#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gud n ASP 621 N 0.00 3.07 -0.45 -3.46 9.92 -1.26 -4.89 116.55 119.49 3gud n ASP 621 Ca 0.00 1.03 0.41 0.00 -0.53 0.00 0.00 54.79 55.70 3gud n ASP 621 Cb 0.00 -1.34 0.75 0.00 -0.64 0.00 0.00 41.12 39.89 3gud n ASP 621 CO 0.00 0.00 0.00 -0.08 0.13 0.00 0.00 177.20 177.25 3gud h GLU 622 N 7.77 0.00 -6.04 -1.24 4.81 -2.07 -3.33 114.58 114.48 3gud h GLU 622 Ca -0.47 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.09 3gud h GLU 622 Cb 1.28 0.00 -0.14 0.00 0.63 0.00 0.00 28.75 30.52 3gud h GLU 622 CO 0.92 0.00 -0.62 -0.98 -0.73 0.00 0.00 179.01 177.60 3gud s ARG 623 N -4.83 2.93 0.00 1.92 1.70 -1.26 -3.87 118.95 115.54 3gud s ARG 623 Ca -0.05 -0.49 0.00 0.00 -0.47 0.00 0.00 55.73 54.73 3gud s ARG 623 Cb 0.23 -2.76 0.00 0.00 -0.57 0.00 0.00 34.95 31.85 3gud s ARG 623 CO 0.79 0.67 0.00 0.72 -1.08 0.00 0.00 175.30 176.40 3gud n HIS 624 N 1.74 0.00 -4.44 5.89 8.25 -1.26 -5.06 115.22 120.33 3gud n HIS 624 Ca -0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.07 3gud n HIS 624 Cb 0.53 0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.51 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 -0.45 1.10 0.25 -0.41 1.02 -1.25 -5.02 119.74 114.98 3gud s LYS 625 Ca 0.00 -0.86 0.01 0.00 0.02 0.00 0.00 55.97 55.13 3gud s LYS 625 Cb 0.00 -1.17 -0.00 0.00 -0.52 0.00 0.00 37.83 36.14 3gud s LYS 625 CO 0.00 0.29 0.32 -2.37 -0.92 0.00 0.00 175.35 172.67 3gud n THR 626 N 1.79 0.00 -1.12 2.17 5.66 -1.26 -4.79 114.28 116.73 3gud n THR 626 Ca -0.18 -1.43 -0.08 0.00 -3.05 0.00 0.00 64.05 59.31 3gud n THR 626 Cb 0.54 0.83 -0.03 0.00 -1.55 0.00 0.00 70.33 70.11 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 -1.84 -4.57 -4.66 1.09 8.00 -1.26 -4.82 116.55 108.49 3gud n ASP 627 Ca 0.02 0.19 -0.42 0.00 0.71 0.00 0.00 54.79 55.29 3gud n ASP 627 Cb 0.43 -3.39 -0.03 0.00 -0.02 0.00 0.00 41.12 38.12 3gud n ASP 627 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 3gud s ILE 628 N -1.55 3.01 0.26 0.53 1.10 -1.26 -4.91 121.20 118.37 3gud s ILE 628 Ca 0.00 0.10 -0.09 0.00 -0.51 0.00 0.00 60.65 60.15 3gud s ILE 628 Cb 0.00 -3.07 -0.01 0.00 0.15 0.00 0.00 42.46 39.54 3gud s ILE 628 CO 0.00 -0.01 0.43 0.00 -2.11 0.00 0.00 174.94 173.25 3gud s ALA 629 N 4.17 0.15 0.86 1.50 0.00 -1.26 -5.15 121.76 122.03 3gud s ALA 629 Ca 0.86 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.59 3gud s ALA 629 Cb -0.42 1.13 0.11 0.00 0.00 0.00 0.00 23.12 23.94 3gud s ALA 629 CO 0.40 -0.80 1.09 -2.14 0.00 0.00 0.00 175.76 174.30 3gud s PRO 630 N -3.84 1.54 0.13 0.00 0.02 -1.26 -4.95 135.00 126.63 3gud s PRO 630 Ca 0.26 0.84 -0.30 0.00 0.02 0.00 0.00 61.00 61.82 3gud s PRO 630 Cb 0.01 -1.84 -0.07 0.00 0.02 0.00 0.00 34.50 32.62 3gud s PRO 630 CO 0.11 -2.05 1.14 0.42 -0.33 0.00 0.00 177.00 176.29 3gud s ILE 631 N -2.96 3.95 0.24 2.83 1.01 -1.26 -4.93 121.20 120.08 3gud s ILE 631 Ca 0.63 1.55 -0.31 0.00 0.00 0.00 0.00 60.65 62.52 3gud s ILE 631 Cb -0.17 -3.99 -0.12 0.00 0.01 0.00 0.00 42.46 38.18 3gud s ILE 631 CO 0.56 0.21 1.66 -0.24 0.00 0.00 0.00 174.94 177.13 3gud n SER 632 N 3.02 3.88 0.22 3.58 2.88 -1.26 -4.84 113.62 121.10 3gud n SER 632 Ca 0.05 1.10 0.06 0.00 -1.33 0.00 0.00 58.87 58.75 3gud n SER 632 Cb 0.46 -1.57 0.50 0.00 -0.75 0.00 0.00 64.21 62.85 3gud n SER 632 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 3gud h ASP 633 N 5.85 0.00 -0.26 -3.46 3.45 -1.99 -2.18 116.42 117.83 3gud h ASP 633 Ca -0.45 0.00 -0.03 0.00 0.43 0.00 0.00 57.03 56.99 3gud h ASP 633 Cb 1.21 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.97 3gud h ASP 633 CO 0.88 0.23 0.06 0.11 -1.57 0.00 0.00 179.24 178.95 3gud h LYS 634 N 0.00 0.42 0.00 3.56 1.57 -2.00 -2.74 116.57 117.38 3gud h LYS 634 Ca -0.00 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.63 3gud h LYS 634 Cb 0.43 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 3gud h LYS 634 CO 0.03 0.52 -0.21 0.28 -0.57 0.00 0.00 179.45 179.49 3gud h VAL 635 N 0.25 0.99 0.00 0.50 2.07 -1.76 -0.66 