#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gud s ARG 623 N 0.00 3.03 -0.16 3.49 3.00 -1.26 -4.88 118.95 122.16 3gud s ARG 623 Ca 0.00 -0.93 0.06 0.00 0.00 0.00 0.00 55.73 54.85 3gud s ARG 623 Cb 0.00 -3.99 0.42 0.00 0.00 0.00 0.00 34.95 31.38 3gud s ARG 623 CO 0.00 -0.84 1.28 0.72 0.00 0.00 0.00 175.30 176.45 3gud n HIS 624 N 5.40 1.30 -4.22 -0.53 8.25 -1.26 -4.96 115.22 119.20 3gud n HIS 624 Ca -0.09 -0.65 -0.23 0.00 -0.26 0.00 0.00 57.72 56.48 3gud n HIS 624 Cb 0.47 -0.42 -0.07 0.00 1.12 0.00 0.00 29.99 31.09 3gud n HIS 624 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3gud s LYS 625 N -1.90 2.28 0.00 -0.41 1.02 -1.26 -5.14 119.74 114.33 3gud s LYS 625 Ca 0.30 -1.55 0.00 0.00 0.02 0.00 0.00 55.97 54.74 3gud s LYS 625 Cb 0.24 -2.12 0.00 0.00 -0.52 0.00 0.00 37.83 35.43 3gud s LYS 625 CO 0.08 0.20 0.00 -2.37 -0.92 0.00 0.00 175.35 172.34 3gud n THR 626 N -1.02 0.00 -4.35 2.17 5.66 -1.26 -4.93 114.28 110.55 3gud n THR 626 Ca -0.04 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.57 3gud n THR 626 Cb 0.61 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.31 3gud n THR 626 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 3gud n ASP 627 N -1.20 -1.36 -4.74 1.09 10.43 -1.26 -4.79 116.55 114.72 3gud n ASP 627 Ca 0.00 -1.18 -0.39 0.00 2.57 0.00 0.00 54.79 55.78 3gud n ASP 627 Cb 0.00 -1.51 -0.05 0.00 1.84 0.00 0.00 41.12 41.40 3gud n ASP 627 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 3gud s ILE 628 N -3.29 4.90 -0.08 0.53 -1.16 -1.26 -5.01 121.20 115.83 3gud s ILE 628 Ca 0.68 1.40 -0.32 0.00 -0.51 0.00 0.00 60.65 61.89 3gud s ILE 628 Cb -0.40 -4.01 0.13 0.00 0.61 0.00 0.00 42.46 38.80 3gud s ILE 628 CO 0.97 0.36 1.33 0.00 -2.81 0.00 0.00 174.94 174.78 3gud s ALA 629 N 0.14 -2.29 1.06 1.50 0.00 -1.26 -5.16 121.76 115.75 3gud s ALA 629 Ca 0.35 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 3gud s ALA 629 Cb -0.19 0.19 0.23 0.00 0.00 0.00 0.00 23.12 23.35 3gud s ALA 629 CO 0.19 -0.95 1.06 -2.14 0.00 0.00 0.00 175.76 173.92 3gud s PRO 630 N -2.28 -0.13 -0.12 0.00 0.02 -1.26 -4.91 135.00 126.32 3gud s PRO 630 Ca 0.14 0.86 -0.29 0.00 0.02 0.00 0.00 61.00 61.72 3gud s PRO 630 Cb 0.04 -1.64 -0.01 0.00 0.02 0.00 0.00 34.50 32.91 3gud s PRO 630 CO -0.05 -3.20 1.04 0.42 -0.33 0.00 0.00 177.00 174.89 3gud s ILE 631 N -2.65 4.69 0.22 2.83 1.01 -1.26 -4.98 121.20 121.06 3gud s ILE 631 Ca 0.67 1.98 -0.22 0.00 0.00 0.00 0.00 60.65 63.08 3gud s ILE 631 Cb -0.22 -4.27 -0.14 0.00 0.01 0.00 0.00 42.46 37.84 3gud s ILE 631 CO 0.61 -0.03 0.32 -0.24 0.00 0.00 0.00 174.94 175.60 3gud n SER 632 N 5.31 -1.47 -0.01 3.58 2.88 -1.26 -4.86 113.62 117.79 3gud n SER 632 Ca 0.10 0.86 -0.15 0.00 -1.33 0.00 0.00 58.87 58.35 3gud n SER 632 Cb 0.48 -0.78 -0.14 0.00 -0.75 0.00 0.00 64.21 63.02 3gud n SER 632 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3gud n ASP 633 N 1.76 1.47 -0.22 -3.46 8.00 -1.26 -2.23 116.55 120.62 3gud n ASP 633 Ca 0.13 0.30 -0.06 0.00 0.71 0.00 0.00 54.79 55.87 3gud n ASP 633 Cb 0.25 -0.42 0.04 0.00 -0.02 0.00 0.00 41.12 40.96 3gud n ASP 633 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3gud h LYS 634 N 0.03 0.83 0.31 -1.24 1.79 -1.97 0.23 116.57 116.56 3gud h LYS 634 Ca -0.36 -0.08 -0.00 0.00 -2.18 0.00 0.00 60.65 58.02 3gud h LYS 634 Cb 2.03 -0.17 -0.01 0.00 -1.58 0.00 0.00 32.23 32.49 3gud h LYS 634 CO 0.08 0.60 -0.25 0.28 -1.08 0.00 0.00 179.45 179.08 3gud h VAL 635 N 0.83 0.47 -0.05 0.50 2.07 -1.94 0.28 116.25 118.41 3gud h VAL 635 Ca 0.22 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.74 3gud h VAL 635 Cb -0.01 0.47 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 3gud h VAL 635 CO -0.04 0.00 0.02 0.25 0.02 0.00 0.00 177.57 177.82 3gud h LEU 636 N -0.57 0.06 -0.20 2.57 5.85 -1.31 0.82 115.31 122.53 3gud h LEU 636 Ca -0.02 -0.00 -0.18 0.00 0.84 0.00 0.00 57.88 58.52 3gud h LEU 636 Cb 0.50 -0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 3gud h LEU 636 CO -0.01 0.06 -0.84 0.44 -0.34 0.00 0.00 178.44 177.74 3gud h ASP 