#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j48 n GLY 628 N 0.00 0.48 3.75 0.00 0.00 -1.26 -5.04 105.19 103.13 2j48 n GLY 628 Ca 0.00 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.71 2j48 n GLY 628 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2j48 s HIS 629 N -2.00 3.63 -0.08 1.61 0.09 -1.26 -4.63 115.29 112.64 2j48 s HIS 629 Ca 0.00 1.11 0.02 0.00 -0.00 0.00 0.00 55.06 56.19 2j48 s HIS 629 Cb 0.00 -2.59 -0.02 0.00 -0.00 0.00 0.00 32.58 29.97 2j48 s HIS 629 CO 0.00 0.30 -0.14 0.42 -0.00 0.00 0.00 174.74 175.32 2j48 s ILE 630 N 0.06 3.08 -0.09 0.60 1.01 -1.05 -3.01 121.20 121.81 2j48 s ILE 630 Ca 0.30 -0.69 -0.00 0.00 0.00 0.00 0.00 60.65 60.26 2j48 s ILE 630 Cb -0.17 -2.24 -0.03 0.00 0.01 0.00 0.00 42.46 40.03 2j48 s ILE 630 CO 0.15 0.56 -0.07 -0.76 0.00 0.00 0.00 174.94 174.83 2j48 s LEU 631 N -0.28 3.14 -0.10 2.97 2.01 -1.08 -2.25 118.68 123.09 2j48 s LEU 631 Ca 0.02 -0.07 0.02 0.00 0.01 0.00 0.00 54.13 54.11 2j48 s LEU 631 Cb -0.13 -1.70 0.02 0.00 0.01 0.00 0.00 46.19 44.39 2j48 s LEU 631 CO 0.03 0.31 -0.14 -0.22 1.01 0.00 0.00 176.35 177.34 2j48 s LEU 632 N -0.49 1.64 -0.27 1.79 2.96 0.31 -0.12 118.68 124.50 2j48 s LEU 632 Ca 0.07 -0.38 -0.05 0.00 -0.22 0.00 0.00 54.13 53.55 2j48 s LEU 632 Cb -0.12 -1.00 0.01 0.00 0.50 0.00 0.00 46.19 45.58 2j48 s LEU 632 CO 0.02 0.00 0.02 -0.22 -1.32 0.00 0.00 176.35 174.86 2j48 s LEU 633 N 1.00 3.54 0.17 -0.68 2.96 -0.55 -0.01 118.68 125.11 2j48 s LEU 633 Ca -0.07 -0.72 -0.22 0.00 -0.22 0.00 0.00 54.13 52.90 2j48 s LEU 633 Cb -0.15 -1.80 0.06 0.00 0.50 0.00 0.00 46.19 44.80 2j48 s LEU 633 CO -0.01 -0.15 0.60 -0.70 -1.32 0.00 0.00 176.35 174.77 2j48 s GLU 634 N 1.44 1.33 0.25 1.98 2.12 -1.03 -2.05 118.70 122.74 2j48 s GLU 634 Ca 0.02 -0.55 0.09 0.00 0.36 0.00 0.00 54.97 54.90 2j48 s GLU 634 Cb -0.17 0.58 -0.04 0.00 0.26 0.00 0.00 34.13 34.77 2j48 s GLU 634 CO -0.00 -0.58 -0.02 -1.21 -0.54 0.00 0.00 175.26 172.91 2j48 s GLU 635 N -3.77 2.28 0.06 4.30 2.02 -1.26 -4.50 118.70 117.82 2j48 s GLU 635 Ca 0.02 -1.37 0.00 0.00 0.02 0.00 0.00 54.97 53.64 2j48 s GLU 635 Cb -0.01 -2.18 0.00 0.00 0.10 0.00 0.00 34.13 32.04 2j48 s GLU 635 CO -0.11 0.38 0.00 -1.91 0.02 0.00 0.00 175.26 173.65 2j48 n GLU 636 N -0.71 -1.68 -0.21 1.61 2.13 -1.26 -3.78 120.64 116.74 2j48 n GLU 636 Ca -0.07 1.54 0.06 0.00 0.66 0.00 0.00 57.16 59.35 2j48 n GLU 636 Cb 0.58 -1.33 0.33 0.00 0.27 0.00 0.00 31.44 31.29 2j48 n GLU 636 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 2j48 h ASP 637 N 1.30 0.71 -0.49 4.31 3.32 -1.96 0.72 116.42 124.33 2j48 h ASP 637 Ca 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 2j48 h ASP 637 Cb 0.00 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2j48 h ASP 637 CO 0.00 0.46 0.17 -0.08 -1.72 0.00 0.00 179.24 178.07 2j48 h GLU 638 N 0.80 0.76 0.05 3.56 4.81 -1.98 0.99 114.58 123.57 2j48 h GLU 638 Ca 0.33 -0.15 -0.14 0.00 -0.13 0.00 0.00 59.36 59.27 2j48 h GLU 638 Cb 0.25 -0.11 0.01 0.00 0.63 0.00 0.00 28.75 29.53 2j48 h GLU 638 CO -0.11 0.70 -0.56 0.00 -0.73 0.00 0.00 179.01 178.31 2j48 h ALA 639 N 1.03 0.01 -0.45 2.92 0.00 -1.58 -2.58 119.26 118.60 2j48 h ALA 639 Ca 0.16 -0.58 -0.06 0.00 0.00 0.00 0.00 54.91 54.43 2j48 h ALA 639 Cb 0.24 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2j48 h ALA 639 CO -0.01 0.28 0.05 0.00 0.00 0.00 0.00 179.25 179.57 2j48 h ALA 640 N 0.21 0.60 -0.54 0.00 0.00 0.46 -2.80 119.26 117.20 2j48 h ALA 640 Ca -0.08 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 2j48 h ALA 640 Cb 1.34 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2j48 h ALA 640 CO 0.11 0.35 0.18 1.15 0.00 0.00 0.00 179.25 181.03 2j48 h THR 641 N 0.62 1.23 0.04 0.00 2.02 0.92 -1.65 112.91 116.09 2j48 h THR 641 Ca 0.13 -0.77 0.02 0.00 0.77 0.00 0.00 66.41 66.57 2j48 h THR 641 Cb 0.42 0.71 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2j48 h THR 641 CO 0.01 0.29 -0.20 0.58 0.37 0.00 0.00 175.52 176.57 2j48 h VAL 642 N 0.75 0.52 -0.75 3.16 2.07 -1.36 0.35 116.25 121.00 2j48 h VAL 642 Ca 0.18 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.70 2j48 h VAL 642 Cb 0.26 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 2j48 h VAL 642 CO -0.01 0.00 0.50 0.58 0.02 0.00 0.00 177.57 178.66 2j48 h VAL 643 N -0.35 1.19 -0.78 2.57 2.07 -1.44 -1.81 116.25 117.70 2j48 h VAL 643 Ca 0.05 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 2j48 h VAL 643 Cb 0.41 0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 2j48 h VAL 643 CO -0.16 0.19 0.47 0.00 0.02 0.00 0.00 177.57 178.08 2j48 h GLU 645 N 1.07 1.06 0.11 0.00 4.81 0.28 0.96 114.58 122.86 2j48 h GLU 645 Ca 0.28 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.36 2j48 h GLU 645 Cb -0.03 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.15 2j48 h GLU 645 CO -0.05 0.81 -0.05 1.98 -0.73 0.00 0.00 179.01 180.96 2j48 h MET 646 N 1.05 -0.14 -0.36 1.92 4.05 -0.74 -0.98 114.93 119.73 2j48 h MET 646 Ca 0.26 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.65 2j48 h MET 646 Cb 0.09 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 2j48 h MET 646 CO -0.03 0.31 0.08 -0.07 0.23 0.00 0.00 176.91 177.42 2j48 h LEU 647 N -0.65 0.56 -0.92 3.39 3.38 -0.91 -2.26 115.31 117.89 2j48 h LEU 647 Ca -0.01 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.79 2j48 h LEU 647 Cb 0.51 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.04 2j48 h LEU 647 CO 0.02 0.65 0.58 0.74 0.09 0.00 0.00 178.44 180.52 2j48 h THR 648 N 0.44 1.03 0.00 0.22 2.02 0.90 0.01 112.91 117.52 2j48 h THR 648 Ca 0.11 -0.35 -0.04 0.00 0.77 0.00 0.00 66.41 66.90 2j48 h THR 648 Cb 0.32 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 66.63 2j48 h THR 648 CO 0.00 0.19 -0.19 0.00 0.37 0.00 0.00 175.52 175.89 2j48 h ALA 649 N 1.44 1.63 0.00 6.16 0.00 -0.80 -1.54 119.26 126.16 2j48 h ALA 649 Ca 0.41 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2j48 h ALA 649 Cb 0.23 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.99 2j48 h ALA 649 CO -0.19 0.24 0.00 0.00 0.00 0.00 0.00 179.25 179.30 2j48 n ALA 650 N -2.48 1.57 -0.05 0.00 0.00 -0.01 -4.78 120.51 114.76 2j48 n ALA 650 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2j48 n ALA 650 Cb 0.26 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.58 2j48 n ALA 650 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j48 n GLY 651 N -0.60 0.78 3.89 0.00 0.00 -0.58 -5.05 105.19 103.62 2j48 n GLY 651 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2j48 n GLY 651 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2j48 s PHE 652 N -2.32 3.52 -0.12 1.61 0.08 -1.23 -5.05 117.98 114.46 2j48 s PHE 652 Ca 0.00 0.62 -0.18 0.00 0.12 0.00 0.00 56.93 57.49 2j48 s PHE 652 Cb 0.00 -2.04 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 2j48 s PHE 652 CO 0.00 0.48 0.48 0.21 -0.10 0.00 0.00 