116.25 117.64 3gud h VAL 635 Ca 0.08 -0.77 -0.08 0.00 0.82 0.00 0.00 66.70 66.75 3gud h VAL 635 Cb 0.29 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 3gud h VAL 635 CO 0.00 0.21 -0.53 -0.07 0.02 0.00 0.00 177.57 177.20 3gud h LEU 636 N 0.00 0.00 0.90 2.57 3.38 -1.60 -2.58 115.31 117.98 3gud h LEU 636 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3gud h LEU 636 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3gud h LEU 636 CO 0.03 0.36 -0.47 0.44 0.09 0.00 0.00 178.44 178.89 3gud h ASP 637 N 0.00 -1.14 -0.59 -0.43 3.32 -0.80 -1.66 116.42 115.11 3gud h ASP 637 Ca -0.02 0.05 0.12 0.00 0.02 0.00 0.00 57.03 57.20 3gud h ASP 637 Cb 1.29 0.31 -0.11 0.00 0.22 0.00 0.00 39.33 41.05 3gud h ASP 637 CO 0.04 -0.77 -0.06 0.00 -1.72 0.00 0.00 179.24 176.73 3gud h ALA 638 N -1.19 0.50 0.00 3.45 0.00 -1.52 -0.90 119.26 119.61 3gud h ALA 638 Ca -0.12 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gud h ALA 638 Cb 0.98 0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3gud h ALA 638 CO 0.17 -0.41 0.00 2.35 0.00 0.00 0.00 179.25 181.36 3gud h TRP 639 N 0.06 0.00 0.00 0.00 2.91 -1.31 -2.62 115.95 114.99 3gud h TRP 639 Ca 0.30 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 60.31 3gud h TRP 639 Cb 0.48 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.12 3gud h TRP 639 CO -0.41 0.00 -0.05 0.93 -1.03 0.00 0.00 178.44 177.88 3gud h GLU 640 N 0.00 0.00 -0.30 2.65 5.08 -0.17 -2.70 114.58 119.14 3gud h GLU 640 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3gud h GLU 640 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3gud h GLU 640 CO 0.00 0.05 0.00 1.63 -1.00 0.00 0.00 179.01 179.69 3gud n LYS 641 N -3.85 2.30 -2.51 2.33 5.02 -0.99 -4.94 118.16 115.52 3gud n LYS 641 Ca -0.03 -1.90 -0.40 0.00 -2.02 0.00 0.00 58.31 53.96 3gud n LYS 641 Cb 0.14 -1.29 -0.04 0.00 -0.02 0.00 0.00 35.03 33.82 3gud n LYS 641 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3gud s VAL 642 N -1.02 3.62 0.10 -0.18 1.01 -1.02 -5.03 120.40 117.88 3gud s VAL 642 Ca 0.24 1.59 0.06 0.00 0.00 0.00 0.00 61.98 63.86 3gud s VAL 642 Cb 0.13 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.46 3gud s VAL 642 CO 0.18 0.36 -0.04 -0.54 0.00 0.00 0.00 175.10 175.05 3gud s LYS 643 N -1.20 2.36 0.05 2.72 1.02 -1.26 -5.06 119.74 118.37 3gud s LYS 643 Ca 0.45 -0.93 -0.00 0.00 0.02 0.00 0.00 55.97 55.51 3gud s LYS 643 Cb -0.31 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.53 3gud s LYS 643 CO 0.39 0.52 0.21 -0.06 -0.92 0.00 0.00 175.35 175.49 3gud s PHE 644 N -1.28 3.52 0.27 3.18 0.08 -1.26 -4.41 117.98 118.07 3gud s PHE 644 Ca 0.24 0.26 0.03 0.00 0.12 0.00 0.00 56.93 57.58 3gud s PHE 644 Cb -0.11 -1.76 -0.04 0.00 -0.57 0.00 0.00 43.02 40.54 3gud s PHE 644 CO 0.16 0.59 0.20 0.71 -0.10 0.00 0.00 175.22 176.79 3gud s TYR 645 N -1.49 1.48 0.26 0.36 2.02 -0.43 -5.01 117.35 114.54 3gud s TYR 645 Ca 0.34 -1.52 0.09 0.00 -0.37 0.00 0.00 57.07 55.61 3gud s TYR 645 Cb -0.13 -0.66 -0.04 0.00 -0.40 0.00 0.00 41.96 40.74 3gud s TYR 645 CO 0.27 -0.74 0.08 1.14 -1.57 0.00 0.00 175.55 174.73 3gud s GLN 646 N -3.80 2.56 -0.09 -0.62 -2.07 -1.26 -3.07 119.66 111.31 3gud s GLN 646 Ca 0.40 -1.27 -0.33 0.00 -1.82 0.00 0.00 55.36 52.34 3gud s GLN 646 Cb 0.05 -2.33 0.14 0.00 -1.09 0.00 0.00 33.01 29.77 3gud s GLN 646 CO 0.20 0.38 1.34 1.52 -1.32 0.00 0.00 175.29 177.41 3gud s TYR 647 N -2.25 -0.03 0.17 9.60 -0.85 -0.90 -4.99 117.35 118.10 3gud s TYR 647 Ca 0.32 -0.02 0.02 0.00 -0.52 0.00 0.00 57.07 56.87 3gud s TYR 647 Cb -0.07 0.52 -0.05 0.00 0.38 0.00 0.00 41.96 42.75 3gud s TYR 647 CO 0.22 -0.15 -0.00 0.15 -1.52 0.00 0.00 175.55 174.24 3gud s LYS 648 N -2.25 1.11 0.02 -3.49 1.02 -1.26 0.11 119.74 115.00 3gud s LYS 648 Ca 0.14 -1.53 -0.19 0.00 0.02 0.00 0.00 55.97 54.41 3gud s LYS 648 Cb 0.05 -0.29 -0.06 0.00 -0.52 0.00 0.00 37.83 37.01 3gud s LYS 648 CO -0.05 -0.12 0.55 -0.06 -0.92 0.00 0.00 175.35 174.75 3gud s PHE 649 N -3.64 3.73 0.56 3.18 0.08 -1.26 -4.97 117.98 115.66 3gud s PHE 649 Ca 0.24 