#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 2.37 0.09 1.57 0.02 -1.26 -4.92 135.00 132.87 1zub s PRO 598 Ca 0.00 0.49 -0.12 0.00 0.02 0.00 0.00 61.00 61.39 1zub s PRO 598 Cb 0.00 -1.96 -0.06 0.00 0.02 0.00 0.00 34.50 32.50 1zub s PRO 598 CO 0.00 -1.39 0.44 0.08 -0.33 0.00 0.00 177.00 175.80 1zub s VAL 599 N -3.29 5.03 0.09 3.83 1.01 -1.26 -4.98 120.40 120.81 1zub s VAL 599 Ca 0.60 0.60 0.05 0.00 0.00 0.00 0.00 61.98 63.23 1zub s VAL 599 Cb -0.13 -3.68 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1zub s VAL 599 CO 0.53 0.31 -0.14 0.42 0.00 0.00 0.00 175.10 176.22 1zub s THR 600 N -1.37 1.14 -0.07 3.92 -4.23 -1.26 -5.03 115.64 108.75 1zub s THR 600 Ca 0.33 -1.47 0.01 0.00 -1.18 0.00 0.00 61.69 59.39 1zub s THR 600 Cb -0.15 -1.24 0.02 0.00 1.34 0.00 0.00 72.50 72.47 1zub s THR 600 CO 0.18 -0.33 -0.10 0.26 -0.54 0.00 0.00 174.62 174.10 1zub s TRP 601 N -1.68 1.29 -0.13 3.99 0.52 -1.26 -2.50 118.94 119.17 1zub s TRP 601 Ca 0.02 -0.49 0.01 0.00 0.02 0.00 0.00 56.10 55.66 1zub s TRP 601 Cb -0.08 -1.00 -0.01 0.00 -1.15 0.00 0.00 33.47 31.24 1zub s TRP 601 CO 0.02 -0.30 -0.16 1.14 0.02 0.00 0.00 176.95 177.67 1zub s GLN 602 N 0.91 3.25 0.57 4.98 -2.07 0.30 -4.87 119.66 122.73 1zub s GLN 602 Ca -0.10 -0.75 -0.20 0.00 -1.82 0.00 0.00 55.36 52.49 1zub s GLN 602 Cb -0.15 -2.56 -0.04 0.00 -1.09 0.00 0.00 33.01 29.17 1zub s GLN 602 CO 0.01 0.13 1.26 -2.14 -1.32 0.00 0.00 175.29 173.22 1zub s PRO 603 N 0.54 3.04 0.07 9.60 0.02 -1.26 -1.43 135.00 145.59 1zub s PRO 603 Ca -0.10 1.97 0.10 0.00 0.02 0.00 0.00 61.00 62.98 1zub s PRO 603 Cb -0.16 -2.06 -0.03 0.00 0.02 0.00 0.00 34.50 32.27 1zub s PRO 603 CO 0.04 -1.18 -0.26 0.45 -0.33 0.00 0.00 177.00 175.71 1zub s SER 604 N -1.37 3.25 0.00 2.53 0.15 0.31 -4.88 113.70 113.70 1zub s SER 604 Ca 0.75 -0.64 0.29 0.00 0.70 0.00 0.00 55.95 57.05 1zub s SER 604 Cb -0.34 -0.28 1.20 0.00 -1.71 0.00 0.00 66.02 64.90 1zub s SER 604 CO 0.38 0.23 1.89 0.29 1.20 0.00 0.00 173.24 177.23 1zub n LYS 605 N 1.46 0.14 0.00 5.44 5.02 -1.26 -1.91 118.16 127.06 1zub n LYS 605 Ca -0.17 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.10 1zub n LYS 605 Cb 0.52 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1zub n LYS 605 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1zub n GLU 606 N -1.41 0.35 0.00 1.97 -0.58 -1.26 -4.24 120.64 115.47 1zub n GLU 606 Ca 0.09 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.83 1zub n GLU 606 Cb 0.31 -1.14 0.00 0.00 -0.57 0.00 0.00 31.44 30.04 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 0.23 -0.73 1.77 0.62 0.00 -1.26 -4.91 105.19 100.90 1zub n GLY 607 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 1zub n GLY 607 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1zub n ASP 608 N 0.00 -2.83 -4.38 1.61 2.03 -0.80 -5.09 116.55 107.10 1zub n ASP 608 Ca 0.00 -0.07 -0.20 0.00 0.52 0.00 0.00 54.79 55.04 1zub n ASP 608 Cb 0.00 -1.44 -0.10 0.00 -0.72 0.00 0.00 41.12 38.86 1zub n ASP 608 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1zub s ARG 609 N -3.13 1.41 -0.28 -0.67 1.70 -1.11 -4.91 118.95 111.97 1zub s ARG 609 Ca 0.04 -1.62 -0.04 0.00 -0.47 0.00 0.00 55.73 53.64 1zub s ARG 609 Cb -0.01 -1.30 0.02 0.00 -0.57 0.00 0.00 34.95 33.09 1zub s ARG 609 CO 0.12 0.23 0.01 -0.51 -1.08 0.00 0.00 175.30 174.07 1zub s LEU 610 N -3.32 3.58 -0.09 -1.89 2.01 -1.26 0.11 118.68 117.83 1zub s LEU 610 Ca 0.24 -0.84 -0.04 0.00 0.01 0.00 0.00 54.13 53.51 1zub s LEU 610 Cb -0.02 -1.77 -0.04 0.00 0.01 0.00 0.00 46.19 44.37 1zub s LEU 610 CO 0.09 -0.17 0.07 -0.63 1.01 0.00 0.00 