175.22 176.29 2j48 s LYS 653 N -2.33 4.33 -0.01 0.44 2.20 -1.26 -3.83 119.74 119.28 2j48 s LYS 653 Ca 0.37 0.46 0.05 0.00 -0.36 0.00 0.00 55.97 56.49 2j48 s LYS 653 Cb -0.13 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.74 2j48 s LYS 653 CO 0.22 0.14 -0.16 0.54 -0.36 0.00 0.00 175.35 175.72 2j48 s VAL 654 N 0.69 1.24 -0.13 4.02 0.11 -1.26 -2.52 120.40 122.56 2j48 s VAL 654 Ca 0.26 -0.69 -0.03 0.00 -2.93 0.00 0.00 61.98 58.60 2j48 s VAL 654 Cb -0.15 -1.04 -0.03 0.00 -1.53 0.00 0.00 36.38 33.63 2j48 s VAL 654 CO 0.10 0.34 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.55 2j48 s ILE 655 N -0.39 3.98 -0.17 7.04 1.01 -0.95 -4.95 121.20 126.77 2j48 s ILE 655 Ca 0.06 -0.34 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 2j48 s ILE 655 Cb -0.06 -2.71 -0.04 0.00 0.01 0.00 0.00 42.46 39.66 2j48 s ILE 655 CO -0.01 0.53 0.50 0.86 0.00 0.00 0.00 174.94 176.83 2j48 s TRP 656 N -0.06 3.42 0.03 3.97 -0.00 -1.26 -0.53 118.94 124.51 2j48 s TRP 656 Ca 0.02 0.80 0.05 0.00 -0.00 0.00 0.00 56.10 56.97 2j48 s TRP 656 Cb -0.13 -2.63 -0.03 0.00 -0.00 0.00 0.00 33.47 30.68 2j48 s TRP 656 CO 0.02 -0.02 -0.09 -0.51 -0.00 0.00 0.00 176.95 176.36 2j48 s LEU 657 N 1.31 3.04 0.00 5.86 2.01 0.99 -4.99 118.68 126.91 2j48 s LEU 657 Ca 0.24 -0.25 0.15 0.00 0.01 0.00 0.00 54.13 54.29 2j48 s LEU 657 Cb -0.15 -1.78 0.02 0.00 0.01 0.00 0.00 46.19 44.29 2j48 s LEU 657 CO 0.10 0.25 0.84 1.33 1.01 0.00 0.00 176.35 179.88 2j48 n VAL 658 N 1.37 0.00 -3.70 -1.59 0.24 -1.26 -2.46 118.33 110.92 2j48 n VAL 658 Ca -0.15 -0.37 -0.11 0.00 -2.04 0.00 0.00 64.34 61.67 2j48 n VAL 658 Cb 0.52 1.20 -0.11 0.00 -1.47 0.00 0.00 33.84 33.99 2j48 n VAL 658 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2j48 s ASP 659 N -1.72 -0.50 0.24 -1.34 2.15 -1.26 -4.99 116.67 109.25 2j48 s ASP 659 Ca 0.13 0.88 -0.07 0.00 0.43 0.00 0.00 52.55 53.92 2j48 s ASP 659 Cb 0.12 0.79 0.22 0.00 -0.30 0.00 0.00 42.92 43.76 2j48 s ASP 659 CO 0.35 -0.18 1.90 1.23 -0.17 0.00 0.00 175.17 178.30 2j48 h GLY 660 N 6.74 1.31 1.04 2.66 0.00 -1.93 -1.83 103.07 111.06 2j48 h GLY 660 Ca -0.34 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.46 2j48 h GLY 660 CO 0.28 0.49 0.44 1.48 0.00 0.00 0.00 176.54 179.24 2j48 h SER 661 N 1.25 1.12 -0.50 0.19 4.64 -1.97 -2.06 113.55 116.23 2j48 h SER 661 Ca 0.34 -0.12 -0.06 0.00 -0.47 0.00 0.00 61.79 61.47 2j48 h SER 661 Cb -0.12 -0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 61.66 2j48 h SER 661 CO -0.07 0.93 0.09 0.74 -0.87 0.00 0.00 176.83 177.65 2j48 h THR 662 N 1.24 1.24 -0.79 2.95 2.02 -1.83 -2.49 112.91 115.25 2j48 h THR 662 Ca 0.30 -0.92 -0.02 0.00 0.77 0.00 0.00 66.41 66.54 2j48 h THR 662 Cb 0.08 0.71 -0.04 0.00 -1.74 0.00 0.00 68.15 67.17 2j48 h THR 662 CO -0.04 0.34 0.41 0.00 0.37 0.00 0.00 175.52 176.59 2j48 h ALA 663 N 1.26 1.01 -0.85 6.16 0.00 -0.71 -2.23 119.26 123.90 2j48 h ALA 663 Ca 0.18 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.97 2j48 h ALA 663 Cb 0.37 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 2j48 h ALA 663 CO 0.01 0.55 0.56 -0.07 0.00 0.00 0.00 179.25 180.29 2j48 h LEU 664 N 1.10 0.95 -0.56 0.00 3.38 -0.96 3.55 115.31 122.78 2j48 h LEU 664 Ca 0.27 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2j48 h LEU 664 Cb 0.07 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2j48 h LEU 664 CO -0.04 0.67 0.22 -0.78 0.09 0.00 0.00 178.44 178.60 2j48 h ASP 