0.20 0.00 -0.98 -3.29 105.19 105.73 1zub n GLY 637 Ca -0.18 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 1zub n GLY 637 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1zub s LYS 638 N -2.97 1.32 -0.40 1.61 -0.14 -1.19 -4.67 119.74 113.31 1zub s LYS 638 Ca 0.00 -1.91 -0.28 0.00 -1.36 0.00 0.00 55.97 52.42 1zub s LYS 638 Cb 0.00 -2.55 -0.07 0.00 -1.68 0.00 0.00 37.83 33.53 1zub s LYS 638 CO 0.00 -1.09 2.34 -0.12 -0.76 0.00 0.00 175.35 175.72 1zub n MET 639 N 3.81 1.35 -1.97 1.68 0.00 -1.26 -2.94 117.12 117.81 1zub n MET 639 Ca 0.05 0.22 -0.30 0.00 -0.00 0.00 0.00 57.70 57.67 1zub n MET 639 Cb 0.36 -3.23 0.21 0.00 0.00 0.00 0.00 33.22 30.56 1zub n MET 639 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1zub s THR 640 N 10.32 2.00 0.08 1.12 -4.23 -0.12 -4.92 115.64 119.89 1zub s THR 640 Ca 1.02 -0.02 0.33 0.00 -1.18 0.00 0.00 61.69 61.83 1zub s THR 640 Cb -0.32 -2.98 0.35 0.00 1.34 0.00 0.00 72.50 70.89 1zub s THR 640 CO 0.32 0.00 1.99 0.44 -0.54 0.00 0.00 174.62 176.83 1zub h ASP 641 N -1.74 0.00 0.56 3.99 3.32 -1.92 -2.30 116.42 118.33 1zub h ASP 641 Ca -0.44 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.50 1zub h ASP 641 Cb 1.21 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.75 1zub h ASP 641 CO 0.31 0.00 -0.54 -0.07 -1.72 0.00 0.00 179.24 177.23 1zub h LEU 642 N 0.00 0.00 0.00 1.55 -0.00 -1.99 -3.47 115.31 111.41 1zub h LEU 642 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 1zub h LEU 642 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.95 1zub h LEU 642 CO 0.00 0.54 0.00 0.61 -0.00 0.00 0.00 178.44 179.59 1zub n GLY 643 N 0.05 1.33 3.36 0.83 0.00 -0.86 -5.12 105.19 104.78 1zub n GLY 643 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 1zub n GLY 643 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1zub s ARG 644 N -0.26 1.46 0.18 1.61 0.52 -1.26 -4.93 118.95 116.26 1zub s ARG 644 Ca 0.00 -1.78 -0.07 0.00 -0.52 0.00 0.00 55.73 53.36 1zub s ARG 644 Cb 0.00 -0.53 -0.06 0.00 0.52 0.00 0.00 34.95 34.88 1zub s ARG 644 CO 0.00 -0.21 0.45 -0.51 0.02 0.00 0.00 175.30 175.06 1zub s LEU 645 N -3.36 4.23 0.00 2.53 1.43 -1.26 -0.95 118.68 121.30 1zub s LEU 645 Ca 0.35 0.75 0.00 0.00 -1.03 0.00 0.00 54.13 54.20 1zub s LEU 645 Cb 0.08 -3.45 0.00 0.00 0.03 0.00 0.00 46.19 42.85 1zub s LEU 645 CO 0.13 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.32 1zub n GLY 646 N 0.05 4.13 3.17 -3.19 0.00 -1.15 -1.29 105.19 106.91 1zub n GLY 646 Ca -0.02 -1.09 -0.23 0.00 0.00 0.00 0.00 46.02 44.69 1zub n GLY 646 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zub s ALA 647 N -1.51 1.39 0.01 4.61 0.00 -1.24 -2.32 121.76 122.70 1zub