176.35 176.72 1zub s ILE 611 N 1.40 4.87 0.12 -0.59 -1.09 -0.51 -2.77 121.20 122.62 1zub s ILE 611 Ca 0.01 -0.08 0.00 0.00 -2.23 0.00 0.00 60.65 58.35 1zub s ILE 611 Cb -0.17 -3.11 -0.04 0.00 -1.58 0.00 0.00 42.46 37.56 1zub s ILE 611 CO -0.01 0.57 -0.01 -0.83 -1.23 0.00 0.00 174.94 173.44 1zub s GLY 612 N -1.07 0.88 -0.17 6.18 0.00 -1.23 0.11 107.32 112.02 1zub s GLY 612 Ca 0.15 -1.42 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 1zub s GLY 612 CO 0.05 -1.42 -0.13 -1.60 0.00 0.00 0.00 173.10 170.00 1zub s ARG 613 N -3.94 3.27 -0.11 2.90 3.52 -1.04 -3.14 118.95 120.41 1zub s ARG 613 Ca 0.17 -0.71 0.03 0.00 -0.13 0.00 0.00 55.73 55.09 1zub s ARG 613 Cb 0.07 -2.72 -0.00 0.00 -1.56 0.00 0.00 34.95 30.73 1zub s ARG 613 CO -0.02 -0.02 -0.20 0.08 -0.81 0.00 0.00 175.30 174.32 1zub s VAL 614 N 0.94 2.37 -0.19 7.11 1.01 0.12 -4.09 120.40 127.67 1zub s VAL 614 Ca -0.02 -0.90 -0.03 0.00 0.00 0.00 0.00 61.98 61.02 1zub s VAL 614 Cb -0.15 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 1zub s VAL 614 CO -0.01 0.55 -0.06 -0.63 0.00 0.00 0.00 175.10 174.95 1zub s ILE 615 N 0.38 3.38 0.08 2.22 -1.09 -1.26 0.12 121.20 125.03 1zub s ILE 615 Ca -0.16 -0.51 0.09 0.00 -2.23 0.00 0.00 60.65 57.84 1zub s ILE 615 Cb -0.17 -2.51 -0.03 0.00 -1.58 0.00 0.00 42.46 38.17 1zub s ILE 615 CO 0.07 0.45 -0.23 -0.76 -1.23 0.00 0.00 174.94 173.24 1zub s LEU 616 N 1.10 2.24 -0.14 2.97 1.43 0.31 -4.70 118.68 121.90 1zub s LEU 616 Ca 0.01 -0.63 0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1zub s LEU 616 Cb -0.15 -1.07 0.01 0.00 0.03 0.00 0.00 46.19 45.02 1zub s LEU 616 CO -0.01 0.16 -0.22 0.21 0.23 0.00 0.00 176.35 176.72 1zub s ASN 617 N -1.59 3.14 -0.30 2.29 2.47 -1.26 0.17 114.94 119.86 1zub s ASN 617 Ca 0.09 -0.60 0.08 0.00 0.42 0.00 0.00 52.86 52.86 1zub s ASN 617 Cb -0.10 -1.45 0.47 0.00 -1.45 0.00 0.00 41.25 38.72 1zub s ASN 617 CO 0.03 0.08 1.36 2.29 -3.72 0.00 0.00 177.10 177.14 1zub n LYS 618 N 4.08 2.37 -0.10 0.43 2.85 -1.26 -4.60 118.16 121.94 1zub n LYS 618 Ca -0.20 -3.53 -0.13 0.00 -1.05 0.00 0.00 58.31 53.40 1zub n LYS 618 Cb 0.51 -1.94 -0.04 0.00 -0.65 0.00 0.00 35.03 32.91 1zub n LYS 618 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1zub n ARG 619 N -0.98 0.54 -2.19 -1.58 5.12 -1.26 -4.84 116.66 111.46 1zub n ARG 619 Ca 0.35 0.25 -0.27 0.00 -1.93 0.00 0.00 57.85 56.25 1zub n ARG 619 Cb 0.90 -1.46 0.06 0.00 -1.16 0.00 0.00 32.46 30.79 1zub n ARG 619 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 1zub s THR 620 N -2.78 2.81 0.53 0.55 -1.32 -1.26 -5.09 115.64 109.08 1zub s THR 620 Ca -0.30 -0.07 -0.00 0.00 -1.21 0.00 0.00 61.69 60.11 1zub s THR 620 Cb 0.06 -3.20 0.02 0.00 -1.51 0.00 0.00 72.50 67.88 1zub s THR 620 CO 0.43 -0.22 0.77 -0.89 -2.21 0.00 0.00 174.62 172.50 1zub s THR 621 N -3.22 3.15 -0.09 5.08 2.01 -1.26 -4.90 115.64 116.41 1zub s THR 621 Ca 0.58 -0.52 -0.30 0.00 0.31 0.00 0.00 61.69 61.77 1zub s THR 621 Cb -0.11 -3.19 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 1zub s THR 621 CO 0.46 -0.15 1.24 -0.32 -0.69 0.00 0.00 174.62 175.16 1zub s MET 622 N -4.76 4.31 0.59 4.92 1.75 -1.26 -4.90 119.30 119.95 1zub s MET 622 Ca 0.54 1.69 0.29 0.00 -1.25 0.00 0.00 55.69 56.97 1zub s MET 622 Cb -0.10 -3.63 1.65 0.00 2.84 0.00 0.00 34.83 35.58 1zub s MET 622 CO 0.39 -0.54 2.07 -1.35 -0.65 0.00 0.00 175.02 174.94 1zub h PRO 623 N 7.74 0.00 0.15 4.11 0.11 -1.95 -0.79 132.00 141.37 1zub h PRO 623 Ca -0.32 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.50 1zub h PRO 623 Cb 1.14 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.26 