665 N 1.12 0.77 0.00 -0.43 1.82 -1.15 -2.42 116.42 116.13 2j48 h ASP 665 Ca 0.32 -0.17 -0.18 0.00 -0.39 0.00 0.00 57.03 56.61 2j48 h ASP 665 Cb -0.07 -0.20 -0.03 0.00 0.68 0.00 0.00 39.33 39.71 2j48 h ASP 665 CO -0.09 0.73 -1.10 1.56 -1.61 0.00 0.00 179.24 178.74 2j48 h GLN 666 N 0.77 0.00 -1.11 0.28 4.20 -0.99 -3.38 115.11 114.87 2j48 h GLN 666 Ca 0.19 0.00 0.31 0.00 0.06 0.00 0.00 58.65 59.20 2j48 h GLN 666 Cb 0.20 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 27.91 2j48 h GLN 666 CO -0.01 0.79 0.75 1.25 -0.67 0.00 0.00 178.83 180.93 2j48 h LEU 667 N -1.00 0.26 -1.13 1.46 6.46 0.66 0.21 115.31 122.22 2j48 h LEU 667 Ca -0.28 0.05 0.05 0.00 -0.12 0.00 0.00 57.88 57.59 2j48 h LEU 667 Cb 1.13 0.01 -0.06 0.00 -0.73 0.00 0.00 40.66 41.02 2j48 h LEU 667 CO -0.17 0.03 0.59 -2.24 -0.62 0.00 0.00 178.44 176.04 2j48 h ASP 668 N 0.22 0.94 1.53 1.25 2.03 -1.52 -0.33 116.42 120.54 2j48 h ASP 668 Ca 0.59 0.00 -0.09 0.00 -0.73 0.00 0.00 57.03 56.80 2j48 h ASP 668 Cb 1.87 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 40.15 2j48 h ASP 668 CO -0.19 0.62 -0.44 -0.07 -1.03 0.00 0.00 179.24 178.13 2j48 h LEU 669 N 1.07 0.00 -0.33 0.15 3.38 -0.82 -3.29 115.31 115.47 2j48 h LEU 669 Ca 0.38 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.16 2j48 h LEU 669 Cb 0.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.88 2j48 h LEU 669 CO -0.13 0.44 -0.61 -0.07 0.09 0.00 0.00 178.44 178.15 2j48 h LEU 670 N 0.00 0.85 -3.26 1.67 3.38 -0.56 -3.48 115.31 113.91 2j48 h LEU 670 Ca -0.00 -0.48 -0.40 0.00 0.09 0.00 0.00 57.88 57.08 2j48 h LEU 670 Cb 1.33 -0.25 0.06 0.00 0.09 0.00 0.00 40.66 41.89 2j48 h LEU 670 CO 0.06 1.26 -0.86 0.00 0.09 0.00 0.00 178.44 178.99 2j48 n GLN 671 N -3.97 -1.19 -1.88 1.13 1.13 -0.46 -4.30 117.38 107.84 2j48 n GLN 671 Ca -0.05 0.59 -0.31 0.00 -1.94 0.00 0.00 57.00 55.29 2j48 n GLN 671 Cb 0.66 -3.91 0.01 0.00 0.11 0.00 0.00 30.24 27.11 2j48 n GLN 671 CO 0.00 0.00 0.00 -1.25 -1.44 0.00 0.00 177.06 174.37 2j48 s PRO 672 N -5.59 3.56 0.02 -1.09 0.04 -1.26 -4.06 135.00 126.61 2j48 s PRO 672 Ca 0.35 0.78 0.20 0.00 0.04 0.00 0.00 61.00 62.38 2j48 s PRO 672 Cb -0.13 -2.08 -0.19 0.00 0.04 0.00 0.00 34.50 32.14 2j48 s PRO 672 CO 0.86 -0.60 0.64 -0.89 0.04 0.00 0.00 177.00 177.05 2j48 n ILE 673 N -2.71 0.71 -3.89 0.56 5.41 -1.16 -4.77 119.36 113.51 2j48 n ILE 673 Ca 0.06 -0.62 -0.15 0.00 1.00 0.00 0.00 62.75 63.04 2j48 n ILE 673 Cb 0.54 -0.37 -0.15 0.00 -0.71 0.00 0.00 39.64 38.95 2j48 n ILE 673 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2j48 s VAL 674 N -3.15 0.09 -0.12 1.39 1.01 -1.25 -0.97 120.40 117.40 2j48 s VAL 674 Ca -0.05 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2j48 s VAL 674 Cb 0.10 -0.16 0.02 0.00 0.00 0.00 0.00 36.38 36.35 2j48 s VAL 674 CO 0.84 0.09 -0.10 -0.63 0.00 0.00 0.00 175.10 175.30 2j48 s ILE 675 N 0.66 1.17 -0.18 2.22 1.01 0.12 -2.64 121.20 123.56 2j48 s ILE 675 Ca -0.06 -0.39 -0.06 0.00 0.00 0.00 0.00 60.65 60.13 2j48 s ILE 675 Cb -0.09 -1.15 -0.04 0.00 0.01 0.00 0.00 42.46 41.20 2j48 s ILE 675 CO -0.01 0.39 0.04 -0.76 0.00 0.00 0.00 174.94 174.59 2j48 s LEU 676 N 1.53 3.64 -0.02 2.97 1.02 0.83 -1.20 118.68 127.45 2j48 s LEU 676 Ca 0.03 -0.00 -0.03 0.00 0.02 0.00 0.00 54.13 54.15 2j48 s LEU 676 Cb -0.13 -1.91 0.00 0.00 0.02 0.00 0.00 46.19 44.17 2j48 s LEU 676 CO -0.07 0.15 0.06 -0.04 0.02 0.00 0.00 176.35 176.47 2j48 s MET 677 