637 N 0.07 0.00 -0.02 1.25 3.32 -0.03 -2.14 116.42 118.88 3gud h ASP 637 Ca 0.02 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.81 3gud h ASP 637 Cb 0.02 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.59 3gud h ASP 637 CO -0.00 0.84 -0.99 0.00 -1.72 0.00 0.00 179.24 177.37 3gud h ALA 638 N 1.16 0.14 -0.79 3.45 0.00 0.84 -3.31 119.26 120.75 3gud h ALA 638 Ca -0.01 -0.68 -0.04 0.00 0.00 0.00 0.00 54.91 54.18 3gud h ALA 638 Cb 1.55 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 19.36 3gud h ALA 638 CO 0.11 0.66 0.32 2.35 0.00 0.00 0.00 179.25 182.69 3gud h TRP 639 N 0.39 1.20 0.00 0.00 2.91 -0.88 -0.96 115.95 118.60 3gud h TRP 639 Ca -0.12 -0.09 0.00 0.00 1.13 0.00 0.00 58.89 59.81 3gud h TRP 639 Cb 1.64 -0.36 0.00 0.00 -0.51 0.00 0.00 29.16 29.93 3gud h TRP 639 CO 0.10 0.90 0.19 1.49 -1.03 0.00 0.00 178.44 180.10 3gud h GLU 640 N 1.14 0.00 0.00 2.65 4.81 -1.47 0.34 114.58 122.05 3gud h GLU 640 Ca 0.26 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.36 3gud h GLU 640 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 3gud h GLU 640 CO -0.02 0.00 -0.75 0.87 -0.73 0.00 0.00 179.01 178.38 3gud h LYS 641 N 0.00 0.00 -6.90 1.92 1.57 -1.28 -3.46 116.57 108.42 3gud h LYS 641 Ca 0.00 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.28 3gud h LYS 641 Cb 0.38 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.72 3gud h LYS 641 CO 0.00 0.51 0.46 0.54 -0.57 0.00 0.00 179.45 180.39 3gud s VAL 642 N -2.93 3.47 0.09 0.50 0.11 0.11 -4.97 120.40 116.79 3gud s VAL 642 Ca 0.02 1.28 0.01 0.00 -2.93 0.00 0.00 61.98 60.37 3gud s VAL 642 Cb 0.08 -3.74 -0.04 0.00 -1.53 0.00 0.00 36.38 31.15 3gud s VAL 642 CO 0.77 0.16 0.23 -0.54 -3.33 0.00 0.00 175.10 172.38 3gud s LYS 643 N -2.06 3.40 -0.06 1.54 1.02 -1.26 -5.07 119.74 117.25 3gud s LYS 643 Ca 0.53 -0.52 -0.11 0.00 0.02 0.00 0.00 55.97 55.89 3gud s LYS 643 Cb -0.28 -2.99 -0.05 0.00 -0.52 0.00 0.00 37.83 33.99 3gud s LYS 643 CO 0.36 0.57 0.28 -0.06 -0.92 0.00 0.00 175.35 175.58 3gud s PHE 644 N -1.59 3.67 0.19 3.18 0.08 -1.26 -4.42 117.98 117.82 3gud s PHE 644 Ca 0.34 0.77 0.08 0.00 0.12 0.00 0.00 56.93 58.24 3gud s PHE 644 Cb -0.12 -2.13 -0.05 0.00 -0.57 0.00 0.00 43.02 40.15 3gud s PHE 644 CO 0.28 0.68 -0.15 0.71 -0.10 0.00 0.00 175.22 176.64 3gud s TYR 645 N -1.03 1.68 0.00 0.36 2.02 0.39 -4.98 117.35 115.79 3gud s TYR 645 Ca 0.20 -0.57 0.05 0.00 -0.37 0.00 0.00 57.07 56.38 3gud s TYR 645 Cb -0.14 -0.80 -0.03 0.00 -0.40 0.00 0.00 41.96 40.59 3gud s TYR 645 CO 0.09 0.33 -0.15 1.14 -1.57 0.00 0.00 175.55 175.39 3gud s GLN 646 N -3.47 2.31 0.24 -0.62 -2.07 -1.26 -1.35 119.66 113.44 3gud s GLN 646 Ca 0.20 -0.84 -0.22 0.00 -1.82 0.00 0.00 55.36 52.69 3gud s GLN 646 Cb -0.02 -2.31 0.03 0.00 -1.09 0.00 0.00 33.01 29.63 3gud s GLN 646 CO 0.06 0.58 0.72 1.52 -1.32 0.00 0.00 175.29 176.86 3gud s TYR 647 N -0.87 -0.25 0.18 9.60 -0.85 -0.97 -5.00 117.35 119.19 3gud s TYR 647 Ca 0.14 -0.15 0.10 0.00 -0.52 0.00 0.00 57.07 56.65 3gud s TYR 647 Cb -0.11 0.67 -0.04 0.00 0.38 0.00 0.00 41.96 42.86 3gud s TYR 647 CO 0.04 -1.12 -0.22 0.15 -1.52 0.00 0.00 175.55 172.88 3gud s LYS 648 N -3.81 1.42 -0.06 -3.49 1.02 -1.26 -2.18 119.74 111.38 3gud s LYS 648 Ca 0.09 -1.46 -0.28 0.00 0.02 0.00 0.00 55.97 54.35 3gud s LYS 648 Cb -0.05 -1.68 -0.03 0.00 -0.52 0.00 0.00 37.83 35.56 3gud s LYS 648 CO 0.03 0.36 0.90 -0.06 -0.92 0.00 0.00 175.35 175.66 3gud s PHE 649 N -1.70 3.58 0.60 3.18 0.08 -1.26 -4.90 117.98 117.56 3gud s PHE 649 Ca 0.18 1.51 0.29 0.00 0.12 0.00 0.00 56.93 59.03 3gud s PHE 649 Cb -0.08 -3.04 1.54 0.00 -0.57 0.00 0.00 43.02 40.87 3gud s PHE 649 CO 0.08 -0.05 1.95 0.87 -0.10 0.00 0.00 175.22 177.97 3gud h LYS 650 N 6.91 0.00 0.40 0.44 1.57 -1.99 -1.18 116.57 122.72 3gud h LYS 650 Ca -0.38 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.39 3gud h LYS 650 Cb 1.19 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.50 3gud h LYS 650 CO 0.78 0.00 -0.23 0.22 -0.57 0.00 0.00 179.45 179.65 3gud h ASP 651 N 0.00 -0.58 -0.55 0.86 1.82 -2.01 -2.96 116.42 113.00 3gud h ASP 651 Ca 0.16 0.03 -0.01 0.00 -0.39 0.00 0.00 57.03 56.81 3gud h ASP 651 Cb 0.95 0.16 -0.03 0.00 0.68 0.00 0.00 39.33 41.10 3gud h ASP 651 CO -0.00 -0.36 0.30 0.00 -1.61 0.00 0.00 179.24 177.56 3gud h ALA 652 N -1.59 1.45 -0.40 -0.78 0.00 -1.66 -3.03 119.26 113.25 3gud h ALA 652 Ca -0.05 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.60 3gud h ALA 652 Cb 0.47 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 3gud h ALA 652 CO 0.06 0.45 -0.34 0.28 0.00 0.00 0.00 179.25 179.70 3gud h VAL 653 N 0.80 1.27 0.00 0.00 2.07 -1.25 0.31 116.25 119.45 3gud h VAL 653 Ca 0.20 -1.51 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 3gud h VAL 653 Cb 0.05 1.35 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3gud h VAL 653 CO -0.03 0.51 -0.12 0.44 0.02 0.00 0.00 177.57 178.39 3gud h ASP 654 N 0.75 0.00 0.18 0.57 3.32 -1.50 0.24 116.42 119.98 3gud h ASP 654 Ca 0.07 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3gud h ASP 654 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.49 3gud h ASP 654 CO 0.09 0.12 -0.09 -0.33 -1.72 0.00 0.00 179.24 177.31 3gud h GLU 655 N 0.00 -0.23 -0.03 3.56 5.08 -1.09 -3.40 114.58 118.46 3gud h GLU 655 Ca -0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3gud h GLU 655 Cb 0.64 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3gud h GLU 655 CO 0.02 0.10 0.00 1.63 -1.00 0.00 0.00 179.01 179.76 3gud n LYS 656 N -4.92 1.58 0.00 2.33 5.02 0.96 -5.09 118.16 118.03 3gud n LYS 656 Ca -0.06 -2.55 0.00 0.00 -2.02 0.00 0.00 58.31 53.68 3gud n LYS 656 Cb 0.22 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 3gud n LYS 656 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gud n GLY 657 N -1.26 0.99 0.29 0.72 0.00 0.84 -1.81 105.19 104.95 3gud n GLY 657 Ca 0.16 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.54 3gud n GLY 657 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gud n GLU 658 N 0.00 0.89 0.28 1.61 -0.58 -1.26 -1.76 120.64 119.81 3gud n GLU 658 Ca 0.00 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 56.90 3gud n GLU 658 Cb 0.00 -1.26 0.73 0.00 -0.57 0.00 0.00 31.44 30.34 3gud n GLU 658 CO 0.00 0.00 0.00 1.49 -0.48 0.00 0.00 177.13 178.14 3gud h GLU 659 N 0.06 0.00 -6.72 3.49 4.81 -1.72 -3.45 114.58 111.04 3gud h GLU 659 Ca 0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.70 3gud h GLU 659 Cb 0.26 0.00 0.06 0.00 0.63 0.00 0.00 28.75 29.70 3gud h GLU 659 CO 0.00 0.05 0.87 0.00 -0.73 0.00 0.00 179.01 179.20 3gud s ALA 660 N -3.80 3.76 0.69 2.92 0.00 -0.73 -4.97 121.76 119.64 3gud s ALA 660 Ca -0.00 1.47 -0.15 0.00 0.00 0.00 0.00 51.96 53.27 3gud s ALA 660 Cb 0.10 -3.63 0.02 0.00 0.00 0.00 0.00 23.12 19.61 3gud s ALA 660 CO 0.54 -0.87 1.17 1.03 0.00 0.00 0.00 175.76 177.64 3gud s ARG 661 N 0.17 2.44 0.06 0.00 0.52 -1.26 -5.02 118.95 115.86 3gud s ARG 661 Ca 0.66 1.63 -0.22 0.00 -0.52 0.00 0.00 55.73 57.28 3gud s ARG 661 Cb -0.46 -1.88 -0.06 0.00 0.52 0.00 0.00 34.95 33.07 3gud s ARG 661 CO 0.40 -1.58 0.65 0.71 0.02 0.00 0.00 175.30 175.50 3gud s TYR 662 N -2.08 3.77 0.08 -0.53 2.02 -1.26 -4.66 117.35 114.70 3gud s TYR 662 Ca 0.72 1.34 0.08 0.00 -0.37 0.00 0.00 57.07 58.85 3gud s TYR 662 Cb -0.26 -2.64 -0.04 0.00 -0.40 0.00 0.00 41.96 38.63 3gud s TYR 662 CO 0.43 0.44 -0.20 -1.01 -1.57 0.00 0.00 175.55 173.64 3gud s HIS 663 N -0.61 2.50 -0.06 2.71 3.76 -0.93 -4.99 115.29 117.68 3gud s HIS 663 Ca 0.32 -0.29 0.03 0.00 -0.15 0.00 0.00 55.06 54.98 3gud s HIS 663 Cb -0.20 -1.38 -0.02 0.00 1.11 0.00 0.00 32.58 32.09 3gud s HIS 663 CO 0.20 0.31 -0.15 -0.06 -0.85 0.00 0.00 174.74 174.19 3gud s PHE 664 N -1.03 2.69 -1.55 1.40 2.99 -1.26 -2.29 117.98 118.93 3gud s PHE 664 Ca 0.16 -0.24 0.00 0.00 0.00 0.00 0.00 56.93 56.85 3gud s PHE 664 Cb -0.10 -1.64 0.00 0.00 0.00 0.00 0.00 43.02 41.27 3gud s PHE 664 CO 0.07 0.12 0.00 0.41 -0.00 0.00 0.00 175.22 175.83 3gud n GLY 665 N 2.46 -0.59 3.92 4.36 0.00 -0.46 -5.00 105.19 109.87 3gud n GLY 665 Ca -0.17 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 