1zub h PRO 623 CO 0.91 0.00 -1.34 1.57 -0.21 0.00 0.00 178.00 178.93 1zub h LYS 624 N 0.00 0.33 0.00 1.05 2.10 -1.93 -3.48 116.57 114.64 1zub h LYS 624 Ca 0.10 -0.56 0.00 0.00 -2.00 0.00 0.00 60.65 58.19 1zub h LYS 624 Cb 0.59 0.21 0.00 0.00 -0.90 0.00 0.00 32.23 32.13 1zub h LYS 624 CO -0.00 1.25 0.00 -0.85 -2.00 0.00 0.00 179.45 177.85 1zub n GLU 625 N -3.56 0.00 -3.25 0.07 0.28 -0.31 -5.19 120.64 108.68 1zub n GLU 625 Ca -0.12 0.00 -0.00 0.00 -0.16 0.00 0.00 57.16 56.88 1zub n GLU 625 Cb 1.04 0.00 0.01 0.00 1.43 0.00 0.00 31.44 33.93 1zub n GLU 625 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1zub n SER 626 N -0.82 -1.03 -3.54 -1.84 3.41 -1.21 -4.42 113.62 104.18 1zub n SER 626 Ca 0.00 -1.40 -0.16 0.00 -0.26 0.00 0.00 58.87 57.05 1zub n SER 626 Cb 0.00 1.64 -0.06 0.00 -0.26 0.00 0.00 64.21 65.53 1zub n SER 626 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1zub s GLY 627 N -3.25 -0.52 -0.06 5.00 0.00 -1.26 -4.31 107.32 102.93 1zub s GLY 627 Ca 0.19 1.53 -0.12 0.00 0.00 0.00 0.00 44.72 46.32 1zub s GLY 627 CO 0.02 1.06 0.49 0.00 0.00 0.00 0.00 173.10 174.67 1zub h ALA 628 N 3.13 -0.33 -3.00 3.20 0.00 -1.99 -3.47 119.26 116.80 1zub h ALA 628 Ca -0.26 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1zub h ALA 628 Cb 1.15 0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1zub h ALA 628 CO 0.34 -0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1zub n LEU 629 N -4.99 0.00 0.07 0.00 7.99 -1.26 -5.08 117.00 113.73 1zub n LEU 629 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.95 1zub n LEU 629 Cb 0.17 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.48 1zub n LEU 629 CO 0.14 0.00 -0.03 0.00 -1.51 0.00 0.00 177.39 175.99 1zub n LEU 630 N -0.55 0.67 0.00 2.23 -0.00 -1.26 -4.05 117.00 114.03 1zub n LEU 630 Ca 0.00 0.23 0.00 0.00 -0.00 0.00 0.00 56.01 56.24 1zub n LEU 630 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 43.42 43.32 1zub n LEU 630 CO 0.00 -0.72 0.00 0.61 -0.00 0.00 0.00 177.39 177.28 1zub n GLY 631 N 2.88 0.00 3.48 1.47 0.00 -1.26 -1.96 105.19 109.80 1zub n GLY 631 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1zub n GLY 631 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1zub s LEU 632 N 0.00 -0.60 -0.10 0.99 0.20 -1.26 -2.72 118.68 115.18 1zub s LEU 632 Ca 0.00 0.40 0.02 0.00 0.69 0.00 0.00 54.13 55.24 1zub s LEU 632 Cb 0.00 2.51 -0.01 0.00 -0.43 0.00 0.00 46.19 48.26 1zub s LEU 632 CO 0.00 -0.73 -0.17 -0.75 -0.29 0.00 0.00 176.35 174.40 1zub s LYS 633 N -2.24 3.09 0.18 1.98 2.36 0.12 -5.00 119.74 120.23 1zub s LYS 633 Ca -0.05 -0.76 0.09 0.00 -2.55 0.00 0.00 55.97 52.69 1zub s LYS 633 Cb -0.00 -2.46 -0.04 0.00 -1.05 0.00 0.00 37.83 34.27 1zub s LYS 633 CO 0.00 0.28 -0.17 0.08 1.55 0.00 0.00 175.35 177.09 1zub s VAL 634 N 0.14 1.84 0.28 4.02 1.01 -1.26 0.12 120.40 126.56 1zub s VAL 634 Ca -0.09 -2.04 0.09 0.00 0.00 0.00 0.00 61.98 59.94 1zub s VAL 634 Cb -0.15 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1zub s VAL 634 CO 0.06 -0.40 0.05 -0.69 0.00 0.00 0.00 175.10 174.12 1zub s VAL 635 N -2.34 3.47 0.06 2.92 1.01 0.30 -4.82 120.40 121.00 1zub s VAL 635 Ca 0.19 -1.80 0.06 0.00 0.00 0.00 0.00 61.98 60.43 1zub s VAL 635 Cb -0.04 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.36 1zub s VAL 635 CO 0.07 -0.33 -0.17 -0.83 0.00 0.00 0.00 175.10 173.84 1zub s GLY 636 N -3.73 0.99 -0.16 4.51 0.00 -1.26 -2.50 107.32 105.16 1zub s GLY 636 Ca 0.33 -1.02 -0.01 0.00 0.00 0.00 0.00 44.72 44.02 1zub s GLY 636 CO 0.21 -1.00 0.14 0.61 0.00 0.00 0.00 173.10 173.06 1zub n GLY 637 