N 0.49 0.17 0.65 1.70 -1.94 -0.41 -1.49 119.30 118.48 2j48 s MET 677 Ca 0.01 -0.07 -0.17 0.00 -1.71 0.00 0.00 55.69 53.75 2j48 s MET 677 Cb -0.13 0.07 -0.00 0.00 2.01 0.00 0.00 34.83 36.78 2j48 s MET 677 CO 0.01 -0.03 1.18 0.00 -0.01 0.00 0.00 175.02 176.17 2j48 s ALA 678 N -0.37 2.40 -0.07 3.03 0.00 -0.87 -2.44 121.76 123.44 2j48 s ALA 678 Ca -0.04 0.84 0.14 0.00 0.00 0.00 0.00 51.96 52.90 2j48 s ALA 678 Cb -0.03 -3.42 -0.21 0.00 0.00 0.00 0.00 23.12 19.46 2j48 s ALA 678 CO 0.00 -1.39 0.23 1.87 0.00 0.00 0.00 175.76 176.46 2j48 n TRP 679 N -2.14 0.00 -1.21 0.00 -0.00 -0.34 -4.56 117.44 109.19 2j48 n TRP 679 Ca 0.13 0.00 -0.21 0.00 -0.00 0.00 0.00 57.50 57.41 2j48 n TRP 679 Cb 0.50 -0.48 0.20 0.00 -0.00 0.00 0.00 31.31 31.53 2j48 n TRP 679 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2j48 n PRO 680 N -2.22 2.43 -2.64 5.87 -0.04 -1.26 -4.95 135.00 132.19 2j48 n PRO 680 Ca -0.10 -3.03 -0.38 0.00 -0.04 0.00 0.00 63.50 59.95 2j48 n PRO 680 Cb 0.61 -2.18 -0.05 0.00 -0.04 0.00 0.00 33.50 31.84 2j48 n PRO 680 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2j48 s PRO 681 N -3.26 4.46 0.58 0.54 0.04 -1.26 -4.94 135.00 131.15 2j48 s PRO 681 Ca 0.57 1.49 0.36 0.00 0.04 0.00 0.00 61.00 63.45 2j48 s PRO 681 Cb 0.47 -2.81 1.65 0.00 0.04 0.00 0.00 34.50 33.86 2j48 s PRO 681 CO 0.11 0.13 2.09 -1.00 0.04 0.00 0.00 177.00 178.37 2j48 h PRO 682 N 3.11 0.00 -5.72 0.56 0.13 -2.00 -3.41 132.00 124.66 2j48 h PRO 682 Ca -0.47 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.05 2j48 h PRO 682 Cb 1.20 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.23 2j48 h PRO 682 CO 0.65 0.02 0.35 -0.51 -0.23 0.00 0.00 178.00 178.28 2j48 s ASP 683 N -5.62 6.64 0.00 1.44 1.01 -1.26 -4.89 116.67 113.99 2j48 s ASP 683 Ca -0.01 0.64 0.09 0.00 0.71 0.00 0.00 52.55 53.98 2j48 s ASP 683 Cb 0.11 -2.39 0.51 0.00 1.01 0.00 0.00 42.92 42.15 2j48 s ASP 683 CO 0.52 -0.58 1.03 0.00 0.21 0.00 0.00 175.17 176.34 2j48 n GLN 684 N 6.13 0.24 -0.03 8.23 6.02 -1.26 -2.87 117.38 133.84 2j48 n GLN 684 Ca 0.03 0.05 0.04 0.00 -0.01 0.00 0.00 57.00 57.11 2j48 n GLN 684 Cb 0.48 -1.50 0.41 0.00 1.02 0.00 0.00 30.24 30.65 2j48 n GLN 684 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 2j48 h SER 685 N 0.00 0.51 -0.82 1.08 0.87 -1.94 -1.70 113.55 111.55 2j48 h SER 685 Ca 0.00 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.56 2j48 h SER 685 Cb 0.02 -0.13 -0.04 0.00 -0.44 0.00 0.00 62.40 61.81 2j48 h SER 685 CO 0.00 0.37 0.54 0.00 -0.53 0.00 0.00 176.83 177.21 2j48 h LEU 687 N 1.11 0.29 -0.70 0.00 3.38 -1.57 -2.21 115.31 115.61 2j48 h LEU 687 Ca 0.30 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 58.08 2j48 h LEU 687 Cb -0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 2j48 h LEU 687 CO -0.07 0.49 -0.23 -0.07 0.09 0.00 0.00 178.44 178.65 2j48 h LEU 688 N 0.28 0.77 -0.53 1.67 3.38 -0.60 -1.84 115.31 118.45 2j48 h LEU 688 Ca 0.05 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 57.78 2j48 h LEU 688 Cb 0.47 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2j48 h LEU 688 CO 0.03 0.98 0.29 0.25 0.09 0.00 0.00 178.44 180.08 2j48 h LEU 689 N 0.66 0.45 -0.91 1.67 6.46 -0.46 0.23 115.31 123.41 2j48 h LEU 689 Ca 0.09 0.02 -0.03 0.00 -0.12 0.00 0.00 57.88 57.84 2j48 h LEU 689 Cb 0.74 -0.07 -0.04 0.00 -0.73 0.00 0.00 40.66 40.55 2j48 h LEU 689 CO 0.06 0.31 0.43 -0.07 -0.62 0.00 0.00 178.44 178.55 2j48 h