s ALA 647 Ca 0.00 -0.84 0.03 0.00 0.00 0.00 0.00 51.96 51.15 1zub s ALA 647 Cb 0.00 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 1zub s ALA 647 CO 0.00 0.31 -0.08 -0.06 0.00 0.00 0.00 175.76 175.92 1zub s PHE 648 N -0.66 0.74 -0.24 0.00 0.40 -1.00 -1.51 117.98 115.71 1zub s PHE 648 Ca 0.05 -0.24 -0.25 0.00 -0.60 0.00 0.00 56.93 55.89 1zub s PHE 648 Cb -0.07 -0.46 -0.00 0.00 0.51 0.00 0.00 43.02 42.99 1zub s PHE 648 CO 0.01 -0.02 0.85 0.42 0.70 0.00 0.00 175.22 177.18 1zub s ILE 649 N -0.54 4.83 0.09 0.64 1.01 -0.97 0.12 121.20 126.37 1zub s ILE 649 Ca -0.00 1.61 0.06 0.00 0.00 0.00 0.00 60.65 62.32 1zub s ILE 649 Cb -0.05 -4.13 -0.23 0.00 0.01 0.00 0.00 42.46 38.06 1zub s ILE 649 CO 0.00 -0.07 1.18 0.71 0.00 0.00 0.00 174.94 176.76 1zub h THR 650 N 5.41 1.58 -1.61 2.92 1.35 -0.28 0.68 112.91 122.96 1zub h THR 650 Ca -0.23 -3.28 0.09 0.00 -0.55 0.00 0.00 66.41 62.44 1zub h THR 650 Cb 1.09 2.82 -0.22 0.00 -1.73 0.00 0.00 68.15 70.11 1zub h THR 650 CO 0.88 0.91 0.55 -1.59 -0.25 0.00 0.00 175.52 176.02 1zub s LYS 651 N -2.69 0.60 -0.04 4.72 -2.85 -1.22 -4.74 119.74 113.52 1zub s LYS 651 Ca -0.01 0.10 0.07 0.00 -1.00 0.00 0.00 55.97 55.13 1zub s LYS 651 Cb 0.09 0.28 -0.01 0.00 -2.06 0.00 0.00 37.83 36.13 1zub s LYS 651 CO 0.83 -0.20 -0.24 0.14 0.10 0.00 0.00 175.35 175.98 1zub s VAL 652 N -1.29 1.97 -0.55 1.79 -7.23 -1.26 0.85 120.40 114.67 1zub s VAL 652 Ca -0.01 -1.04 -0.25 0.00 -1.81 0.00 0.00 61.98 58.87 1zub s VAL 652 Cb -0.01 -1.65 0.04 0.00 0.56 0.00 0.00 36.38 35.32 1zub s VAL 652 CO 0.01 0.55 1.01 -0.54 -0.31 0.00 0.00 175.10 175.82 1zub s LYS 653 N -0.32 3.41 -0.39 4.82 1.02 -0.38 -4.97 119.74 122.93 1zub s LYS 653 Ca 0.02 -0.07 -0.27 0.00 0.02 0.00 0.00 55.97 55.67 1zub s LYS 653 Cb -0.12 -4.03 -0.06 0.00 -0.52 0.00 0.00 37.83 33.10 1zub s LYS 653 CO 0.02 -1.51 2.35 1.63 -0.92 0.00 0.00 175.35 176.92 1zub n LYS 654 N 7.70 1.36 0.00 1.68 5.02 -1.26 -1.09 118.16 131.58 1zub n LYS 654 Ca 0.04 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.52 1zub n LYS 654 Cb 0.48 -3.36 0.00 0.00 -0.02 0.00 0.00 35.03 32.13 1zub n LYS 654 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1zub n GLY 655 N 5.94 1.85 3.77 0.72 0.00 -1.26 -5.10 105.19 111.10 1zub n GLY 655 Ca 0.35 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.07 1zub n GLY 655 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1zub s SER 656 N -1.47 2.69 0.10 1.61 0.01 -0.25 -4.72 113.70 111.67 1zub s SER 656 Ca 0.00 0.72 -0.27 0.00 1.31 0.00 0.00 55.95 57.70 1zub s SER 656 Cb 0.00 -1.08 -0.12 0.00 0.21 0.00 0.00 66.02 65.04 1zub s SER 656 CO 0.00 -3.04 1.66 -0.07 0.41 0.00 0.00 173.24 172.20 