N 1.54 0.34 2.94 0.20 0.00 -0.91 -3.43 105.19 105.87 1zub n GLY 637 Ca -0.19 -0.12 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.18 2.15 -0.09 1.61 -0.14 -1.12 -4.66 119.74 114.32 1zub s LYS 638 Ca 0.06 -2.86 -0.30 0.00 -1.36 0.00 0.00 55.97 51.52 1zub s LYS 638 Cb -0.01 -3.36 -0.08 0.00 -1.68 0.00 0.00 37.83 32.70 1zub s LYS 638 CO 0.12 -1.17 2.08 -0.12 -0.76 0.00 0.00 175.35 175.51 1zub n MET 639 N 2.75 2.41 -2.67 1.68 0.00 -1.26 -3.39 117.12 116.64 1zub n MET 639 Ca 0.10 0.81 -0.16 0.00 -0.00 0.00 0.00 57.70 58.45 1zub n MET 639 Cb 0.33 -3.07 0.04 0.00 0.00 0.00 0.00 33.22 30.52 1zub n MET 639 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1zub n THR 640 N 6.46 0.00 0.27 1.12 -2.24 -1.02 -4.98 114.28 113.89 1zub n THR 640 Ca 0.25 -1.47 0.14 0.00 -2.27 0.00 0.00 64.05 60.69 1zub n THR 640 Cb 0.41 -0.50 0.66 0.00 -2.10 0.00 0.00 70.33 68.80 1zub n THR 640 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1zub h ASP 641 N 0.19 0.00 0.59 3.42 5.19 -1.93 -1.94 116.42 121.94 1zub h ASP 641 Ca -0.22 0.00 -0.05 0.00 -0.62 0.00 0.00 57.03 56.14 1zub h ASP 641 Cb 0.92 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.42 1zub h ASP 641 CO 0.32 0.00 -0.26 -0.07 -3.12 0.00 0.00 179.24 176.11 1zub h LEU 642 N 0.00 0.00 0.00 1.55 -0.00 -1.98 -3.46 115.31 111.41 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 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.83 1zub h LEU 642 CO 0.00 0.26 0.00 0.61 -0.00 0.00 0.00 178.44 179.31 1zub n GLY 643 N -0.25 0.96 3.36 0.83 0.00 -0.73 -5.08 105.19 104.28 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 -0.95 1.47 0.20 1.61 0.52 -1.26 -4.96 118.95 115.58 1zub s ARG 644 Ca 0.00 -1.79 -0.05 0.00 -0.52 0.00 0.00 55.73 53.37 1zub s ARG 644 Cb 0.00 -0.55 -0.06 0.00 0.52 0.00 0.00 34.95 34.87 1zub s ARG 644 CO 0.00 -0.21 0.45 -0.51 0.02 0.00 0.00 175.30 175.05 1zub s LEU 645 N -3.37 4.20 0.00 2.53 1.43 -1.26 -2.44 118.68 119.77 1zub s LEU 645 Ca 0.35 0.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.11 1zub s LEU 645 Cb 0.08 -3.42 0.00 0.00 0.03 0.00 0.00 46.19 42.88 1zub s LEU 645 CO 0.13 -0.04 0.00 0.61 0.23 0.00 0.00 176.35 177.28 1zub n GLY 646 N -0.25 3.69 3.24 -3.19 0.00 -1.22 -0.68 105.19 106.77 1zub n GLY 646 Ca -0.02 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.39 1.63 -0.00 4.61 0.00 -1.24 -2.14 121.76 123.21 1zub s ALA 647 Ca 0.00 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1zub s ALA 647 Cb 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 23.12 22.85 1zub s ALA 647 CO 0.00 0.34 -0.03 -0.06 0.00 0.00 0.00 175.76 176.01 1zub s PHE 648 N -0.94 0.29 -0.22 0.00 0.40 -1.04 -1.37 117.98 115.10 1zub s PHE 648 Ca 0.05 -0.05 -0.29 0.00 -0.60 0.00 0.00 56.93 56.04 1zub s PHE 648 Cb -0.09 -0.20 -0.00 0.00 0.51 0.00 0.00 43.02 43.24 1zub s PHE 648 CO 0.02 -0.02 1.17 0.42 0.70 0.00 0.00 175.22 177.52 1zub s ILE 649 N 0.01 4.43 0.06 0.64 1.01 -0.65 0.11 121.20 126.82 1zub s ILE 649 Ca 0.00 1.72 0.07 0.00 0.00 0.00 0.00 60.65 62.44 1zub s ILE 649 Cb -0.02 -4.16 -0.22 0.00 0.01 0.00 0.00 42.46 38.06 1zub s ILE 649 CO -0.00 -0.22 1.07 0.71 0.00 0.00 0.00 174.94 176.50 1zub h THR 650 N 5.54 1.42 -2.05 2.92 1.35 -0.64 0.95 112.91 122.41 1zub h THR 650 Ca -0.23 -3.16 0.05 0.00 -0.55 0.00 0.00 66.41 62.52 1zub h THR 650 Cb 1.08 2.73 -0.18 0.00 -1.73 0.00 0.00 68.15 70.05 1zub h THR 650 CO 0.99 0.82 0.41 -1.59 -0.25 0.00 0.00 175.52 175.90 1zub s LYS 651 N -2.67 0.85 -0.05 4.72 -2.85 -1.20 -4.73 119.74 113.81 1zub s LYS 651 Ca -0.02 -0.04 0.03 0.00 -1.00 0.00 0.00 55.97 54.94 