45.00 3gud n GLY 665 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gud s VAL 666 N -3.31 2.78 -0.17 1.61 -7.23 -1.26 -0.47 120.40 112.35 3gud s VAL 666 Ca 0.00 -1.22 0.00 0.00 -1.81 0.00 0.00 61.98 58.95 3gud s VAL 666 Cb 0.00 -3.00 0.04 0.00 0.56 0.00 0.00 36.38 33.98 3gud s VAL 666 CO 0.00 0.00 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.07 3gud s ILE 667 N -2.43 1.40 0.19 -0.62 1.01 -1.26 -4.92 121.20 114.57 3gud s ILE 667 Ca 0.51 -0.74 -0.16 0.00 0.00 0.00 0.00 60.65 60.25 3gud s ILE 667 Cb -0.06 -1.46 0.16 0.00 0.01 0.00 0.00 42.46 41.12 3gud s ILE 667 CO 0.30 0.24 1.63 0.00 0.00 0.00 0.00 174.94 177.10 3gud h ALA 668 N 8.06 0.24 -1.00 9.38 0.00 -1.90 -1.20 119.26 132.84 3gud h ALA 668 Ca -0.29 0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.88 3gud h ALA 668 Cb 1.11 0.50 -0.07 0.00 0.00 0.00 0.00 17.79 19.33 3gud h ALA 668 CO 0.46 -0.50 0.65 1.96 0.00 0.00 0.00 179.25 181.81 3gud h GLN 669 N -0.06 1.14 -0.38 0.00 7.50 -1.93 0.16 115.11 121.53 3gud h GLN 669 Ca 0.25 -0.07 -0.10 0.00 0.50 0.00 0.00 58.65 59.23 3gud h GLN 669 Cb 0.45 -0.26 -0.02 0.00 0.05 0.00 0.00 27.48 27.70 3gud h GLN 669 CO -0.57 0.75 -0.17 0.37 -1.50 0.00 0.00 178.83 177.71 3gud h GLN 670 N 1.17 0.72 0.05 1.46 4.15 -1.69 -3.13 115.11 117.84 3gud h GLN 670 Ca 0.43 -0.26 -0.00 0.00 0.77 0.00 0.00 58.65 59.59 3gud h GLN 670 Cb 0.16 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.81 3gud h GLN 670 CO -0.17 0.85 -0.02 0.82 -1.93 0.00 0.00 178.83 178.37 3gud h ILE 671 N 0.64 1.01 0.00 2.39 2.04 -0.06 -1.94 117.51 121.60 3gud h ILE 671 Ca 0.10 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.75 3gud h ILE 671 Cb 0.65 1.16 0.00 0.00 -0.74 0.00 0.00 36.82 37.89 3gud h ILE 671 CO 0.05 0.05 0.03 -0.37 0.00 0.00 0.00 178.15 177.91 3gud h VAL 672 N -0.16 0.00 0.04 1.67 -1.51 -0.79 -2.59 116.25 112.90 3gud h VAL 672 Ca -0.01 0.00 -0.32 0.00 -1.23 0.00 0.00 66.70 65.14 3gud h VAL 672 Cb 0.14 0.56 -0.04 0.00 -2.13 0.00 0.00 31.29 29.82 3gud h VAL 672 CO 0.01 0.00 -1.80 1.17 -1.23 0.00 0.00 177.57 175.73 3gud n LYS 673 N -2.40 0.63 0.22 5.19 4.81 -0.79 -3.17 118.16 122.66 3gud n LYS 673 Ca -0.02 0.40 0.07 0.00 -0.87 0.00 0.00 58.31 57.89 3gud n LYS 673 Cb 0.07 -1.68 0.50 0.00 0.02 0.00 0.00 35.03 33.95 3gud n LYS 673 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 3gud h VAL 674 N -0.59 0.98 -0.02 3.15 -1.51 -1.02 -0.95 116.25 116.29 3gud h VAL 674 Ca -0.45 -0.90 -0.17 0.00 -1.23 0.00 0.00 66.70 63.94 3gud h VAL 674 Cb 1.63 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 32.29 3gud h VAL 674 CO -0.15 0.24 -0.77 -0.26 -1.23 0.00 0.00 177.57 175.41 3gud h PHE 675 N 0.00 0.27 -0.62 5.19 0.05 -1.67 -3.03 116.94 117.13 3gud h PHE 675 Ca -0.00 -0.13 -0.10 0.00 3.82 0.00 0.00 57.97 61.56 3gud h PHE 675 Cb 0.50 -0.04 -0.02 0.00 2.00 0.00 0.00 35.95 38.39 3gud h PHE 675 CO 0.00 0.88 0.01 0.93 -0.18 0.00 0.00 178.31 179.95 3gud h GLU 676 N 0.12 1.09 -0.63 1.51 5.08 -1.17 3.14 114.58 123.73 3gud h GLU 676 Ca -0.03 -0.34 -0.03 0.00 -1.00 0.00 0.00 59.36 57.97 3gud h GLU 676 Cb 1.34 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 3gud h GLU 676 CO 0.12 1.05 0.29 -0.44 -1.00 0.00 0.00 179.01 179.03 3gud h ASP 677 N 1.00 0.83 0.06 1.42 3.32 -1.30 -1.41 116.42 120.33 3gud h ASP 677 Ca 0.18 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3gud h ASP 677 Cb 0.55 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3gud h ASP 677 CO 0.03 0.74 -0.01 1.21 -1.72 0.00 0.00 179.24 179.49 3gud n GLU 678 N -4.49 1.09 -0.86 3.56 4.07 -1.14 -4.85 120.64 118.01 3gud n GLU 678 Ca 0.04 -0.23 0.00 0.00 -0.06 0.00 0.00 57.16 56.91 3gud n GLU 678 Cb 0.13 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.02 3gud n GLU 678 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3gud n GLY 679 N 1.08 0.48 3.90 8.31 0.00 -0.49 -5.06 105.19 113.41 3gud n GLY 679 Ca 0.22 -0.85 -0.20 0.00 0.00 0.00 0.00 46.02 45.18 3gud n GLY 679 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gud s LEU 680 N 0.00 