1.18 0.27 0.00 0.12 0.00 0.00 56.93 58.73 3gud s PHE 649 Cb 0.06 -2.51 1.50 0.00 -0.57 0.00 0.00 43.02 41.50 3gud s PHE 649 CO 0.04 0.49 2.01 0.87 -0.10 0.00 0.00 175.22 178.52 3gud h LYS 650 N 5.10 0.00 0.18 0.44 1.57 -2.00 -2.57 116.57 119.28 3gud h LYS 650 Ca -0.48 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 57.96 3gud h LYS 650 Cb 1.21 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.53 3gud h LYS 650 CO 0.66 0.00 -1.68 -0.44 -0.57 0.00 0.00 179.45 177.42 3gud h ASP 651 N 0.00 0.59 -0.80 0.86 3.45 -1.99 -2.94 116.42 115.60 3gud h ASP 651 Ca 0.18 -0.85 0.02 0.00 0.43 0.00 0.00 57.03 56.82 3gud h ASP 651 Cb 0.86 -0.19 -0.04 0.00 -0.56 0.00 0.00 39.33 39.39 3gud h ASP 651 CO -0.00 1.71 0.52 0.00 -1.57 0.00 0.00 179.24 179.89 3gud h ALA 652 N 0.20 1.03 0.00 3.45 0.00 -1.89 -0.94 119.26 121.11 3gud h ALA 652 Ca -0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3gud h ALA 652 Cb 2.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3gud h ALA 652 CO 0.18 0.36 0.00 0.28 0.00 0.00 0.00 179.25 180.08 3gud h VAL 653 N 1.02 0.00 0.18 0.00 2.07 -1.57 0.38 116.25 118.33 3gud h VAL 653 Ca 0.31 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 3gud h VAL 653 Cb -0.04 1.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3gud h VAL 653 CO -0.09 0.00 -0.09 -0.78 0.02 0.00 0.00 177.57 176.63 3gud h ASP 654 N 0.00 -0.21 -0.17 0.57 1.82 -1.03 0.10 116.42 117.51 3gud h ASP 654 Ca 0.00 -0.26 -0.15 0.00 -0.39 0.00 0.00 57.03 56.22 3gud h ASP 654 Cb 0.66 0.05 0.00 0.00 0.68 0.00 0.00 39.33 40.73 3gud h ASP 654 CO 0.00 0.17 -0.50 -0.08 -1.61 0.00 0.00 179.24 177.23 3gud h GLU 655 N -0.62 0.63 0.00 0.28 4.81 -0.96 -3.36 114.58 115.36 3gud h GLU 655 Ca -0.03 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 3gud h GLU 655 Cb 0.46 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.91 3gud h GLU 655 CO 0.04 1.08 -1.50 1.63 -0.73 0.00 0.00 179.01 179.53 3gud n LYS 656 N -4.18 0.81 0.00 1.92 5.02 0.13 -5.08 118.16 116.77 3gud n LYS 656 Ca -0.07 -0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 3gud n LYS 656 Cb 0.59 -1.34 0.00 0.00 -0.02 0.00 0.00 35.03 34.26 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 1.55 0.45 0.05 0.72 0.00 0.36 -3.51 105.19 104.80 3gud n GLY 657 Ca -0.02 -0.91 0.01 0.00 0.00 0.00 0.00 46.02 45.11 3gud n GLY 657 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3gud n GLU 658 N 7.94 1.06 0.00 1.61 4.07 -1.26 -2.61 120.64 131.45 3gud n GLU 658 Ca 0.00 -0.09 0.14 0.00 -0.06 0.00 0.00 57.16 57.15 3gud n GLU 658 Cb 0.00 -1.04 0.58 0.00 -0.06 0.00 0.00 31.44 30.92 3gud n GLU 658 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 3gud n GLU 659 N -0.44 1.23 -1.65 5.31 2.13 -1.23 -4.93 120.64 121.06 3gud n GLU 659 Ca 0.02 -0.59 -0.34 0.00 0.66 0.00 0.00 57.16 56.90 3gud n GLU 659 Cb 0.03 -1.49 0.07 0.00 0.27 0.00 0.00 31.44 30.32 3gud n GLU 659 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3gud s ALA 660 N -2.18 2.30 0.45 4.31 0.00 -1.07 -4.95 121.76 120.62 3gud s ALA 660 Ca 0.35 0.84 -0.22 0.00 0.00 0.00 0.00 51.96 52.93 3gud s ALA 660 Cb 0.21 -3.43 -0.09 0.00 0.00 0.00 0.00 23.12 19.81 3gud s ALA 660 CO 0.40 -1.57 1.05 1.03 0.00 0.00 0.00 175.76 176.67 3gud s ARG 661 N -3.80 3.95 0.12 0.00 0.52 -1.26 -5.04 118.95 113.44 3gud s ARG 661 Ca 0.73 1.45 -0.30 0.00 -0.52 0.00 0.00 55.73 57.09 3gud s ARG 661 Cb -0.27 -2.30 -0.06 0.00 0.52 0.00 0.00 34.95 32.83 3gud s ARG 661 CO 0.41 -0.31 1.00 0.71 0.02 0.00 0.00 175.30 177.13 3gud s TYR 662 N -1.82 3.75 0.46 -0.53 2.02 -1.26 -4.58 117.35 115.39 3gud s TYR 662 Ca 0.63 1.74 0.06 0.00 -0.37 0.00 0.00 57.07 59.12 3gud s TYR 662 Cb -0.19 -3.12 -0.02 0.00 -0.40 0.00 0.00 41.96 38.23 3gud s TYR 662 CO 0.24 -0.03 0.21 -1.01 -1.57 0.00 0.00 175.55 173.39 3gud s HIS 663 N 0.06 2.22 0.16 2.71 3.76 0.12 -4.94 115.29 119.37 3gud s HIS 663 Ca 0.48 -0.72 0.02 0.00 -0.15 0.00 0.00 55.06 54.69 3gud s HIS 663 Cb -0.25 -1.89 -0.05 0.00 1.11 0.00 0.00 32.58 31.51 3gud s HIS 663 CO 0.31 0.02 -0.02 -0.06 -0.85 0.00 0.00 174.74 174.14 3gud s PHE 664 N -2.69 1.16 -2.30 1.40 0.40 -1.26 -2.12 117.98 112.56 3gud s PHE 664 Ca 0.33 -0.98 0.00 0.00 -0.60 0.00 0.00 56.93 55.68 3gud s PHE 664 Cb 0.02 -0.66 0.00 0.00 0.51 0.00 0.00 43.02 42.89 3gud s PHE 664 CO 0.19 -0.18 0.00 0.41 0.70 0.00 0.00 175.22 176.34 3gud n GLY 665 N -0.21 0.57 3.95 4.36 0.00 -1.17 -5.00 105.19 107.68 3gud n GLY 665 Ca -0.08 -1.93 -0.24 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.70 1.85 -0.04 1.61 -7.23 -1.26 -1.31 120.40 112.31 3gud s VAL 666 Ca 0.00 -1.30 0.06 0.00 -1.81 0.00 0.00 61.98 58.92 3gud s VAL 666 Cb 0.00 -2.15 -0.01 0.00 0.56 0.00 0.00 36.38 34.78 3gud s VAL 666 CO 0.00 0.00 -0.22 -0.63 -0.31 0.00 0.00 175.10 173.94 3gud s ILE 667 N -2.73 1.76 0.16 -0.62 1.01 -1.26 -4.96 121.20 114.57 3gud s ILE 667 Ca 0.45 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 60.03 3gud s ILE 667 Cb -0.04 -1.49 0.04 0.00 0.01 0.00 0.00 42.46 40.98 3gud s ILE 667 CO 0.28 0.50 1.77 0.00 0.00 0.00 0.00 174.94 177.48 3gud h ALA 668 N 6.05 0.51 -0.40 9.38 0.00 -1.95 -2.70 119.26 130.13 3gud h ALA 668 Ca -0.34 0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 3gud h ALA 668 Cb 1.17 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 3gud h ALA 668 CO 0.47 -0.19 -0.12 1.96 0.00 0.00 0.00 179.25 181.37 3gud h GLN 669 N 0.37 0.73 -0.65 0.00 7.50 -1.97 -1.20 115.11 119.89 3gud h GLN 669 Ca 0.18 -0.24 -0.02 0.00 0.50 0.00 0.00 58.65 59.07 3gud h GLN 669 Cb 0.12 -0.06 -0.03 0.00 0.05 0.00 0.00 27.48 27.56 3gud h GLN 669 CO -0.15 0.82 0.34 0.37 -1.50 0.00 0.00 178.83 178.71 3gud h GLN 670 N 0.66 0.92 -0.41 1.46 5.75 -1.92 0.82 115.11 122.39 3gud h GLN 670 Ca 0.11 -0.12 -0.15 0.00 -0.15 0.00 0.00 58.65 58.35 3gud h GLN 670 Cb 0.59 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 3gud h GLN 670 CO 0.04 0.71 -0.31 0.82 -2.65 0.00 0.00 178.83 177.44 3gud h ILE 671 N 0.89 1.27 0.30 2.39 2.04 -1.34 -2.59 117.51 120.47 3gud h ILE 671 Ca 0.23 -1.48 -0.01 0.00 1.00 0.00 0.00 64.86 64.60 3gud h ILE 671 Cb 0.07 1.30 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 3gud h ILE 671 CO -0.03 0.50 -0.18 0.58 0.00 0.00 0.00 178.15 179.02 3gud h VAL 672 N 0.77 0.00 -1.07 1.67 2.07 -0.86 -2.43 116.25 116.40 3gud h VAL 672 Ca 0.08 0.00 0.32 0.00 0.82 0.00 0.00 66.70 67.92 3gud h VAL 672 Cb 0.90 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.54 3gud h VAL 672 CO 0.08 0.00 0.65 0.11 0.02 0.00 0.00 177.57 178.43 3gud h LYS 673 N -0.44 0.32 0.02 1.57 1.57 0.64 -1.42 116.57 118.82 3gud h LYS 673 Ca -0.04 -0.02 -0.24 0.00 -1.87 0.00 0.00 60.65 58.48 3gud h LYS 673 Cb 0.35 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 3gud h LYS 673 CO 0.04 0.21 -1.25 -0.39 -0.57 0.00 0.00 179.45 177.50 3gud h VAL 674 N 0.33 1.43 -0.35 0.50 -1.51 -1.41 -2.86 116.25 112.38 3gud h VAL 674 Ca 0.71 -3.16 -0.13 0.00 -1.23 0.00 0.00 66.70 62.88 3gud h VAL 674 Cb 1.76 2.74 -0.01 0.00 -2.13 0.00 0.00 31.29 33.64 3gud h VAL 674 CO -0.48 0.83 -0.32 -0.26 -1.23 0.00 0.00 177.57 176.11 3gud h PHE 675 N 0.01 0.91 0.00 5.19 0.05 -0.76 -2.61 116.94 119.73 3gud h PHE 675 Ca -0.11 -0.24 0.00 0.00 3.82 0.00 0.00 57.97 61.44 3gud h PHE 675 Cb 1.87 -0.20 0.00 0.00 2.00 0.00 0.00 35.95 39.62 3gud h PHE 675 CO 0.01 0.99 0.00 0.93 -0.18 0.00 0.00 178.31 180.06 3gud h GLU 676 N 0.65 0.00 0.00 1.51 5.08 -1.05 -2.35 114.58 118.43 3gud h GLU 676 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3gud h GLU 676 Cb 0.86 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.11 3gud h GLU 676 CO 0.08 0.00 0.00 -0.25 -1.00 0.00 0.00 179.01 177.84 3gud n ASP 677 N -2.70 0.00 -0.60 1.42 8.00 -0.98 -2.96 116.55 118.72 3gud n ASP 677 Ca 0.03 -1.64 0.00 0.00 0.71 0.00 0.00 54.79 53.89 3gud n ASP 677 Cb 0.39 0.00 -0.00 0.00 -0.02 0.00 0.00 41.12 41.49 3gud n ASP 677 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3gud n GLU 678 N -0.52 0.00 -0.15 -1.24 1.02 -0.92 -5.02 120.64 113.82 3gud n GLU 678 Ca 0.01 -0.81 0.00 0.00 -0.02 0.00 0.00 57.16 