1zub s LYS 651 Cb 0.09 0.40 0.01 0.00 -2.06 0.00 0.00 37.83 36.26 1zub s LYS 651 CO 0.83 -0.32 -0.13 0.14 0.10 0.00 0.00 175.35 175.98 1zub s VAL 652 N -2.07 1.10 -0.56 1.79 -7.23 -1.26 0.10 120.40 112.27 1zub s VAL 652 Ca -0.01 -0.51 -0.27 0.00 -1.81 0.00 0.00 61.98 59.38 1zub s VAL 652 Cb -0.01 -0.98 0.03 0.00 0.56 0.00 0.00 36.38 35.99 1zub s VAL 652 CO -0.02 0.34 1.09 -0.54 -0.31 0.00 0.00 175.10 175.66 1zub s LYS 653 N 0.34 3.46 -0.39 4.82 1.02 -1.10 -4.96 119.74 122.93 1zub s LYS 653 Ca -0.08 0.08 -0.28 0.00 0.02 0.00 0.00 55.97 55.72 1zub s LYS 653 Cb -0.12 -4.02 -0.07 0.00 -0.52 0.00 0.00 37.83 33.10 1zub s LYS 653 CO 0.02 -1.58 2.33 1.17 -0.92 0.00 0.00 175.35 176.38 1zub n LYS 654 N 8.02 1.37 0.00 1.68 4.81 -1.26 -1.14 118.16 131.65 1zub n LYS 654 Ca 0.06 0.23 0.00 0.00 -0.87 0.00 0.00 58.31 57.74 1zub n LYS 654 Cb 0.48 -3.21 0.00 0.00 0.02 0.00 0.00 35.03 32.32 1zub n LYS 654 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1zub n GLY 655 N 5.98 1.41 3.68 3.14 0.00 -1.26 -5.12 105.19 113.02 1zub n GLY 655 Ca 0.36 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.12 2.18 0.11 1.61 0.01 -0.29 -4.72 113.70 111.47 1zub s SER 656 Ca 0.00 0.90 -0.24 0.00 1.31 0.00 0.00 55.95 57.91 1zub s SER 656 Cb 0.00 -1.37 -0.07 0.00 0.21 0.00 0.00 66.02 64.79 1zub s SER 656 CO 0.00 -3.38 1.67 -0.07 0.41 0.00 0.00 173.24 171.87 1zub h LEU 657 N -2.07 -0.49 -1.71 2.44 4.07 -1.70 -1.48 115.31 114.37 1zub h LEU 657 Ca -0.50 0.07 0.35 0.00 0.08 0.00 0.00 57.88 57.88 1zub h LEU 657 Cb 1.32 0.20 -0.08 0.00 1.08 0.00 0.00 40.66 43.18 1zub h LEU 657 CO 0.50 -0.24 0.85 0.00 -1.08 0.00 0.00 178.44 178.47 1zub h ALA 658 N 0.61 2.85 0.00 1.53 0.00 -1.75 0.84 119.26 123.35 1zub h ALA 658 Ca 0.05 0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1zub h ALA 658 Cb 0.35 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1zub h ALA 658 CO -0.14 -1.28 -0.50 0.22 0.00 0.00 0.00 179.25 177.55 1zub h ASP 659 N 0.14 0.01 -0.00 0.00 3.58 -1.56 0.88 116.42 119.46 1zub h ASP 659 Ca 0.65 -0.82 -0.00 0.00 0.42 0.00 0.00 57.03 57.28 1zub h ASP 659 Cb 2.21 -0.00 -0.00 0.00 1.72 0.00 0.00 39.33 43.26 1zub h ASP 659 CO -0.16 1.20 -0.01 -0.37 -2.88 0.00 0.00 179.24 177.02 1zub h VAL 660 N -0.98 1.44 0.00 2.25 -1.51 -0.26 -0.11 116.25 117.09 1zub h VAL 660 Ca -0.14 -1.31 -0.23 0.00 -1.23 0.00 0.00 66.70 63.79 1zub h VAL 660 Cb 1.14 2.32 -0.04 0.00 -2.13 0.00 0.00 31.29 32.58 1zub h VAL 660 CO -0.07 0.34 -1.54 1.62 -1.23 0.00 0.00 177.57 176.68 1zub h VAL 661 N -0.54 0.71 0.00 7.19 3.04 0.44 -3.40 116.25 123.68 1zub h VAL 661 Ca 0.00 -2.39 -0.18 0.00 -1.01 0.00 0.00 66.70 63.11 1zub h VAL 661 Cb 0.56 2.25 -0.03 0.00 -2.01 0.00 0.00 31.29 32.07 1zub h VAL 661 CO 0.00 0.40 -1.22 0.61 -1.01 0.00 0.00 177.57 176.36 1zub n GLY 662 N 1.47 -0.80 2.69 3.17 0.00 -0.61 -4.36 105.19 106.76 1zub n GLY 662 Ca -0.13 -0.03 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 1zub n GLY 662 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1zub n HIS 663 N -4.46 -1.89 -4.42 1.61 -0.00 0.30 -4.92 115.22 101.43 1zub n HIS 663 Ca -0.27 0.68 -0.22 0.00 0.46 0.00 0.00 57.72 58.37 1zub n HIS 663 Cb 0.58 -3.55 -0.09 0.00 -0.12 0.00 0.00 29.99 26.82 1zub n HIS 663 CO 0.00 0.00 0.00 -0.48 0.46 0.00 0.00 176.34 176.32 1zub s LEU 664 N -4.22 1.88 0.07 0.27 -0.00 -1.25 -5.03 118.68 110.39 1zub s LEU 664 Ca 0.21 -1.61 -0.01 0.00 -0.00 0.00 0.00 54.13 52.72 1zub s LEU 664 Cb -0.03 0.03 -0.04 0.00 -0.00 0.00 0.00 46.19 46.15 1zub s LEU 664 CO 0.53 -0.89 -0.02 -0.13 -0.00 0.00 0.00 176.35 175.84 1zub s