1zub h LEU 657 N -1.84 -0.58 -1.98 2.44 3.38 -1.35 -0.48 115.31 114.90 1zub h LEU 657 Ca -0.48 0.06 0.35 0.00 0.09 0.00 0.00 57.88 57.90 1zub h LEU 657 Cb 1.30 0.20 -0.05 0.00 0.09 0.00 0.00 40.66 42.20 1zub h LEU 657 CO 0.49 -0.32 0.88 0.00 0.09 0.00 0.00 178.44 179.58 1zub h ALA 658 N 0.26 3.13 0.00 1.53 0.00 -1.32 0.86 119.26 123.73 1zub h ALA 658 Ca 0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1zub h ALA 658 Cb 0.43 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1zub h ALA 658 CO -0.06 -1.50 -0.91 0.22 0.00 0.00 0.00 179.25 177.00 1zub h ASP 659 N 0.00 0.00 -0.15 0.00 3.58 -1.59 0.77 116.42 119.03 1zub h ASP 659 Ca 0.57 -0.55 -0.07 0.00 0.42 0.00 0.00 57.03 57.40 1zub h ASP 659 Cb 2.32 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 43.37 1zub h ASP 659 CO -0.01 1.30 -0.17 -0.37 -2.88 0.00 0.00 179.24 177.11 1zub h VAL 660 N -1.00 1.35 0.00 2.25 -1.51 -0.23 -2.28 116.25 114.83 1zub h VAL 660 Ca -0.24 -1.36 -0.36 0.00 -1.23 0.00 0.00 66.70 63.51 1zub h VAL 660 Cb 1.14 1.89 -0.07 0.00 -2.13 0.00 0.00 31.29 32.12 1zub h VAL 660 CO -0.15 0.40 -2.28 0.55 -1.23 0.00 0.00 177.57 174.86 1zub n VAL 661 N -4.52 1.43 -0.07 7.19 3.14 0.29 -4.61 118.33 121.18 1zub n VAL 661 Ca -0.06 -0.85 -0.10 0.00 -2.96 0.00 0.00 64.34 60.37 1zub n VAL 661 Cb 0.39 -0.56 -0.08 0.00 -1.06 0.00 0.00 33.84 32.53 1zub n VAL 661 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 1zub h GLY 662 N 3.90 0.00 -4.41 7.55 0.00 -0.52 -3.44 103.07 106.15 1zub h GLY 662 Ca -0.51 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.78 1zub h GLY 662 CO 0.04 0.00 -0.16 1.42 0.00 0.00 0.00 176.54 177.84 1zub n HIS 663 N -4.64 -1.67 -4.17 5.60 -0.00 0.26 -4.93 115.22 105.67 1zub n HIS 663 Ca -0.09 0.62 -0.13 0.00 -0.00 0.00 0.00 57.72 58.11 1zub n HIS 663 Cb 0.33 -3.17 -0.08 0.00 -0.00 0.00 0.00 29.99 27.07 1zub n HIS 663 CO 0.00 0.00 0.00 -0.48 -0.00 0.00 0.00 176.34 175.86 1zub s LEU 664 N -3.56 1.14 0.09 2.41 -0.00 -1.25 -5.04 118.68 112.46 1zub s LEU 664 Ca 0.08 -1.41 -0.02 0.00 -0.00 0.00 0.00 54.13 52.79 1zub s LEU 664 Cb -0.01 0.76 -0.04 0.00 -0.00 0.00 0.00 46.19 46.90 1zub s LEU 664 CO 0.44 -0.99 0.03 -0.13 -0.00 0.00 0.00 176.35 175.70 1zub s ARG 665 N -3.85 0.78 0.01 1.48 0.52 -1.26 -4.87 118.95 111.76 1zub s ARG 665 Ca 0.36 -1.29 -0.34 0.00 -0.52 0.00 0.00 55.73 53.94 1zub s ARG 665 Cb 0.04 0.24 -0.12 0.00 0.52 0.00 0.00 34.95 35.63 1zub s ARG 665 CO 0.16 -0.19 1.79 0.00 0.02 0.00 0.00 175.30 177.08 1zub n ALA 666 N 0.00 1.16 0.00 2.13 0.00 -1.26 -2.27 120.51 120.27 1zub n ALA 666 Ca -0.10 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1zub n ALA 666 Cb 0.62 