LEU 690 N 0.57 1.10 -0.32 2.25 -0.00 -1.26 -2.43 115.31 115.22 2j48 h LEU 690 Ca 0.22 -0.12 -0.02 0.00 -0.00 0.00 0.00 57.88 57.97 2j48 h LEU 690 Cb 0.08 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 40.45 2j48 h LEU 690 CO -0.13 0.91 0.14 -0.61 -0.00 0.00 0.00 178.44 178.75 2j48 h GLN 691 N 1.21 0.48 0.20 1.13 4.15 -0.33 -0.76 115.11 121.18 2j48 h GLN 691 Ca 0.30 -0.08 0.01 0.00 0.77 0.00 0.00 58.65 59.65 2j48 h GLN 691 Cb 0.08 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 2j48 h GLN 691 CO -0.04 0.47 -0.28 1.25 -1.93 0.00 0.00 178.83 178.29 2j48 h HIS 692 N 0.38 -0.76 -0.94 3.99 2.76 -0.30 0.12 115.15 120.40 2j48 h HIS 692 Ca 0.11 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.39 2j48 h HIS 692 Cb 0.16 0.31 -0.07 0.00 1.55 0.00 0.00 27.41 29.36 2j48 h HIS 692 CO -0.01 -0.40 0.60 -0.07 -1.30 0.00 0.00 177.93 176.76 2j48 h LEU 693 N -0.55 0.87 -1.22 0.26 3.38 -1.39 -0.16 115.31 116.49 2j48 h LEU 693 Ca 0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2j48 h LEU 693 Cb 0.54 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2j48 h LEU 693 CO -0.11 0.50 0.17 -0.09 0.09 0.00 0.00 178.44 179.00 2j48 h ARG 694 N 0.95 0.71 -0.37 1.13 2.43 0.05 2.36 114.38 121.64 2j48 h ARG 694 Ca 0.44 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.42 2j48 h ARG 694 Cb 0.40 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 2j48 h ARG 694 CO -0.20 0.61 -0.09 0.93 -1.51 0.00 0.00 179.97 179.71 2j48 h GLU 695 N 0.70 0.64 -0.44 0.20 5.08 0.11 -3.28 114.58 117.58 2j48 h GLU 695 Ca 0.16 -0.19 -0.30 0.00 -1.00 0.00 0.00 59.36 58.04 2j48 h GLU 695 Cb 0.18 -0.07 -0.39 0.00 0.50 0.00 0.00 28.75 28.98 2j48 h GLU 695 CO -0.01 0.72 -1.00 -2.39 -1.00 0.00 0.00 179.01 175.33 2j48 n HIS 696 N -4.20 1.44 0.26 4.33 1.44 -0.96 -4.86 115.22 112.69 2j48 n HIS 696 Ca 0.01 -1.94 0.12 0.00 -2.01 0.00 0.00 57.72 53.90 2j48 n HIS 696 Cb 0.33 -0.25 0.73 0.00 0.12 0.00 0.00 29.99 30.92 2j48 n HIS 696 CO 0.00 0.00 0.00 -0.56 -2.81 0.00 0.00 176.34 172.97 2j48 h GLN 697 N 2.23 0.00 0.00 -1.40 3.07 0.39 -2.36 115.11 117.05 2j48 h GLN 697 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2j48 h GLN 697 Cb 1.40 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.96 2j48 h GLN 697 CO 0.31 0.09 -0.43 0.00 0.09 0.00 0.00 178.83 178.89 2j48 n ALA 698 N -2.36 2.84 0.05 0.06 0.00 -1.26 -4.22 120.51 115.63 2j48 n ALA 698 Ca -0.02 -0.21 -0.10 0.00 0.00 0.00 0.00 53.44 53.11 2j48 n ALA 698 Cb 0.18 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 18.32 2j48 n ALA 698 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2j48 h ASP 699 N 0.00 -0.19 -0.68 0.00 3.58 -1.80 -3.47 116.42 113.85 2j48 h ASP 699 Ca 0.00 -0.31 0.00 0.00 0.42 0.00 0.00 57.03 57.14 2j48 h ASP 699 Cb 0.69 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.79 2j48 h ASP 699 CO 0.00 0.37 0.00 -0.81 -2.88 0.00 0.00 179.24 175.92 2j48 n PRO 700 N -4.92 2.03 -3.54 0.28 -0.04 -1.25 -5.04 135.00 122.53 2j48 n PRO 700 Ca -0.07 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.98 2j48 n PRO 700 Cb 0.24 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.62 2j48 n PRO 700 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2j48 s HIS 701 N 0.85 3.36 -0.50 0.54 3.76 -1.26 -5.01 115.29 117.03 2j48 s HIS 701 Ca 0.00 -1.59 -0.40 0.00 -0.15 0.00 0.00 55.06 52.92 2j48 s HIS 701 Cb 0.00 -3.26 -0.17 0.00 1.11 0.00 0.00 32.58 30.26 