ARG 665 N -3.75 0.68 0.04 1.48 0.52 -1.26 -4.88 118.95 111.79 1zub s ARG 665 Ca 0.31 -1.26 -0.32 0.00 -0.52 0.00 0.00 55.73 53.93 1zub s ARG 665 Cb 0.04 0.19 -0.11 0.00 0.52 0.00 0.00 34.95 35.59 1zub s ARG 665 CO 0.17 -0.13 1.84 0.00 0.02 0.00 0.00 175.30 177.19 1zub n ALA 666 N 0.07 1.51 0.00 2.13 0.00 -1.26 -2.46 120.51 120.50 1zub n ALA 666 Ca -0.12 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1zub n ALA 666 Cb 0.61 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 17.52 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 4.22 1.61 3.77 0.00 0.00 0.33 -4.94 105.19 110.18 1zub n GLY 667 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.21 6.12 -0.36 1.61 1.01 -1.03 -4.67 116.67 118.15 1zub s ASP 668 Ca 0.00 2.62 -0.12 0.00 0.71 0.00 0.00 52.55 55.76 1zub s ASP 668 Cb 0.00 -2.63 0.01 0.00 1.01 0.00 0.00 42.92 41.30 1zub s ASP 668 CO 0.00 -0.98 0.22 -0.70 0.21 0.00 0.00 175.17 173.92 1zub s GLU 669 N -2.42 3.14 -0.52 8.23 2.12 -1.26 -1.63 118.70 126.37 1zub s GLU 669 Ca 0.60 -0.87 -0.20 0.00 0.36 0.00 0.00 54.97 54.85 1zub s GLU 669 Cb -0.37 -3.76 0.05 0.00 0.26 0.00 0.00 34.13 30.32 1zub s GLU 669 CO 0.47 -0.58 0.71 0.08 -0.54 0.00 0.00 175.26 175.40 1zub s VAL 670 N 1.63 4.75 -2.17 3.70 1.01 -0.47 -2.38 120.40 126.48 1zub s VAL 670 Ca 0.04 -0.28 0.24 0.00 0.00 0.00 0.00 61.98 61.98 1zub s VAL 670 Cb -0.18 -4.36 0.61 0.00 0.00 0.00 0.00 36.38 32.45 1zub s VAL 670 CO 0.08 -0.88 1.81 0.18 0.00 0.00 0.00 175.10 176.29 1zub n LEU 671 N 6.50 0.71 -3.69 3.92 7.99 -0.35 -3.71 117.00 128.36 1zub n LEU 671 Ca -0.04 -0.27 -0.11 0.00 -0.01 0.00 0.00 56.01 55.58 1zub n LEU 671 Cb 0.46 -0.03 -0.12 0.00 -0.11 0.00 0.00 43.42 43.63 1zub n LEU 671 CO 0.56 0.13 -0.04 -1.61 -1.51 0.00 0.00 177.39 174.93 1zub s GLU 672 N -1.95 0.28 -0.10 3.23 2.02 -1.17 -2.90 118.70 118.11 1zub s GLU 672 Ca 0.36 0.74 -0.00 0.00 0.02 0.00 0.00 54.97 56.09 1zub s GLU 672 Cb 0.18 0.00 0.02 0.00 0.10 0.00 0.00 34.13 34.44 1zub s GLU 672 CO 0.29 -0.20 -0.06 -0.46 0.02 0.00 0.00 175.26 174.85 1zub s TRP 673 N 1.75 1.28 -1.36 1.61 -0.11 -0.71 -1.42 118.94 119.98 1zub s TRP 673 Ca -0.06 -0.58 -0.06 0.00 1.22 0.00 0.00 56.10 56.61 1zub s TRP 673 Cb -0.10 -1.11 0.01 0.00 -1.50 0.00 0.00 33.47 30.77 1zub s TRP 673 CO -0.11 -0.44 0.86 -1.71 -4.62 0.00 0.00 176.95 170.93 1zub n ASN 674 N 4.84 -6.01 -0.34 5.86 2.85 -0.32 -1.59 115.26 120.55 1zub n ASN 674 Ca -0.13 -0.39 -0.04 0.00 -0.11 0.00 0.00 54.58 53.90 1zub n ASN 674 Cb 0.50 -4.72 -0.02 0.00 1.24 0.00 0.00 39.78 36.78 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 -1.71 0.63 3.62 8.20 0.00 -1.01 -4.84 105.19 110.08 1zub n GLY 675 Ca -0.05 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.83 2.47 -0.26 1.61 2.47 -0.62 -5.09 119.74 118.48 1zub s LYS 676 Ca 0.00 -0.82 -0.28 0.00 -1.56 0.00 0.00 55.97 53.32 1zub s LYS 676 Cb 0.00 -2.48 0.01 0.00 -1.46 0.00 0.00 37.83 33.90 1zub s LYS 676 CO 0.00 0.57 0.99 -1.25 0.16 0.00 0.00 175.35 175.81 1zub s PRO 677 N -1.84 4.17 -0.07 4.03 0.04 -1.26 -1.75 135.00 138.32 1zub s PRO 677 Ca 0.20 1.14 -0.02 0.00 0.04 0.00 0.00 61.00 62.36 1zub s PRO 677 Cb -0.11 -3.67 -0.26 0.00 0.04 0.00 0.00 34.50 30.49 1zub s PRO 677 CO 0.12 -0.68 0.55 -0.07 0.04 0.00 0.00 177.00 176.96 1zub h LEU 678 N 9.56 0.35 -8.40 -3.56 3.38 -1.86 -3.46 115.31 111.31 1zub h LEU 678 Ca -0.21 -0.68 -0.79 0.00 0.09 0.00 0.00 57.88 56.30 1zub h LEU 678 Cb 1.07 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1zub h LEU 678 CO 0.96 1.60 1.14 -2.65 0.09 0.00 0.00 178.44 179.58 1zub n PRO 679 N -3.40 0.19 0.00 