3.40 -0.20 0.99 1.43 1.04 -4.91 118.68 120.43 3gud s LEU 680 Ca 0.00 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.37 3gud s LEU 680 Cb 0.00 -2.11 0.00 0.00 0.03 0.00 0.00 46.19 44.11 3gud s LEU 680 CO 0.00 -0.71 -0.10 -0.55 0.23 0.00 0.00 176.35 175.22 3gud s SER 681 N -4.19 3.89 0.52 2.29 0.15 -1.26 -3.13 113.70 111.97 3gud s SER 681 Ca 0.49 -0.47 0.23 0.00 0.70 0.00 0.00 55.95 56.91 3gud s SER 681 Cb -0.04 -1.64 1.42 0.00 -1.71 0.00 0.00 66.02 64.04 3gud s SER 681 CO 0.29 0.00 2.11 0.00 1.20 0.00 0.00 173.24 176.84 3gud h ALA 682 N 7.92 1.53 0.00 5.45 0.00 -1.89 -2.27 119.26 130.00 3gud h ALA 682 Ca -0.41 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.36 3gud h ALA 682 Cb 1.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 3gud h ALA 682 CO 0.61 0.12 -0.23 0.74 0.00 0.00 0.00 179.25 180.48 3gud h PHE 683 N 0.00 0.00 0.00 0.00 -1.00 -1.95 -2.84 116.94 111.15 3gud h PHE 683 Ca -0.00 0.00 -0.11 0.00 2.81 0.00 0.00 57.97 60.67 3gud h PHE 683 Cb 0.21 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.75 3gud h PHE 683 CO 0.00 0.23 -0.51 -0.44 -1.61 0.00 0.00 178.31 175.98 3gud h ASP 684 N 0.00 0.00 -0.50 2.17 3.32 -1.78 -2.67 116.42 116.96 3gud h ASP 684 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gud h ASP 684 Cb 0.48 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.03 3gud h ASP 684 CO 0.03 0.51 0.00 -1.22 -1.72 0.00 0.00 179.24 176.84 3gud n TYR 685 N -3.68 0.67 -3.24 4.55 4.02 -1.18 -4.96 117.16 113.34 3gud n TYR 685 Ca -0.01 -0.33 -0.23 0.00 -0.01 0.00 0.00 57.90 57.32 3gud n TYR 685 Cb 0.57 0.00 0.04 0.00 -0.02 0.00 0.00 39.34 39.93 3gud n TYR 685 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3gud n GLY 686 N 1.38 -0.53 0.11 2.72 0.00 -1.01 -4.87 105.19 103.00 3gud n GLY 686 Ca 0.19 0.16 0.10 0.00 0.00 0.00 0.00 46.02 46.47 3gud n GLY 686 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3gud n LEU 687 N -4.28 0.83 -3.92 0.99 4.77 -1.08 -4.53 117.00 109.79 3gud n LEU 687 Ca -0.07 0.33 -0.10 0.00 -0.03 0.00 0.00 56.01 56.14 3gud n LEU 687 Cb 0.59 -0.05 -0.11 0.00 -2.33 0.00 0.00 43.42 41.53 3gud n LEU 687 CO 0.54 -0.15 -0.26 -0.69 -1.33 0.00 0.00 177.39 175.49 3gud s VAL 688 N -3.33 0.09 0.20 4.08 1.01 -1.26 -2.15 120.40 119.05 3gud s VAL 688 Ca -0.01 -0.74 0.09 0.00 0.00 0.00 0.00 61.98 61.32 3gud s VAL 688 Cb 0.10 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 36.09 3gud s VAL 688 CO 0.80 -0.41 -0.18 -0.83 0.00 0.00 0.00 175.10 174.47 3gud s GLY 689 N -1.33 1.54 0.01 4.51 0.00 -1.05 -4.68 107.32 106.33 3gud s GLY 689 Ca -0.14 -1.63 0.03 0.00 0.00 0.00 0.00 44.72 42.97 3gud s GLY 689 CO 0.00 -1.70 -0.09 -0.47 0.00 0.00 0.00 173.10 170.84 3gud s TYR 690 N -2.35 0.81 -0.07 1.90 5.04 -1.26 -2.56 117.35 118.86 3gud s TYR 690 Ca 0.21 -0.23 -0.05 0.00 -2.44 0.00 0.00 57.07 54.55 3gud s TYR 690 Cb -0.04 -0.51 0.02 0.00 0.35 0.00 0.00 41.96 41.78 3gud s TYR 690 CO 0.09 -0.01 0.17 0.34 -1.34 0.00 0.00 175.55 174.80 3gud s ASP 691 N -0.58 -0.17 0.02 4.32 2.15 -0.54 -5.01 116.67 116.85 3gud s ASP 691 Ca 0.01 0.35 -0.04 0.00 0.43 0.00 0.00 52.55 53.30 3gud s ASP 691 Cb -0.05 0.33 -0.01 0.00 -0.30 0.00 0.00 42.92 42.89 3gud s ASP 691 CO 0.00 -0.08 0.07 -0.70 -0.17 0.00 0.00 175.17 174.29 3gud s GLU 692 N 0.36 0.46 0.09 4.34 -6.30 -1.26 -0.92 118.70 115.46 3gud s GLU 692 Ca -0.02 -0.58 -0.08 0.00 -2.50 0.00 0.00 54.97 51.79 3gud s GLU 692 Cb -0.04 0.18 -0.01 0.00 0.00 0.00 0.00 34.13 34.27 3gud s GLU 692 CO -0.01 -0.10 0.17 1.67 0.02 0.00 0.00 175.26 177.00 3gud s TRP 693 N -1.79 0.22 0.43 5.30 -2.14 -1.03 -5.02 118.94 114.91 3gud s TRP 693 Ca -0.12 -0.66 -0.16 0.00 2.66 0.00 0.00 56.10 57.82 3gud s TRP 693 Cb -0.06 -0.11 -0.08 0.00 -3.10 0.00 0.00 33.47 30.12 3gud s TRP 693 CO -0.01 -0.54 0.88 -1.21 -2.66 0.00 0.00 176.95 173.41 3gud s GLU 694 N -3.88 3.98 -0.50 3.25 0.41 -1.26 -4.11 118.70 116.59 3gud s GLU 694 Ca 0.06 0.82 -0.27 0.00 -0.41 0.00 0.00 54.97 55.17 3gud s GLU 694 Cb 0.05 -2.26 0.03 0.00 -1.78 0.00 0.00 34.13 30.17 3gud s GLU 