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1zub n ALA 666 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1zub n GLY 667 N 4.09 1.51 3.77 0.00 0.00 0.24 -4.92 105.19 109.88 1zub n GLY 667 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 1zub n GLY 667 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1zub s ASP 668 N -1.27 6.40 -0.40 1.61 1.01 -0.96 -4.65 116.67 118.41 1zub s ASP 668 Ca 0.00 2.91 -0.15 0.00 0.71 0.00 0.00 52.55 56.02 1zub s ASP 668 Cb 0.00 -2.66 0.01 0.00 1.01 0.00 0.00 42.92 41.28 1zub s ASP 668 CO 0.00 -0.82 0.31 -0.70 0.21 0.00 0.00 175.17 174.17 1zub s GLU 669 N -2.07 3.08 -0.50 8.23 2.12 -1.26 -2.29 118.70 126.01 1zub s GLU 669 Ca 0.53 -0.92 -0.20 0.00 0.36 0.00 0.00 54.97 54.75 1zub s GLU 669 Cb -0.44 -3.95 0.05 0.00 0.26 0.00 0.00 34.13 30.06 1zub s GLU 669 CO 0.59 -0.71 0.65 0.08 -0.54 0.00 0.00 175.26 175.33 1zub s VAL 670 N 1.75 4.83 -2.19 3.70 1.01 -0.57 -2.00 120.40 126.93 1zub s VAL 670 Ca 0.06 -0.35 0.21 0.00 0.00 0.00 0.00 61.98 61.90 1zub s VAL 670 Cb -0.18 -4.30 0.50 0.00 0.00 0.00 0.00 36.38 32.39 1zub s VAL 670 CO 0.11 -0.80 1.64 0.18 0.00 0.00 0.00 175.10 176.22 1zub n LEU 671 N 6.28 1.05 -3.69 3.92 7.99 -0.31 -3.70 117.00 128.53 1zub n LEU 671 Ca -0.05 -0.43 -0.11 0.00 -0.01 0.00 0.00 56.01 55.41 1zub n LEU 671 Cb 0.46 -0.06 -0.11 0.00 -0.11 0.00 0.00 43.42 43.60 1zub n LEU 671 CO 0.55 0.21 -0.00 -1.61 -1.51 0.00 0.00 177.39 175.03 1zub s GLU 672 N -1.88 0.32 -0.15 3.23 2.02 -1.16 -2.50 118.70 118.59 1zub s GLU 672 Ca 0.32 0.77 -0.01 0.00 0.02 0.00 0.00 54.97 56.07 1zub s GLU 672 Cb 0.16 0.01 0.04 0.00 0.10 0.00 0.00 34.13 34.44 1zub s GLU 672 CO 0.25 -0.18 -0.04 -0.46 0.02 0.00 0.00 175.26 174.85 1zub s TRP 673 N 1.64 1.43 -0.96 1.61 -0.11 -0.84 -1.40 118.94 120.32 1zub s TRP 673 Ca -0.07 -0.88 -0.04 0.00 1.22 0.00 0.00 56.10 56.33 1zub s TRP 673 Cb -0.10 -1.19 0.00 0.00 -1.50 0.00 0.00 33.47 30.69 1zub s TRP 673 CO -0.12 -0.56 0.54 -1.71 -4.62 0.00 0.00 176.95 170.49 1zub n ASN 674 N 4.95 -4.64 -0.54 5.86 2.85 -0.31 -2.45 115.26 120.98 1zub n ASN 674 Ca -0.11 -0.25 -0.07 0.00 -0.11 0.00 0.00 54.58 54.04 1zub n ASN 674 Cb 0.48 -3.40 -0.03 0.00 1.24 0.00 0.00 39.78 38.07 1zub n ASN 674 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1zub n GLY 675 N -1.34 0.88 3.60 8.20 0.00 -0.77 -4.79 105.19 110.95 1zub n GLY 675 Ca -0.04 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.34 1zub n GLY 675 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1zub s LYS 676 N -2.26 2.18 -0.26 1.61 2.20 -1.03 -5.09 119.74 117.09 1zub s LYS 676 Ca 0.00 -1.06 -0.25 0.00 -0.36 0.00 0.00 55.97 54.30 1zub s LYS 676 Cb 0.00 -2.31 -0.00 0.00 -1.51 0.00 0.00 37.83 34.01 1zub s LYS 676 CO 0.00 0.49 0.85 -1.25 -0.36 0.00 0.00 175.35 175.08 1zub s PRO 677 N -2.42 4.12 -0.09 4.03 0.04 -1.26 -1.99 135.00 137.44 1zub s PRO 677 Ca 0.23 0.88 -0.00 0.00 0.04 0.00 0.00 61.00 62.15 1zub s PRO 677 Cb -0.11 -3.67 -0.25 0.00 0.04 0.00 0.00 34.50 30.51 1zub s PRO 677 CO 0.15 -0.59 0.49 -0.07 0.04 0.00 0.00 177.00 177.02 1zub h LEU 678 N 9.32 0.28 -8.42 -3.56 3.38 -1.82 -3.47 115.31 111.03 1zub h LEU 678 Ca -0.23 -0.63 -0.79 0.00 0.09 0.00 0.00 57.88 56.32 1zub h LEU 678 Cb 1.09 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.73 1zub h LEU 678 CO 0.89 1.56 1.11 -2.65 0.09 0.00 0.00 178.44 179.45 1zub n PRO 679 N -3.34 0.17 0.00 1.13 -0.02 -1.26 0.27 135.00 131.95 1zub n PRO 679 Ca -0.26 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.27 1zub n PRO 679 Cb 1.05 -1.62 0.00 0.00 -0.02 0.00 0.00 33.50 32.91 1zub n PRO 679 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1zub n GLY 680 N 6.16 1.80 3.85 -1.23 0.00 -0.41 -4.91 105.19 110.45 1zub n GLY 680 Ca 0.45 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.10 1zub n GLY 680 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1zub s ALA 681 N -2.23 3.73 0.65 4.61 0.00 0.14 -4.70 121.76 123.96 1zub s ALA 681 Ca 0.00 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.62 1zub s ALA 681 Cb 0.00 -2.30 0.09 0.00 0.00 0.00 0.00 23.12 20.91 1zub s ALA 681 CO 0.00 0.53 0.59 -2.37 0.00 0.00 0.00 175.76 174.51 1zub n THR 682 N 1.55 0.00 -0.22 0.00 5.66 -1.26 -4.12 114.28 115.89 1zub n THR 682 Ca -0.13 -0.84 0.02 0.00 -3.05 0.00 0.00 64.05 60.06 1zub n THR 682 Cb 0.53 -1.20 0.13 0.00 -1.55 0.00 0.00 70.33 68.24 1zub n THR 682 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1zub h ASN 683 N -0.44 -0.09 -0.62 1.09 7.08 -1.82 0.82 115.58 121.60 1zub h ASN 683 Ca -0.20 0.14 -0.07 0.00 -3.08 0.00 0.00 56.30 53.10 1zub h ASN 683 Cb 0.69 0.21 -0.03 0.00 -2.08 0.00 0.00 38.32 37.11 1zub h ASN 683 CO 0.20 -0.05 0.14 1.05 -2.08 0.00 0.00 177.43 176.69 1zub h GLU 684 N 0.21 1.02 0.81 4.14 4.11 -1.94 -1.10 114.58 121.84 1zub h GLU 684 Ca 0.35 -0.24 -0.04 0.00 0.07 0.00 0.00 59.36 59.50 1zub h GLU 684 Cb 0.57 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1zub h GLU 684 CO -0.48 0.92 -0.39 0.93 0.07 0.00 0.00 179.01 180.05 1zub h GLU 685 N 0.97 -1.04 -0.91 1.06 5.08 -1.42 -2.90 114.58 115.41 1zub h GLU 685 Ca 0.20 0.07 0.24 0.00 -1.00 0.00 0.00 59.36 58.87 1zub h GLU 685 Cb 0.36 0.24 -0.13 0.00 0.50 0.00 0.00 28.75 29.72 1zub h GLU 685 CO 0.00 -0.70 0.39 0.28 -1.00 0.00 0.00 179.01 177.98 1zub h VAL 686 N -1.19 0.42 -0.77 3.13 2.07 -0.88 0.15 116.25 119.17 