1.13 -0.02 -1.25 0.40 135.00 132.06 1zub n PRO 679 Ca -0.25 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1zub n PRO 679 Cb 1.05 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 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 6.26 1.34 3.77 -1.23 0.00 0.14 -4.88 105.19 110.59 1zub n GLY 680 Ca 0.45 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.11 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 -2.15 3.68 0.94 4.61 0.00 0.16 -4.67 121.76 124.34 1zub s ALA 681 Ca 0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.44 1zub s ALA 681 Cb 0.00 -2.26 0.01 0.00 0.00 0.00 0.00 23.12 20.87 1zub s ALA 681 CO 0.00 0.26 0.06 -2.37 0.00 0.00 0.00 175.76 173.71 1zub n THR 682 N 3.03 0.00 -0.00 0.00 5.66 -1.26 -3.97 114.28 117.73 1zub n THR 682 Ca -0.15 -0.05 -0.09 0.00 -3.05 0.00 0.00 64.05 60.71 1zub n THR 682 Cb 0.53 -1.92 -0.03 0.00 -1.55 0.00 0.00 70.33 67.36 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 -0.08 -0.41 -0.65 1.09 -1.07 -1.82 -1.22 115.58 111.42 1zub h ASN 683 Ca -0.02 0.08 0.04 0.00 0.07 0.00 0.00 56.30 56.47 1zub h ASN 683 Cb 0.06 0.20 -0.04 0.00 -2.07 0.00 0.00 38.32 36.47 1zub h ASN 683 CO 0.02 -0.17 0.43 -0.08 0.07 0.00 0.00 177.43 177.69 1zub h GLU 684 N -0.16 0.71 0.74 4.14 4.81 -1.93 -0.91 114.58 121.98 1zub h GLU 684 Ca 0.09 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1zub h GLU 684 Cb 0.29 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.52 1zub h GLU 684 CO -0.22 0.47 -0.36 0.93 -0.73 0.00 0.00 179.01 179.10 1zub h GLU 685 N 0.74 -0.96 -0.93 1.92 4.39 -1.67 -2.96 114.58 115.10 1zub h GLU 685 Ca 0.27 0.07 0.24 0.00 0.34 0.00 0.00 59.36 60.27 1zub h GLU 685 Cb 0.13 0.22 -0.13 0.00 -0.10 0.00 0.00 28.75 28.87 1zub h GLU 685 CO -0.08 -0.64 0.46 0.28 -1.16 0.00 0.00 179.01 177.87 1zub h VAL 686 N -1.16 0.47 -0.60 3.13 2.07 -1.01 0.85 116.25 120.00 1zub h VAL 686 Ca -0.10 -0.15 0.12 0.00 0.82 0.00 0.00 66.70 67.39 1zub h VAL 686 Cb 0.76 -0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.43 1zub h VAL 686 CO 0.17 0.08 -0.04 1.88 0.02 0.00 0.00 177.57 179.68 1zub h TYR 687 N 0.44 -0.11 -0.47 1.57 -1.99 -1.03 0.76 116.97 116.14 1zub h TYR 687 Ca 0.60 0.05 -0.04 0.00 2.00 0.00 0.00 58.73 61.33 1zub h TYR 687 Cb 1.16 0.14 -0.02 0.00 2.00 0.00 0.00 36.73 40.01 1zub h TYR 687 CO -0.09 -0.19 0.12 -0.91 -0.00 0.00 0.00 178.16 177.09 1zub h ASN 688 N 0.08 0.70 0.43 3.88 2.35 -0.69 -0.47 115.58 121.88 1zub h ASN 688 Ca 0.31 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1zub h ASN 688 Cb 0.49 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.67 1zub h ASN 688 CO -0.54 0.74 -0.26 0.40 -1.65 0.00 0.00 177.43 176.12 1zub h ILE 689 N 0.63 0.00 0.20 2.81 5.03 -0.59 -0.90 117.51 124.68 1zub h ILE 689 Ca 0.15 0.00 0.01 0.00 -0.12 0.00 0.00 64.86 64.90 1zub h ILE 689 Cb 0.31 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 34.07 1zub h ILE 689 CO -0.00 0.00 -0.27 0.40 -0.68 0.00 0.00 178.15 177.60 1zub h ILE 690 N -0.65 0.42 -0.70 -0.67 2.04 -0.98 -1.90 117.51 115.07 1zub h ILE 690 Ca -0.06 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.94 1zub h ILE 690 Cb 0.52 0.42 -0.13 0.00 -0.74 0.00 0.00 36.82 36.88 1zub h ILE 690 CO 0.06 0.00 -0.17 -0.07 0.00 0.00 0.00 178.15 177.97 1zub h LEU 691 N -0.53 -0.65 -2.12 1.44 4.07 -1.11 1.23 115.31 117.64 1zub h LEU 691 Ca 0.01 0.21 -0.01 0.00 0.08 0.00 0.00 57.88 58.17 1zub h LEU 691 Cb 0.52 0.43 -0.00 0.00 1.08 0.00 0.00 40.66 42.69 1zub h LEU 691 CO -0.10 -0.23 -0.03 -0.33 -1.08 0.00 0.00 178.44 176.67 1zub h GLU 692 N 0.00 0.00 -0.00 1.13 