56.34 3gud n GLU 678 Cb 0.00 -0.28 0.00 0.00 -0.02 0.00 0.00 31.44 31.14 3gud n GLU 678 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gud n GLY 679 N 0.04 2.23 3.84 0.62 0.00 -1.15 -4.99 105.19 105.77 3gud n GLY 679 Ca -0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 3gud n GLY 679 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3gud s LEU 680 N 0.00 3.77 -0.14 0.99 2.34 -0.97 -4.97 118.68 119.69 3gud s LEU 680 Ca 0.00 -0.31 -0.00 0.00 0.06 0.00 0.00 54.13 53.88 3gud s LEU 680 Cb 0.00 -2.33 -0.01 0.00 -0.56 0.00 0.00 46.19 43.29 3gud s LEU 680 CO 0.00 -0.13 -0.13 -0.55 -1.06 0.00 0.00 176.35 174.48 3gud s SER 681 N -3.89 3.97 0.58 1.48 0.15 -1.26 -2.22 113.70 112.51 3gud s SER 681 Ca 0.35 -0.36 0.33 0.00 0.70 0.00 0.00 55.95 56.98 3gud s SER 681 Cb -0.07 -1.61 1.79 0.00 -1.71 0.00 0.00 66.02 64.42 3gud s SER 681 CO 0.26 0.14 2.18 0.00 1.20 0.00 0.00 173.24 177.02 3gud h ALA 682 N 6.90 1.22 0.00 5.45 0.00 -1.86 -1.72 119.26 129.25 3gud h ALA 682 Ca -0.28 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.49 3gud h ALA 682 Cb 1.21 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 3gud h ALA 682 CO 0.56 0.06 -0.49 0.74 0.00 0.00 0.00 179.25 180.13 3gud h PHE 683 N 0.00 0.00 0.00 0.00 -1.00 -1.94 -2.17 116.94 111.83 3gud h PHE 683 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 3gud h PHE 683 Cb 0.20 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.76 3gud h PHE 683 CO 0.00 0.49 0.00 -0.25 -1.61 0.00 0.00 178.31 176.94 3gud n ASP 684 N -3.73 0.00 0.00 2.17 8.00 -0.64 -2.13 116.55 120.21 3gud n ASP 684 Ca -0.01 0.43 0.00 0.00 0.71 0.00 0.00 54.79 55.92 3gud n ASP 684 Cb 0.54 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 3gud n ASP 684 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 3gud n TYR 685 N -1.46 0.00 -1.05 1.24 4.02 -1.19 -4.99 117.16 113.73 3gud n TYR 685 Ca 0.03 -0.25 -0.02 0.00 -0.01 0.00 0.00 57.90 57.65 3gud n TYR 685 Cb 0.11 -0.02 -0.01 0.00 -0.02 0.00 0.00 39.34 39.40 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 -0.25 0.51 0.23 2.72 0.00 -0.91 -4.88 105.19 102.61 3gud n GLY 686 Ca 0.00 -0.25 0.10 0.00 0.00 0.00 0.00 46.02 45.86 3gud n GLY 686 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gud h LEU 687 N 0.00 0.00 -8.57 0.99 3.38 -1.64 -3.40 115.31 106.08 3gud h LEU 687 Ca -0.04 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.70 3gud h LEU 687 Cb 0.31 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 40.91 3gud h LEU 687 CO 0.05 0.22 -0.57 -0.69 0.09 0.00 0.00 178.44 177.54 3gud s VAL 688 N -3.96 0.00 0.06 1.22 1.01 -1.25 -1.64 120.40 115.83 3gud s VAL 688 Ca -0.01 -1.95 -0.06 0.00 0.00 0.00 0.00 61.98 59.95 3gud s VAL 688 Cb 0.12 -2.47 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 3gud s VAL 688 CO 0.63 0.00 0.12 -0.83 0.00 0.00 0.00 175.10 175.03 3gud s GLY 689 N -3.16 0.17 -0.04 4.51 0.00 0.52 -4.82 107.32 104.50 3gud s GLY 689 Ca 0.38 -0.66 -0.02 0.00 0.00 0.00 0.00 44.72 44.42 3gud s GLY 689 CO 0.12 -0.82 0.09 -0.47 0.00 0.00 0.00 173.10 172.03 3gud s TYR 690 N -3.35 -0.08 0.00 1.90 5.04 -1.26 0.23 117.35 119.83 3gud s TYR 690 Ca 0.01 0.31 0.04 0.00 -2.44 0.00 0.00 57.07 54.99 3gud s TYR 690 Cb 0.03 -0.12 -0.01 0.00 0.35 0.00 0.00 41.96 42.20 3gud s TYR 690 CO -0.08 -0.12 -0.12 -0.51 -1.34 0.00 0.00 175.55 173.38 3gud s ASP 691 N 0.97 1.37 0.07 4.32 -0.00 -0.09 -4.99 116.67 118.31 3gud s ASP 691 Ca -0.08 -0.27 0.02 0.00 -0.00 0.00 0.00 52.55 52.22 3gud s ASP 691 Cb -0.10 -0.13 -0.03 0.00 -0.00 0.00 0.00 42.92 42.66 3gud s ASP 691 CO -0.04 0.10 -0.08 -0.70 -0.00 0.00 0.00 175.17 174.45 3gud s GLU 692 N -0.52 0.68 0.33 8.23 -6.30 -1.26 0.15 118.70 120.02 3gud s GLU 692 Ca 0.03 -1.01 0.07 0.00 -2.50 0.00 0.00 54.97 51.56 3gud s GLU 692 Cb -0.05 -0.30 -0.03 0.00 0.00 0.00 0.00 34.13 33.74 3gud s GLU 692 CO -0.00 0.03 0.27 1.67 0.02 0.00 0.00 175.26 177.25 3gud s TRP 693 N -2.29 1.75 0.36 5.30 -2.14 0.46 -4.89 118.94 117.49 3gud s TRP 693 Ca -0.00 -1.64 0.09 0.00 2.66 0.00 