1zub h VAL 686 Ca -0.11 -0.12 0.16 0.00 0.82 0.00 0.00 66.70 67.45 1zub h VAL 686 Cb 0.83 0.03 -0.11 0.00 -1.52 0.00 0.00 31.29 30.53 1zub h VAL 686 CO 0.18 0.06 0.26 1.88 0.02 0.00 0.00 177.57 179.97 1zub h TYR 687 N 0.35 0.42 -0.55 1.57 0.05 -1.00 0.15 116.97 117.97 1zub h TYR 687 Ca 0.58 0.04 -0.06 0.00 0.05 0.00 0.00 58.73 59.34 1zub h TYR 687 Cb 1.15 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 38.80 1zub h TYR 687 CO -0.15 -0.02 0.11 -0.91 -1.05 0.00 0.00 178.16 176.14 1zub h ASN 688 N 0.36 0.86 0.33 3.88 2.35 -0.56 -1.49 115.58 121.31 1zub h ASN 688 Ca 0.44 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.92 1zub h ASN 688 Cb 0.73 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.87 1zub h ASN 688 CO -0.47 0.89 -0.17 0.40 -1.65 0.00 0.00 177.43 176.43 1zub h ILE 689 N 0.80 0.00 -0.06 2.81 5.03 -0.72 -0.12 117.51 125.25 1zub h ILE 689 Ca 0.17 0.00 0.04 0.00 -0.12 0.00 0.00 64.86 64.95 1zub h ILE 689 Cb 0.38 0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 34.12 1zub h ILE 689 CO 0.01 0.00 -0.26 0.40 -0.68 0.00 0.00 178.15 177.61 1zub h ILE 690 N -0.45 0.39 -0.41 -0.67 2.04 -1.29 -1.77 117.51 115.35 1zub h ILE 690 Ca -0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.90 1zub h ILE 690 Cb 0.35 0.39 -0.08 0.00 -0.74 0.00 0.00 36.82 36.74 1zub h ILE 690 CO 0.07 0.00 -0.13 -0.07 0.00 0.00 0.00 178.15 178.02 1zub h LEU 691 N -0.37 -0.45 -2.22 1.44 4.07 -1.32 0.43 115.31 116.88 1zub h LEU 691 Ca 0.08 0.13 0.05 0.00 0.08 0.00 0.00 57.88 58.22 1zub h LEU 691 Cb 0.49 0.28 -0.01 0.00 1.08 0.00 0.00 40.66 42.50 1zub h LEU 691 CO -0.27 -0.16 0.20 -0.33 -1.08 0.00 0.00 178.44 176.80 1zub h GLU 692 N -0.03 0.00 0.00 1.13 4.39 -0.53 0.19 114.58 119.73 1zub h GLU 692 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1zub h GLU 692 Cb 0.34 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.99 1zub h GLU 692 CO -0.44 0.00 -0.83 0.45 -1.16 0.00 0.00 179.01 177.03 1zub n SER 693 N -3.80 0.72 0.29 1.42 2.88 0.12 -4.15 113.62 111.09 1zub n SER 693 Ca 0.02 -0.55 0.14 0.00 -1.33 0.00 0.00 58.87 57.15 1zub n SER 693 Cb 0.33 0.69 0.88 0.00 -0.75 0.00 0.00 64.21 65.36 1zub n SER 693 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1zub h LYS 694 N 0.00 0.00 -0.01 -1.46 1.57 0.27 0.76 116.57 117.70 1zub h LYS 694 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1zub h LYS 694 Cb 0.55 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.86 1zub h LYS 694 CO 0.00 0.00 -0.31 0.45 -0.57 0.00 0.00 179.45 179.02 1zub n SER 695 N -3.94 1.37 -4.69 0.86 2.88 -1.25 -4.88 113.62 103.97 1zub n SER 695 Ca -0.03 -1.12 -0.41 0.00 -1.33 0.00 0.00 58.87 55.98 1zub n