694 CO -0.10 -0.08 1.07 0.00 -0.49 0.00 0.00 175.26 175.66 3gud s ALA 695 N -2.34 3.15 0.07 5.21 0.00 -1.26 -4.52 121.76 122.06 3gud s ALA 695 Ca 0.57 -0.71 -0.19 0.00 0.00 0.00 0.00 51.96 51.63 3gud s ALA 695 Cb -0.10 -3.83 -0.07 0.00 0.00 0.00 0.00 23.12 19.12 3gud s ALA 695 CO 0.25 -2.29 0.56 0.95 0.00 0.00 0.00 175.76 175.22 3gud s THR 696 N 4.30 4.76 0.67 0.00 -4.23 -0.31 -4.92 115.64 115.91 3gud s THR 696 Ca 0.42 1.19 -0.17 0.00 -1.18 0.00 0.00 61.69 61.95 3gud s THR 696 Cb -0.08 -3.89 0.00 0.00 1.34 0.00 0.00 72.50 69.87 3gud s THR 696 CO 0.28 0.56 1.27 -1.61 -0.54 0.00 0.00 174.62 174.58 3gud s GLU 697 N -1.11 2.43 -0.39 3.99 0.41 -1.26 -3.00 118.70 119.77 3gud s GLU 697 Ca 0.29 1.98 -0.27 0.00 -0.41 0.00 0.00 54.97 56.56 3gud s GLU 697 Cb -0.19 -1.84 0.02 0.00 -1.78 0.00 0.00 34.13 30.34 3gud s GLU 697 CO 0.19 -1.67 0.98 -0.51 -0.49 0.00 0.00 175.26 173.75 3gud s ASP 698 N -1.56 6.68 -0.17 -0.19 1.01 -1.26 -3.91 116.67 117.26 3gud s ASP 698 Ca 0.80 0.55 0.00 0.00 0.71 0.00 0.00 52.55 54.62 3gud s ASP 698 Cb -0.35 -2.49 0.01 0.00 1.01 0.00 0.00 42.92 41.10 3gud s ASP 698 CO 0.41 -0.95 -0.16 -1.61 0.21 0.00 0.00 175.17 173.06 3gud s GLU 699 N 3.69 3.12 -0.26 8.23 0.41 -1.19 -5.04 118.70 127.67 3gud s GLU 699 Ca 0.40 -0.78 -0.07 0.00 -0.41 0.00 0.00 54.97 54.12 3gud s GLU 699 Cb -0.11 -2.63 -0.02 0.00 -1.78 0.00 0.00 34.13 29.59 3gud s GLU 699 CO 0.21 -0.11 0.06 0.71 -0.49 0.00 0.00 175.26 175.64 3gud s TYR 700 N 1.10 3.08 0.11 1.61 2.02 -1.23 -2.57 117.35 121.47 3gud s TYR 700 Ca 0.00 -0.63 -0.08 0.00 -0.37 0.00 0.00 57.07 55.99 3gud s TYR 700 Cb -0.14 -2.23 -0.01 0.00 -0.40 0.00 0.00 41.96 39.18 3gud s TYR 700 CO -0.06 -0.44 0.20 -0.51 -1.57 0.00 0.00 175.55 173.17 3gud s ASP 701 N 1.57 0.13 -0.28 2.29 -0.00 -0.80 -4.14 116.67 115.44 3gud s ASP 701 Ca 0.05 -0.76 -0.01 0.00 -0.00 0.00 0.00 52.55 51.84 3gud s ASP 701 Cb -0.15 0.35 0.19 0.00 -0.00 0.00 0.00 42.92 43.31 3gud s ASP 701 CO 0.02 -0.77 2.01 -1.54 -0.00 0.00 0.00 175.17 174.90 3gud n SER 702 N -0.09 6.31 -1.39 0.27 3.41 -1.26 -4.66 113.62 116.21 3gud n SER 702 Ca -0.12 -2.99 -0.01 0.00 -0.26 0.00 0.00 58.87 55.49 3gud n SER 702 Cb 0.63 -1.06 -0.00 0.00 -0.26 0.00 0.00 64.21 63.51 3gud n SER 702 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3gud n GLU 703 N 0.48 0.64 0.00 4.33 4.07 -1.26 -5.00 120.64 123.90 3gud n GLU 703 Ca 0.26 -0.10 0.00 0.00 -0.06 0.00 0.00 57.16 57.26 3gud n GLU 703 Cb 0.57 0.06 0.00 0.00 -0.06 0.00 0.00 31.44 32.01 3gud n GLU 703 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3gud n GLY 704 N 1.55 -0.53 3.79 8.31 0.00 -1.26 -4.64 105.19 112.40 3gud n GLY 704 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 3gud n GLY 704 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gud s ASN 705 N -0.98 7.25 -0.18 1.61 0.01 -1.26 -4.90 114.94 116.49 3gud s ASN 705 Ca 0.00 1.49 -0.18 0.00 -0.71 0.00 0.00 52.86 53.46 3gud s ASN 705 Cb 0.00 -2.44 -0.03 0.00 0.41 0.00 0.00 41.25 39.18 3gud s ASN 705 CO 0.00 0.23 0.51 -0.22 -1.51 0.00 0.00 177.10 176.11 3gud s LEU 706 N -1.18 4.18 -0.28 0.60 1.98 -1.26 -1.90 118.68 120.82 3gud s LEU 706 Ca 0.34 0.71 -0.14 0.00 -2.89 0.00 0.00 54.13 52.15 3gud s LEU 706 Cb -0.21 -2.71 -0.12 0.00 0.66 0.00 0.00 46.19 43.80 3gud s LEU 706 CO 0.23 -0.14 -0.36 0.52 -1.89 0.00 0.00 176.35 174.71 3gud n VAL 707 N 4.36 1.52 -3.86 1.68 0.31 -1.06 -4.99 118.33 116.28 3gud n VAL 707 Ca -0.05 -0.38 -0.12 0.00 -0.01 0.00 0.00 64.34 63.77 3gud n VAL 707 Cb 0.51 -1.88 -0.14 0.00 -0.91 0.00 0.00 33.84 31.42 3gud n VAL 707 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 3gud s GLU 708 N -2.51 0.01 -0.29 5.55 0.41 -1.24 -5.10 118.70 115.52 3gud s GLU 708 Ca -0.39 0.02 -0.07 0.00 -0.41 0.00 0.00 54.97 54.12 3gud s GLU 708 Cb 0.15 -0.00 0.01 0.00 -1.78 0.00 0.00 34.13 32.50 3gud s GLU 708 CO 0.49 -0.01 0.08 -1.59 -0.49 0.00 0.00 175.26 173.74 3gud s LYS 709 N 0.04 3.15 0.00 1.61 0.00 -1.26 -3.14 119.74 120.14 3gud s LYS 709 Ca -0.00 -0.82 0.00 0.00 0.00 0.00 0.00 55.97 55.15 