0.00 56.10 57.20 3gud s TRP 693 Cb -0.04 -0.74 -0.07 0.00 -3.10 0.00 0.00 33.47 29.53 3gud s TRP 693 CO -0.01 -0.84 -0.04 -1.21 -2.66 0.00 0.00 176.95 172.19 3gud s GLU 694 N -3.47 1.91 0.80 3.25 0.41 -1.26 -1.07 118.70 119.27 3gud s GLU 694 Ca 0.40 -1.94 -0.11 0.00 -0.41 0.00 0.00 54.97 52.91 3gud s GLU 694 Cb 0.02 -1.74 0.07 0.00 -1.78 0.00 0.00 34.13 30.70 3gud s GLU 694 CO 0.27 0.09 1.09 0.00 -0.49 0.00 0.00 175.26 176.21 3gud s ALA 695 N -2.61 2.15 -0.01 5.21 0.00 -1.26 -4.05 121.76 121.18 3gud s ALA 695 Ca 0.34 -0.07 0.05 0.00 0.00 0.00 0.00 51.96 52.27 3gud s ALA 695 Cb 0.04 -3.16 -0.01 0.00 0.00 0.00 0.00 23.12 19.99 3gud s ALA 695 CO 0.18 -1.80 -0.15 0.95 0.00 0.00 0.00 175.76 174.94 3gud s THR 696 N -3.06 1.21 0.61 0.00 -4.23 -0.45 -4.83 115.64 104.88 3gud s THR 696 Ca 0.61 -0.65 -0.18 0.00 -1.18 0.00 0.00 61.69 60.30 3gud s THR 696 Cb -0.15 -1.01 -0.08 0.00 1.34 0.00 0.00 72.50 72.60 3gud s THR 696 CO 0.55 0.34 0.51 -0.62 -0.54 0.00 0.00 174.62 174.86 3gud n GLU 697 N 2.76 0.46 -1.75 3.99 -0.58 -1.26 -2.52 120.64 121.74 3gud n GLU 697 Ca -0.15 0.18 -0.32 0.00 -0.42 0.00 0.00 57.16 56.46 3gud n GLU 697 Cb 0.55 -1.72 0.04 0.00 -0.57 0.00 0.00 31.44 29.73 3gud n GLU 697 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 3gud s ASP 698 N -1.23 5.49 -0.24 1.62 1.01 -1.26 -3.17 116.67 118.88 3gud s ASP 698 Ca 0.68 1.72 -0.08 0.00 0.71 0.00 0.00 52.55 55.57 3gud s ASP 698 Cb -0.42 -2.51 -0.03 0.00 1.01 0.00 0.00 42.92 40.96 3gud s ASP 698 CO 0.55 -1.37 0.08 -0.70 0.21 0.00 0.00 175.17 173.95 3gud s GLU 699 N -4.63 3.73 -0.01 8.23 2.12 0.44 -4.76 118.70 123.82 3gud s GLU 699 Ca 0.61 -0.44 -0.03 0.00 0.36 0.00 0.00 54.97 55.47 3gud s GLU 699 Cb -0.15 -3.35 -0.02 0.00 0.26 0.00 0.00 34.13 30.87 3gud s GLU 699 CO 0.47 -0.13 -0.06 0.66 -0.54 0.00 0.00 175.26 175.66 3gud n TYR 700 N 4.78 0.00 -0.13 5.30 4.01 -1.26 0.32 117.16 130.17 3gud n TYR 700 Ca -0.16 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.49 3gud n TYR 700 Cb 0.52 -0.15 -0.01 0.00 -0.31 0.00 0.00 39.34 39.39 3gud n TYR 700 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 3gud h ASP 701 N -0.18 0.58 -0.09 7.72 1.82 -1.95 -3.35 116.42 120.95 3gud h ASP 701 Ca -0.08 -0.21 -0.02 0.00 -0.39 0.00 0.00 57.03 56.34 3gud h ASP 701 Cb 0.76 -0.15 -0.00 0.00 0.68 0.00 0.00 39.33 40.62 3gud h ASP 701 CO -0.05 0.63 -0.02 -1.28 -1.61 0.00 0.00 179.24 176.91 3gud h SER 702 N 0.49 0.17 -0.41 2.28 0.87 -1.98 -3.39 113.55 111.58 3gud h SER 702 Ca 0.13 -0.35 -0.28 0.00 -1.23 0.00 0.00 61.79 60.05 3gud h SER 702 Cb 0.26 -0.05 -0.38 0.00 -0.44 0.00 0.00 62.40 61.79 3gud h SER 702 CO -0.00 0.49 -1.00 -0.62 -0.53 0.00 0.00 176.83 175.16 3gud n GLU 703 N -4.79 1.86 -2.51 2.24 1.02 -1.26 -4.94 120.64 112.26 3gud n GLU 703 Ca -0.06 -3.40 -0.07 0.00 -0.02 0.00 0.00 57.16 53.61 3gud n GLU 703 Cb 0.22 -1.50 0.03 0.00 -0.02 0.00 0.00 31.44 30.17 3gud n GLU 703 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gud n GLY 704 N -0.48 0.12 2.67 0.62 0.00 -1.26 -5.04 105.19 101.82 3gud n GLY 704 Ca 0.16 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.68 3gud n GLY 704 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gud s ASN 705 N -3.48 3.46 -0.49 1.61 2.20 -1.26 -5.08 114.94 111.91 3gud s ASN 705 Ca 0.02 -2.74 -0.32 0.00 -0.94 0.00 0.00 52.86 48.88 3gud s ASN 705 Cb -0.00 -0.97 -0.12 0.00 -2.00 0.00 0.00 41.25 38.16 3gud s ASN 705 CO 0.29 -0.24 2.34 -0.11 -2.94 0.00 0.00 177.10 176.43 3gud n LEU 706 N 3.37 1.92 0.01 3.54 0.00 -1.26 -4.15 117.00 120.43 3gud n LEU 706 Ca 0.12 0.13 -0.13 0.00 0.00 0.00 0.00 56.01 56.14 3gud n LEU 706 Cb 0.36 -1.30 -0.09 0.00 0.00 0.00 0.00 43.42 42.39 3gud n LEU 706 CO 0.22 -0.94 0.66 0.58 0.00 0.00 0.00 177.39 177.91 3gud h VAL 707 N 7.40 1.24 -2.05 1.96 2.07 0.49 -3.47 116.25 123.89 3gud h VAL 707 Ca -0.23 -0.89 0.03 0.00 0.82 0.00 0.00 66.70 66.43 3gud h VAL 707 Cb 1.30 1.83 -0.19 0.00 -1.52 0.00 0.00 31.29 32.71 3gud h VAL 707 CO 1.11 0.22 0.38 -0.70 0.02 0.00 0.00 177.57 178.61 