4.39 -0.80 -1.03 114.58 118.27 1zub h GLU 692 Ca 0.34 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.04 1zub h GLU 692 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 1zub h GLU 692 CO -0.72 0.03 -0.74 0.45 -1.16 0.00 0.00 179.01 176.87 1zub n SER 693 N -4.20 0.76 0.18 1.42 2.88 0.32 -4.19 113.62 110.80 1zub n SER 693 Ca -0.03 -0.63 0.16 0.00 -1.33 0.00 0.00 58.87 57.04 1zub n SER 693 Cb 0.12 0.62 0.78 0.00 -0.75 0.00 0.00 64.21 64.98 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 0.03 0.00 -0.58 -1.46 1.57 0.24 0.13 116.57 116.50 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 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1zub h LYS 694 CO 0.00 0.00 0.00 0.43 -0.57 0.00 0.00 179.45 179.31 1zub n SER 695 N -4.01 3.62 -4.72 0.86 7.64 -1.26 -4.96 113.62 110.79 1zub n SER 695 Ca 0.02 -1.98 -0.41 0.00 1.01 0.00 0.00 58.87 57.50 1zub n SER 695 Cb 0.32 -0.38 -0.04 0.00 -1.01 0.00 0.00 64.21 63.10 1zub n SER 695 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1zub s GLU 696 N -1.08 4.59 0.62 1.43 0.41 0.46 -4.92 118.70 120.19 1zub s GLU 696 Ca 0.41 1.36 0.33 0.00 -0.41 0.00 0.00 54.97 56.66 1zub s GLU 696 Cb 0.22 -3.43 1.80 0.00 -1.78 0.00 0.00 34.13 30.95 1zub s GLU 696 CO 0.29 0.06 2.01 -1.35 -0.49 0.00 0.00 175.26 175.78 1zub h PRO 697 N 6.35 0.00 -3.35 0.39 0.11 -1.93 -3.42 132.00 130.16 1zub h PRO 697 Ca -0.42 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.61 1zub h PRO 697 Cb 1.21 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.17 1zub h PRO 697 CO 0.74 0.00 -0.19 -1.14 -0.21 0.00 0.00 178.00 177.20 1zub s GLN 698 N -4.02 0.90 0.01 1.05 0.74 -1.26 -4.35 119.66 112.73 1zub s GLN 698 Ca -0.04 -0.60 0.02 0.00 0.05 0.00 0.00 55.36 54.80 1zub s GLN 698 Cb 0.10 0.39 -0.01 0.00 1.10 0.00 0.00 33.01 34.59 1zub s GLN 698 CO 0.30 -0.31 -0.08 0.08 -0.55 0.00 0.00 175.29 174.73 1zub s VAL 699 N -3.06 0.59 -0.25 1.34 1.01 0.45 -4.97 120.40 115.51 1zub s VAL 699 Ca -0.01 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.46 1zub s VAL 699 Cb 0.01 -0.53 0.06 0.00 0.00 0.00 0.00 36.38 35.92 1zub s VAL 699 CO -0.07 0.03 -0.05 -0.70 0.00 0.00 0.00 175.10 174.32 1zub s GLU 700 N -0.54 1.63 -0.05 2.72 2.12 -1.26 0.12 118.70 123.43 1zub s GLU 700 Ca -0.00 -1.09 0.06 0.00 0.36 0.00 0.00 54.97 54.30 1zub s GLU 700 Cb -0.05 -2.63 -0.02 0.00 0.26 0.00 0.00 34.13 31.70 1zub s GLU 700 CO 0.00 -0.64 -0.22 0.96 -0.54 0.00 0.00 175.26 174.82 1zub s ILE 701 N 1.34 2.33 0.04 -3.70 -4.36 0.34 -1.17 121.20 116.01 1zub s ILE 701 Ca -0.04 -0.98 0.07 0.00 -0.26 0.00 0.00 60.65 59.44 1zub s ILE 701 Cb -0.19 -1.86 -0.03 0.00 1.25 0.00 0.00 42.46 41.63 1zub s ILE 701 CO -0.07 0.57 -0.19 -0.63 0.24 0.00 0.00 174.94 174.86 1zub s ILE 702 N -0.39 2.71 0.42 8.37 -1.09 -0.51 0.14 121.20 130.84 1zub s ILE 702 Ca 0.03 -1.19 0.04 0.00 -2.23 0.00 0.00 60.65 57.31 1zub s ILE 702 Cb -0.12 -2.12 -0.02 0.00 -1.58 0.00 0.00 42.46 38.62 1zub s ILE 702 CO 0.02 0.36 0.14 0.68 -1.23 0.00 0.00 174.94 174.91 1zub s VAL 703 N -0.90 0.53 -0.22 2.92 -7.23 -1.19 -1.21 120.40 113.11 1zub s VAL 703 Ca 0.14 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.27 1zub s VAL 703 Cb -0.10 -2.31 0.10 0.00 0.56 0.00 0.00 36.38 34.63 1zub s VAL 703 CO 0.05 0.00 0.26 -0.55 -0.31 0.00 0.00 175.10 174.55 1zub s SER 704 N -3.62 1.08 0.00 4.85 0.15 -1.00 -3.54 113.70 111.62 1zub s SER 704 Ca 0.23 -0.11 0.22 0.00 0.70 0.00 0.00 55.95 56.99 1zub s SER 704 Cb 0.02 0.58 0.17 0.00 -1.71 0.00 0.00 66.02 65.08 1zub s SER 704 CO 0.15 -0.32 1.20 -1.14 1.20 0.00 0.00 173.24 174.33