SER 695 Cb 0.10 0.23 -0.04 0.00 -0.75 0.00 0.00 64.21 63.75 1zub n SER 695 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1zub s GLU 696 N -2.47 4.40 0.32 -1.46 0.41 0.26 -4.93 118.70 115.24 1zub s GLU 696 Ca 0.23 1.11 0.21 0.00 -0.41 0.00 0.00 54.97 56.10 1zub s GLU 696 Cb 0.19 -3.52 1.12 0.00 -1.78 0.00 0.00 34.13 30.14 1zub s GLU 696 CO 0.53 -0.17 1.62 -2.30 -0.49 0.00 0.00 175.26 174.44 1zub n PRO 697 N 4.57 0.13 -3.91 0.39 -0.02 -1.26 -4.51 135.00 130.40 1zub n PRO 697 Ca 0.04 0.63 -0.10 0.00 -2.02 0.00 0.00 63.50 62.05 1zub n PRO 697 Cb 0.50 -1.98 -0.09 0.00 -0.02 0.00 0.00 33.50 31.91 1zub n PRO 697 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1zub s GLN 698 N -3.52 0.64 0.02 -0.52 0.74 -1.26 -3.99 119.66 111.77 1zub s GLN 698 Ca -0.02 -0.75 -0.03 0.00 0.05 0.00 0.00 55.36 54.61 1zub s GLN 698 Cb 0.06 0.25 -0.01 0.00 1.10 0.00 0.00 33.01 34.41 1zub s GLN 698 CO 0.19 -0.17 0.04 0.08 -0.55 0.00 0.00 175.29 174.87 1zub s VAL 699 N -2.74 0.12 -0.24 1.34 1.01 0.36 -4.94 120.40 115.31 1zub s VAL 699 Ca -0.04 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 60.99 1zub s VAL 699 Cb -0.00 -0.51 0.07 0.00 0.00 0.00 0.00 36.38 35.94 1zub s VAL 699 CO -0.05 -0.52 0.00 -0.70 0.00 0.00 0.00 175.10 173.83 1zub s GLU 700 N -1.82 1.16 -0.07 2.72 2.12 -1.26 0.43 118.70 121.98 1zub s GLU 700 Ca -0.12 -0.85 0.03 0.00 0.36 0.00 0.00 54.97 54.39 1zub s GLU 700 Cb -0.07 -2.37 -0.02 0.00 0.26 0.00 0.00 34.13 31.93 1zub s GLU 700 CO -0.02 -0.68 -0.14 0.96 -0.54 0.00 0.00 175.26 174.84 1zub s ILE 701 N 1.56 3.04 0.03 -3.70 -4.36 0.37 -1.16 121.20 116.99 1zub s ILE 701 Ca -0.01 -0.71 0.07 0.00 -0.26 0.00 0.00 60.65 59.73 1zub s ILE 701 Cb -0.18 -2.21 -0.03 0.00 1.25 0.00 0.00 42.46 41.28 1zub s ILE 701 CO -0.10 0.57 -0.18 -0.63 0.24 0.00 0.00 174.94 174.85 1zub s ILE 702 N -0.41 2.80 0.42 8.37 -1.09 -0.49 -0.25 121.20 130.55 1zub s ILE 702 Ca 0.05 -1.15 0.04 0.00 -2.23 0.00 0.00 60.65 57.35 1zub s ILE 702 Cb -0.12 -2.17 -0.02 0.00 -1.58 0.00 0.00 42.46 38.57 1zub s ILE 702 CO 0.02 0.36 0.13 0.68 -1.23 0.00 0.00 174.94 174.90 1zub s VAL 703 N -0.91 0.57 -0.12 2.92 -7.23 -1.20 -1.16 120.40 113.27 1zub s VAL 703 Ca 0.14 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.28 1zub s VAL 703 Cb -0.10 -2.30 0.06 0.00 0.56 0.00 0.00 36.38 34.59 1zub s VAL 703 CO 0.05 0.00 0.15 -0.94 -0.31 0.00 0.00 175.10 174.05 1zub s SER 704 N -3.63 1.24 0.00 4.85 1.04 -0.85 -3.40 113.70 112.95 1zub s SER 704 Ca 0.22 -0.00 0.24 0.00 0.48 0.00 0.00 55.95 56.89 1zub s SER 704 Cb 0.02 0.15 1.45 0.00 0.10 0.00 0.00 66.02 67.74 1zub s SER 704 CO 0.14 -0.28 1.81 -1.14 0.98 0.00 0.00 173.24 174.75