3gud s GLU 708 N -4.62 0.88 0.18 1.57 2.12 -1.08 -4.98 118.70 112.77 3gud s GLU 708 Ca -0.15 -0.00 -0.30 0.00 0.36 0.00 0.00 54.97 54.87 3gud s GLU 708 Cb 0.02 0.41 -0.09 0.00 0.26 0.00 0.00 34.13 34.74 3gud s GLU 708 CO 0.65 -0.32 1.33 -1.59 -0.54 0.00 0.00 175.26 174.80 3gud s LYS 709 N -1.94 4.37 0.00 4.30 -2.85 -1.26 0.17 119.74 122.53 3gud s LYS 709 Ca -0.03 2.07 0.00 0.00 -1.00 0.00 0.00 55.97 57.01 3gud s LYS 709 Cb -0.01 -3.20 0.00 0.00 -2.06 0.00 0.00 37.83 32.56 3gud s LYS 709 CO -0.00 -0.30 0.00 0.41 0.10 0.00 0.00 175.35 175.56 3gud n GLY 710 N 2.60 -2.14 3.40 0.59 0.00 -1.19 -4.83 105.19 103.62 3gud n GLY 710 Ca 0.07 -1.48 -0.20 0.00 0.00 0.00 0.00 46.02 44.41 3gud n GLY 710 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3gud n ARG 711 N -1.19 0.02 -4.11 1.61 0.63 -1.05 -4.82 116.66 107.75 3gud n ARG 711 Ca 0.00 -2.40 -0.09 0.00 -0.92 0.00 0.00 57.85 54.43 3gud n ARG 711 Cb 0.00 -0.56 -0.10 0.00 0.45 0.00 0.00 32.46 32.26 3gud n ARG 711 CO 0.00 0.00 0.00 -2.00 -2.51 0.00 0.00 177.63 173.12 3gud s GLU 712 N -4.74 0.91 0.36 -0.14 2.12 -1.26 -1.34 118.70 114.60 3gud s GLU 712 Ca 0.58 -1.36 -0.25 0.00 0.36 0.00 0.00 54.97 54.30 3gud s GLU 712 Cb -0.03 0.26 -0.13 0.00 0.26 0.00 0.00 34.13 34.48 3gud s GLU 712 CO 0.38 -0.26 0.73 0.00 -0.54 0.00 0.00 175.26 175.57 3gud n ALA 713 N -0.08 -1.09 -3.71 6.30 0.00 -1.26 -4.14 120.51 116.53 3gud n ALA 713 Ca -0.07 0.27 0.07 0.00 0.00 0.00 0.00 53.44 53.71 3gud n ALA 713 Cb 0.63 -1.86 0.02 0.00 0.00 0.00 0.00 19.45 18.24 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 1.58 0.71 3.65 0.00 0.00 -0.23 -4.84 105.19 106.06 3gud n GLY 714 Ca 0.11 -1.09 -0.03 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.95 -0.09 -0.01 1.61 2.20 -1.26 0.17 114.94 114.62 3gud s ASN 715 Ca 0.19 0.16 -0.11 0.00 -0.94 0.00 0.00 52.86 52.15 3gud s ASN 715 Cb -0.02 0.16 0.01 0.00 -2.00 0.00 0.00 41.25 39.40 3gud s ASN 715 CO 0.04 -0.03 0.23 0.27 -2.94 0.00 0.00 177.10 174.67 3gud s ILE 716 N -0.07 0.06 0.91 0.54 -0.00 0.39 -4.93 121.20 118.11 3gud s ILE 716 Ca 0.07 -0.53 -0.14 0.00 -0.00 0.00 0.00 60.65 60.05 3gud s ILE 716 Cb -0.05 -0.52 0.17 0.00 -0.00 0.00 0.00 42.46 42.06 3gud s ILE 716 CO -0.14 -0.29 1.26 -0.31 -0.00 0.00 0.00 174.94 175.46 3gud s TYR 717 N -1.24 1.92 -0.26 1.37 1.51 -1.26 -0.92 117.35 118.48 3gud s TYR 717 Ca -0.13 0.38 -0.26 0.00 -1.01 0.00 0.00 57.07 56.05 3gud s TYR 717 Cb -0.06 -3.90 0.10 0.00 -0.11 0.00 0.00 41.96 37.99 3gud s TYR 717 CO 0.03 -2.38 0.90 -1.12 -1.11 0.00 0.00 175.55 171.88 3gud s SER 718 N -4.81 -0.56 0.31 2.29 0.01 0.13 -4.87 113.70 106.21 3gud s SER 718 Ca 0.71 1.03 0.09 0.00 1.31 0.00 0.00 55.95 59.08 3gud s SER 718 Cb -0.06 1.02 -0.04 0.00 0.21 0.00 0.00 66.02 67.16 3gud s SER 718 CO 0.51 -0.22 0.09 0.27 0.41 0.00 0.00 173.24 174.30 3gud s ILE 719 N 0.11 3.29 -0.38 1.44 -4.36 -1.26 0.19 121.20 120.23 3gud s ILE 719 Ca 0.01 -1.76 -0.01 0.00 -0.26 0.00 0.00 60.65 58.63 3gud s ILE 719 Cb -0.04 -2.96 0.10 0.00 1.25 0.00 0.00 42.46 40.81 3gud s ILE 719 CO -0.02 -0.27 0.14 -0.13 0.24 0.00 0.00 174.94 174.90 3gud s ARG 720 N -3.78 1.94 0.25 0.37 1.81 -0.65 -4.84 118.95 114.05 3gud s ARG 720 Ca 0.35 -1.76 -0.05 0.00 -1.72 0.00 0.00 55.73 52.54 3gud s ARG 720 Cb -0.04 -3.45 0.28 0.00 -0.45 0.00 0.00 34.95 31.28 3gud s ARG 720 CO 0.22 -0.99 1.84 -1.35 -0.68 0.00 0.00 175.30 174.34 3gud h PRO 721 N 7.95 1.11 -0.17 3.54 0.11 -1.94 0.27 132.00 142.87 3gud h PRO 721 Ca -0.12 -0.16 -0.12 0.00 0.11 0.00 0.00 66.00 65.70 3gud h PRO 721 Cb 1.04 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.94 3gud h PRO 721 CO 0.64 0.86 -0.42 1.15 -0.21 0.00 0.00 178.00 180.02 3gud h THR 722 N 1.10 1.31 -0.07 -1.15 2.02 -1.98 0.17 112.91 114.31 3gud h THR 722 Ca 0.27 -1.58 -0.07 0.00 0.77 0.00 0.00 66.41 65.80 3gud h THR 722 Cb 0.13 1.64 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 3gud h THR 722 CO -0.03 0.49 -0.21 -0.08 0.37 0.00 0.00 175.52 176.05 3gud h GLU 723 N 0.34 0.27 -0.79 6.66 4.57 -1.78 -2.85 114.58 120.99 3gud h GLU 723 Ca 0.03 -0.19 0.02 0.00 -1.18 0.00 0.00 59.36 58.03 3gud h GLU 723 Cb 0.88 0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 29.46 3gud h GLU 723 CO 0.07 0.82 0.52 0.00 -1.18 0.00 0.00 179.01 179.24 3gud h GLN 725 N 1.03 0.63 -0.29 0.00 4.20 -0.65 -1.90 115.11 118.13 3gud h GLN 725 Ca 0.30 -0.23 -0.07 0.00 0.06 0.00 0.00 58.65 58.71 3gud h GLN 725 Cb -0.05 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3gud h GLN 725 CO -0.09 0.80 -0.12 -1.49 -0.67 0.00 0.00 178.83 177.25 3gud h TRP 726 N 0.56 0.53 0.00 2.96 4.06 -1.45 -1.10 115.95 121.51 3gud h TRP 726 Ca 0.09 -0.08 -0.07 0.00 2.06 0.00 0.00 58.89 60.89 3gud h TRP 726 Cb 0.66 -0.14 -0.01 0.00 -1.00 0.00 0.00 29.16 28.67 3gud h TRP 726 CO 0.03 0.60 -0.33 1.25 -3.56 0.00 0.00 178.44 176.42 3gud h LEU 727 N 0.45 0.00 -0.22 -4.49 5.85 -1.23 -0.36 115.31 115.32 3gud h LEU 727 Ca 0.08 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.64 3gud h LEU 727 Cb 0.49 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 3gud h LEU 727 CO 0.03 0.33 -0.76 -0.08 -0.34 0.00 0.00 178.44 177.62 3gud h GLU 728 N 0.00 0.00 -0.11 1.25 4.57 -1.04 -1.68 114.58 117.58 3gud h GLU 728 Ca -0.00 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.02 3gud h GLU 728 Cb 0.91 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.49 3gud h GLU 728 CO 0.04 0.76 -0.61 0.52 -1.18 0.00 0.00 179.01 178.54 3gud h MET 729 N 0.00 0.37 -0.14 1.92 2.86 -0.64 -1.98 114.93 117.33 3gud h MET 729 Ca -0.01 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.35 3gud h MET 729 Cb 1.49 0.04 -0.00 0.00 0.06 0.00 0.00 31.60 33.18 3gud h MET 729 CO 0.10 0.87 -0.00 0.00 1.06 0.00 0.00 176.91 178.94 3gud h ALA 730 N 1.07 0.18 -0.26 6.32 0.00 -0.99 -1.00 119.26 124.58 3gud h ALA 730 Ca -0.01 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.74 3gud h ALA 730 Cb 1.15 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.85 3gud h ALA 730 CO 0.10 -0.12 0.07 0.00 0.00 0.00 0.00 179.25 179.31 3gud h MET 732 N 0.18 -0.07 -0.77 0.00 2.86 -1.35 0.11 114.93 115.90 3gud h MET 732 Ca 0.12 0.00 0.18 0.00 -2.06 0.00 0.00 59.70 57.94 3gud h MET 732 Cb 0.10 0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 3gud h MET 732 CO -0.13 0.01 0.52 -0.09 1.06 0.00 0.00 176.91 178.28 3gud h ARG 733 N -0.13 0.25 0.05 1.72 2.43 -0.97 0.70 114.38 118.42 3gud h ARG 733 Ca -0.01 -0.01 -0.28 0.00 -0.81 0.00 0.00 59.98 58.87 3gud h ARG 733 Cb 0.11 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.58 3gud h ARG 733 CO 0.01 0.16 -1.45 -0.09 -1.51 0.00 0.00 179.97 177.09 3gud h ARG 734 N 0.25 0.10 -0.22 0.20 2.43 -0.67 -3.03 114.38 113.44 3gud h ARG 734 Ca 0.38 -0.16 -0.15 0.00 -0.81 0.00 0.00 59.98 59.24 3gud h ARG 734 Cb 1.11 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 3gud h ARG 734 CO -0.09 0.88 -0.44 0.87 -1.51 0.00 0.00 179.97 179.68 3gud h LYS 735 N 0.03 0.68 -0.95 0.20 1.57 -0.02 -3.26 116.57 114.82 3gud h LYS 735 Ca -0.20 -0.44 0.11 0.00 -1.87 0.00 0.00 60.65 58.25 3gud h LYS 735 Cb 1.95 0.06 -0.07 0.00 0.08 0.00 0.00 32.23 34.24 3gud h LYS 735 CO 0.12 1.06 0.61 1.25 -0.57 0.00 0.00 179.45 181.92 3gud h LEU 736 N 0.39 0.86 -4.31 2.94 5.85 0.30 -1.50 115.31 119.84 3gud h LEU 736 Ca 0.01 0.03 -0.17 0.00 0.84 0.00 0.00 57.88 58.59 3gud h LEU 736 Cb 1.05 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.89 3gud h LEU 736 CO 0.10 0.48 0.08 -1.84 -0.34 0.00 0.00 178.44 176.92 3gud n GLU 737 N -4.57 1.62 -2.98 1.25 -0.00 -1.14 -3.19 120.64 111.63 3gud n GLU 737 Ca 0.17 -0.84 -0.15 0.00 -0.00 0.00 0.00 57.16 56.34 3gud n GLU 737 Cb 0.34 -1.94 -0.02 0.00 -0.00 0.00 0.00 31.44 29.83 3gud n GLU 737 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.13 180.02 3gud n ARG 738 N 2.72 0.64 0.00 3.44 1.85 -0.56 -5.03 116.66 119.71 3gud n ARG 738 Ca 0.35 -2.46 0.00 0.00 -1.00 0.00 0.00 57.85 54.74 3gud n ARG 738 Cb 0.66 -1.41 0.00 0.00 -1.05 0.00 0.00 32.46 30.66 3gud n ARG 738 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51