2j48 s HIS 701 CO 0.00 -0.91 2.20 -2.30 -0.85 0.00 0.00 174.74 172.88 2j48 n PRO 702 N 4.97 0.29 -2.10 8.40 -0.02 -1.26 -4.92 135.00 140.36 2j48 n PRO 702 Ca -0.10 0.07 -0.29 0.00 -2.02 0.00 0.00 63.50 61.17 2j48 n PRO 702 Cb 0.42 -1.78 0.03 0.00 -0.02 0.00 0.00 33.50 32.15 2j48 n PRO 702 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2j48 s PRO 703 N 6.32 3.18 0.12 0.52 0.04 -1.26 -5.04 135.00 138.89 2j48 s PRO 703 Ca 1.18 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.32 2j48 s PRO 703 Cb -1.30 -2.15 -0.06 0.00 0.04 0.00 0.00 34.50 31.04 2j48 s PRO 703 CO 0.60 -0.71 1.05 -0.51 0.04 0.00 0.00 177.00 177.47 2j48 s LEU 704 N -5.14 4.46 -0.06 -3.56 1.43 -0.14 -4.90 118.68 110.78 2j48 s LEU 704 Ca 0.55 1.93 0.04 0.00 -1.03 0.00 0.00 54.13 55.61 2j48 s LEU 704 Cb -0.11 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.52 2j48 s LEU 704 CO 0.50 -0.21 -0.17 -0.69 0.23 0.00 0.00 176.35 176.01 2j48 s VAL 705 N 0.17 1.48 -0.08 -1.59 1.01 -1.26 0.15 120.40 120.28 2j48 s VAL 705 Ca 0.50 -0.71 0.03 0.00 0.00 0.00 0.00 61.98 61.80 2j48 s VAL 705 Cb -0.26 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.81 2j48 s VAL 705 CO 0.31 0.43 -0.19 -0.76 0.00 0.00 0.00 175.10 174.89 2j48 s LEU 706 N 0.30 2.41 -0.17 3.92 1.02 -0.34 0.30 118.68 126.12 2j48 s LEU 706 Ca -0.10 -0.39 -0.03 0.00 0.02 0.00 0.00 54.13 53.63 2j48 s LEU 706 Cb -0.14 -1.49 -0.02 0.00 0.02 0.00 0.00 46.19 44.56 2j48 s LEU 706 CO 0.04 0.24 -0.06 -0.36 0.02 0.00 0.00 176.35 176.23 2j48 s PHE 707 N -0.09 2.95 0.04 0.29 0.08 -0.74 -1.28 117.98 119.22 2j48 s PHE 707 Ca -0.04 -0.54 -0.07 0.00 0.12 0.00 0.00 56.93 56.41 2j48 s PHE 707 Cb -0.14 -1.97 -0.05 0.00 -0.57 0.00 0.00 43.02 40.29 2j48 s PHE 707 CO 0.04 -0.21 0.30 -0.51 -0.10 0.00 0.00 175.22 174.75 2j48 s LEU 708 N 0.64 4.35 0.00 -0.37 1.02 -1.02 -1.16 118.68 122.14 2j48 s LEU 708 Ca -0.04 0.60 0.00 0.00 0.02 0.00 0.00 54.13 54.71 2j48 s LEU 708 Cb -0.15 -2.82 0.00 0.00 0.02 0.00 0.00 46.19 43.24 2j48 s LEU 708 CO 0.02 0.21 0.00 0.61 0.02 0.00 0.00 176.35 177.22 2j48 n GLY 709 N 0.92 0.75 3.94 -3.19 0.00 -0.92 -1.20 105.19 105.50 2j48 n GLY 709 Ca -0.09 -1.41 -0.24 0.00 0.00 0.00 0.00 46.02 44.27 2j48 n GLY 709 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2j48 s GLU 710 N 0.00 3.07 0.74 1.61 2.02 -1.26 -3.55 118.70 121.33 2j48 s GLU 710 Ca 0.00 -0.28 -0.11 0.00 0.02 0.00 0.00 54.97 54.60 2j48 s GLU 710 Cb 0.00 -2.46 0.04 0.00 0.10 0.00 0.00 34.13 31.81 2j48 s GLU 710 CO 0.00 -0.39 1.08 -1.25 0.02 0.00 0.00 175.26 174.72 2j48 s PRO 711 N -4.70 2.51 0.78 0.39 0.04 -1.26 -4.85 135.00 127.91 2j48 s PRO 711 Ca 0.50 0.98 -0.13 0.00 0.04 0.00 0.00 61.00 62.39 2j48 s PRO 711 Cb -0.10 -1.94 0.07 0.00 0.04 0.00 0.00 34.50 32.57 2j48 s PRO 711 CO 0.41 -1.41 1.18 -1.25 0.04 0.00 0.00 177.00 175.97 2j48 s PRO 712 N -5.00 1.88 -0.00 0.56 0.04 -1.26 -4.90 135.00 126.31 2j48 s PRO 712 Ca 0.60 1.65 0.04 0.00 0.04 0.00 0.00 61.00 63.33 2j48 s PRO 712 Cb -0.15 -1.81 0.11 0.00 0.04 0.00 0.00 34.50 32.69 2j48 s PRO 712 CO 0.55 -2.01 1.08 0.28 0.04 0.00 0.00 177.00 176.95 2j48 n VAL 713 N -3.16 0.18 -3.63 -0.36 0.31 -1.26 -4.78 118.33 105.63 2j48 n VAL 713 Ca 0.13 -0.17 -0.13 0.00 -0.01 0.00 0.00 64.34 64.15 2j48 n VAL 713 Cb 0.51 0.07 -0.07 0.00 -0.91 0.00 0.00 33.84 33.44 2j48 n VAL 713 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 2j48 s ASP 714 N -0.97 -0.68 