3gud s LYS 709 Cb -0.00 -3.36 0.00 0.00 0.00 0.00 0.00 37.83 34.46 3gud s LYS 709 CO -0.00 -0.42 0.00 0.41 0.00 0.00 0.00 175.35 175.34 3gud n GLY 710 N 4.87 0.85 3.45 0.59 0.00 -1.25 -5.06 105.19 108.64 3gud n GLY 710 Ca -0.15 -0.37 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 3gud n GLY 710 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gud s ARG 711 N 3.01 2.96 0.05 1.61 0.52 -1.16 -4.97 118.95 120.97 3gud s ARG 711 Ca 0.00 -0.66 -0.21 0.00 -0.52 0.00 0.00 55.73 54.34 3gud s ARG 711 Cb 0.00 -2.54 -0.06 0.00 0.52 0.00 0.00 34.95 32.87 3gud s ARG 711 CO 0.00 0.44 0.61 -2.00 0.02 0.00 0.00 175.30 174.37 3gud s GLU 712 N -0.24 4.30 0.26 3.54 2.12 -1.26 -1.17 118.70 126.25 3gud s GLU 712 Ca 0.02 0.80 -0.31 0.00 0.36 0.00 0.00 54.97 55.84 3gud s GLU 712 Cb -0.13 -3.29 -0.13 0.00 0.26 0.00 0.00 34.13 30.84 3gud s GLU 712 CO 0.03 0.51 1.44 0.00 -0.54 0.00 0.00 175.26 176.70 3gud n ALA 713 N 2.14 1.45 -3.34 6.30 0.00 -1.26 -4.85 120.51 120.95 3gud n ALA 713 Ca -0.08 0.40 -0.03 0.00 0.00 0.00 0.00 53.44 53.73 3gud n ALA 713 Cb 0.51 -2.32 -0.00 0.00 0.00 0.00 0.00 19.45 17.64 3gud n ALA 713 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gud n GLY 714 N 2.07 2.26 3.44 0.00 0.00 -1.26 -5.00 105.19 106.71 3gud n GLY 714 Ca 0.10 -1.31 -0.15 0.00 0.00 0.00 0.00 46.02 44.66 3gud n GLY 714 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gud s ASN 715 N -1.78 1.02 -0.28 1.61 2.20 -1.26 -2.46 114.94 113.99 3gud s ASN 715 Ca 0.09 -1.52 -0.20 0.00 -0.94 0.00 0.00 52.86 50.28 3gud s ASN 715 Cb -0.01 0.63 0.12 0.00 -2.00 0.00 0.00 41.25 39.99 3gud s ASN 715 CO 0.06 -1.23 0.93 -0.51 -2.94 0.00 0.00 177.10 173.41 3gud s ILE 716 N -3.19 0.00 -0.14 0.54 2.07 -0.10 -4.99 121.20 115.40 3gud s ILE 716 Ca 0.33 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.50 3gud s ILE 716 Cb 0.00 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.55 3gud s ILE 716 CO 0.21 0.00 0.10 -0.31 -1.91 0.00 0.00 174.94 173.03 3gud s TYR 717 N 0.85 3.43 0.26 3.50 1.51 -1.26 -1.47 117.35 124.18 3gud s TYR 717 Ca -0.03 0.36 0.01 0.00 -1.01 0.00 0.00 57.07 56.40 3gud s TYR 717 Cb -0.05 -1.97 -0.00 0.00 -0.11 0.00 0.00 41.96 39.83 3gud s TYR 717 CO -0.11 0.52 0.03 -1.13 -1.11 0.00 0.00 175.55 173.75 3gud n SER 718 N 2.52 2.21 -4.34 2.29 3.41 -1.06 -4.88 113.62 113.77 3gud n SER 718 Ca -0.19 -2.22 -0.18 0.00 -0.26 0.00 0.00 58.87 56.03 3gud n SER 718 Cb 0.54 0.32 -0.10 0.00 -0.26 0.00 0.00 64.21 64.71 3gud n SER 718 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3gud s ILE 719 N -2.14 1.39 -0.83 -1.33 -4.36 -1.26 -2.53 121.20 110.14 3gud s ILE 719 Ca 0.04 -2.11 -0.07 0.00 -0.26 0.00 0.00 60.65 58.25 3gud s ILE 719 Cb 0.00 -2.18 0.21 0.00 1.25 0.00 0.00 42.46 41.74 3gud s ILE 719 CO 0.03 -0.49 0.72 -0.13 0.24 0.00 0.00 174.94 175.32 3gud s ARG 720 N -3.75 3.30 0.43 0.37 1.81 -0.91 -4.84 118.95 115.35 3gud s ARG 720 Ca 0.24 -2.82 0.15 0.00 -1.72 0.00 0.00 55.73 51.58 3gud s ARG 720 Cb 0.03 -4.11 1.04 0.00 -0.45 0.00 0.00 34.95 31.46 3gud s ARG 720 CO 0.07 -1.24 1.95 -1.35 -0.68 0.00 0.00 175.30 174.05 3gud h PRO 721 N 6.90 0.40 -0.04 3.54 0.11 -1.92 -1.81 132.00 139.18 3gud h PRO 721 Ca 0.10 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 66.02 3gud h PRO 721 Cb 0.93 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 3gud h PRO 721 CO 0.81 0.26 -0.69 1.15 -0.21 0.00 0.00 178.00 179.32 3gud h THR 722 N 0.41 1.42 -0.14 -1.15 2.02 -1.96 -0.71 112.91 112.80 3gud h THR 722 Ca 0.33 -2.19 -0.17 0.00 0.77 0.00 0.00 66.41 65.15 3gud h THR 722 Cb 0.71 2.15 -0.01 0.00 -1.74 0.00 0.00 68.15 69.27 3gud h THR 722 CO -0.10 0.64 -0.62 -0.08 0.37 0.00 0.00 175.52 175.74 3gud h GLU 723 N 0.15 0.49 -0.69 6.66 4.57 -1.64 -2.82 114.58 121.29 3gud h GLU 723 Ca -0.02 -0.34 -0.06 0.00 -1.18 0.00 0.00 59.36 57.76 3gud h GLU 723 Cb 1.23 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 29.85 3gud h GLU 723 CO 0.11 0.96 0.20 0.00 -1.18 0.00 0.00 179.01 179.09 3gud h GLN 725 N 1.02 0.71 0.10 0.00 4.20 -1.15 -1.32 115.11 118.66 3gud h GLN 725 Ca 0.22 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.75 3gud h GLN 725 Cb 0.32 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 3gud h GLN 725 CO -0.00 0.75 -0.45 -1.49 -0.67 0.00 0.00 178.83 176.97 3gud h TRP 726 N 0.56 -1.30 -0.68 2.96 -0.00 -1.40 0.73 115.95 116.82 3gud h TRP 726 Ca 0.13 0.03 0.03 0.00 -0.00 0.00 0.00 58.89 59.08 3gud h TRP 726 Cb 0.39 0.55 -0.04 0.00 -0.00 0.00 0.00 29.16 30.07 3gud h TRP 726 CO 0.03 -0.51 0.45 1.25 -0.00 0.00 0.00 178.44 179.66 3gud h LEU 727 N -0.64 0.72 -0.23 -4.49 5.85 -1.42 0.14 115.31 115.24 3gud h LEU 727 Ca -0.01 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.72 3gud h LEU 727 Cb 0.64 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 3gud h LEU 727 CO -0.24 0.50 0.10 -0.08 -0.34 0.00 0.00 178.44 178.38 3gud h GLU 728 N 0.84 0.22 0.00 1.25 4.57 -0.85 0.01 114.58 120.62 3gud h GLU 728 Ca 0.27 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.32 3gud h GLU 728 Cb 0.03 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.56 3gud h GLU 728 CO -0.07 0.15 -0.56 0.52 -1.18 0.00 0.00 179.01 177.86 3gud h MET 729 N 0.23 0.00 -0.28 1.92 2.86 0.67 -1.57 114.93 118.76 3gud h MET 729 Ca 0.09 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 3gud h MET 729 Cb 0.03 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.68 3gud h MET 729 CO -0.07 0.56 -0.26 0.00 1.06 0.00 0.00 176.91 178.20 3gud h ALA 730 N 1.44 1.03 0.11 6.32 0.00 -0.62 -1.29 119.26 126.24 3gud h ALA 730 Ca -0.01 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 3gud h ALA 730 Cb 1.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3gud h ALA 730 CO 0.07 0.58 -0.05 0.00 0.00 0.00 0.00 179.25 179.85 3gud n MET 732 N -5.09 0.09 -0.02 0.00 2.81 -0.63 -2.09 117.12 112.19 3gud n MET 732 Ca -0.08 0.05 -0.16 0.00 -1.81 0.00 0.00 57.70 55.69 3gud n MET 732 Cb 0.14 -1.50 -0.10 0.00 -0.71 0.00 0.00 33.22 31.05 3gud n MET 732 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3gud h ARG 733 N 0.00 0.36 -0.35 0.03 3.08 -1.04 -3.29 114.38 113.17 3gud h ARG 733 Ca 0.00 -0.34 -0.06 0.00 0.07 0.00 0.00 59.98 59.65 3gud h ARG 733 Cb 0.40 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3gud h ARG 733 CO 0.00 1.00 -0.01 -0.09 -1.07 0.00 0.00 179.97 179.80 3gud h ARG 734 N -0.15 0.62 -0.76 0.04 2.43 -1.01 -2.52 114.38 113.04 3gud h ARG 734 Ca -0.04 -0.20 0.07 0.00 -0.81 0.00 0.00 59.98 59.00 3gud h ARG 734 Cb 1.12 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.56 3gud h ARG 734 CO 0.09 0.74 0.50 0.87 -1.51 0.00 0.00 179.97 180.66 3gud h LYS 735 N 0.43 0.74 0.00 0.20 1.57 -1.62 -2.13 116.57 115.76 3gud h LYS 735 Ca 0.10 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.70 3gud h LYS 735 Cb 0.47 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.59 3gud h LYS 735 CO 0.02 0.49 -0.62 -0.07 -0.57 0.00 0.00 179.45 178.70 3gud h LEU 736 N 0.77 0.00 -0.65 2.94 4.07 -1.56 0.58 115.31 121.46 3gud h LEU 736 Ca 0.33 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.29 3gud h LEU 736 Cb 0.30 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.04 3gud h LEU 736 CO -0.12 0.62 0.00 -0.62 -1.08 0.00 0.00 178.44 177.25 3gud n GLU 737 N -3.69 0.13 -1.96 1.13 1.02 -0.89 -4.85 120.64 111.54 3gud n GLU 737 Ca -0.01 0.44 -0.02 0.00 -0.02 0.00 0.00 57.16 57.55 3gud n GLU 737 Cb 0.64 -1.78 -0.00 0.00 -0.02 0.00 0.00 31.44 30.28 3gud n GLU 737 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3gud n ARG 738 N -2.03 -0.14 -0.10 3.49 1.74 0.20 -4.91 116.66 114.92 3gud n ARG 738 Ca 0.01 0.12 0.01 0.00 -0.77 0.00 0.00 57.85 57.22 3gud n ARG 738 Cb 0.16 -3.72 0.04 0.00 -1.02 0.00 0.00 32.46 27.92 3gud n ARG 738 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 3gud n LEU 739 N -0.25 1.58 0.00 0.55 -0.00 -0.86 -4.99 117.00 113.03 3gud n LEU 739 Ca -0.02 -0.80 0.00 0.00 -0.00 0.00 0.00 56.01 55.19 3gud n LEU 739 Cb 0.48 -0.52 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 3gud n LEU 739 CO 0.02 0.30 0.00 -0.24 -0.00 0.00 0.00 177.39 177.47