0.00 4.52 1.01 -1.26 -5.03 116.67 114.26 2j48 s ASP 714 Ca 0.09 1.29 0.09 0.00 0.71 0.00 0.00 52.55 54.73 2j48 s ASP 714 Cb 0.05 1.30 0.39 0.00 1.01 0.00 0.00 42.92 45.67 2j48 s ASP 714 CO 0.06 -0.24 1.27 -0.81 0.21 0.00 0.00 175.17 175.66 2j48 n PRO 715 N 2.51 0.01 0.00 8.23 -0.04 -1.26 -2.50 135.00 141.96 2j48 n PRO 715 Ca -0.14 0.33 -0.05 0.00 -0.04 0.00 0.00 63.50 63.60 2j48 n PRO 715 Cb 0.55 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.66 2j48 n PRO 715 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2j48 h LEU 716 N 0.00 0.54 -0.32 1.53 5.85 -1.98 -2.17 115.31 118.76 2j48 h LEU 716 Ca 0.00 -0.21 -0.19 0.00 0.84 0.00 0.00 57.88 58.32 2j48 h LEU 716 Cb 0.14 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 2j48 h LEU 716 CO 0.00 0.84 -0.85 -0.07 -0.34 0.00 0.00 178.44 178.01 2j48 h LEU 717 N 0.44 0.17 -0.61 2.25 3.38 -1.91 -2.61 115.31 116.42 2j48 h LEU 717 Ca 0.05 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2j48 h LEU 717 Cb 0.80 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.46 2j48 h LEU 717 CO 0.06 0.94 0.32 0.74 0.09 0.00 0.00 178.44 180.60 2j48 h THR 718 N 0.07 1.20 -0.63 0.22 2.02 -1.57 3.05 112.91 117.27 2j48 h THR 718 Ca -0.03 -0.53 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 2j48 h THR 718 Cb 1.48 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 68.30 2j48 h THR 718 CO 0.12 0.22 0.12 0.00 0.37 0.00 0.00 175.52 176.36 2j48 h ALA 719 N 1.15 0.84 -0.01 6.16 0.00 -1.36 -2.48 119.26 123.55 2j48 h ALA 719 Ca 0.21 -0.26 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 2j48 h ALA 719 Cb 0.06 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2j48 h ALA 719 CO -0.03 0.58 -0.77 1.96 0.00 0.00 0.00 179.25 180.99 2j48 h GLN 720 N 0.95 0.13 -6.89 0.00 4.20 -1.02 -3.44 115.11 109.04 2j48 h GLN 720 Ca 0.19 -0.12 -0.50 0.00 0.06 0.00 0.00 58.65 58.28 2j48 h GLN 720 Cb 0.41 0.03 0.03 0.00 0.30 0.00 0.00 27.48 28.25 2j48 h GLN 720 CO 0.01 0.83 0.49 0.00 -0.67 0.00 0.00 178.83 179.49 2j48 s ALA 721 N -3.36 3.27 -0.19 3.87 0.00 1.01 -4.45 121.76 121.91 2j48 s ALA 721 Ca -0.02 0.91 0.18 0.00 0.00 0.00 0.00 51.96 53.03 2j48 s ALA 721 Cb 0.11 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.90 2j48 s ALA 721 CO 0.80 -0.33 1.18 0.66 0.00 0.00 0.00 175.76 178.07 2j48 h SER 722 N 3.15 0.00 -4.78 0.00 4.64 0.44 -3.46 113.55 113.54 2j48 h SER 722 Ca -0.48 0.00 0.24 0.00 -0.47 0.00 0.00 61.79 61.08 2j48 h SER 722 Cb 1.22 0.00 -0.16 0.00 -0.31 0.00 0.00 62.40 63.16 2j48 h SER 722 CO 0.64 0.37 0.73 0.00 -0.87 0.00 0.00 176.83 177.71 2j48 s ALA 723 N -3.05 -2.03 -0.07 5.18 0.00 -0.94 -4.92 121.76 115.92 2j48 s ALA 723 Ca 0.01 1.14 -0.03 0.00 0.00 0.00 0.00 51.96 53.08 2j48 s ALA 723 Cb 0.08 0.16 0.04 0.00 0.00 0.00 0.00 23.12 23.41 2j48 s ALA 723 CO 0.77 -0.76 0.14 0.42 0.00 0.00 0.00 175.76 176.33 2j48 s ILE 724 N -2.63 -0.16 0.14 0.00 1.01 -1.26 -1.80 121.20 116.50 2j48 s ILE 724 Ca 0.10 0.29 0.04 0.00 0.00 0.00 0.00 60.65 61.08 2j48 s ILE 724 Cb 0.00 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.18 2j48 s ILE 724 CO -0.05 0.12 0.15 -0.76 0.00 0.00 0.00 174.94 174.40 2j48 s LEU 725 N 1.80 3.91 0.00 2.97 1.02 -0.31 -4.98 118.68 123.09 2j48 s LEU 725 Ca -0.02 -0.04 0.00 0.00 0.02 0.00 0.00 54.13 54.09 2j48 s LEU 725 Cb -0.12 -2.53 0.00 0.00 0.02 0.00 0.00 46.19 43.56 2j48 s LEU 725 CO -0.06 0.09 0.30 -1.20 0.02 0.00 0.00 176.35 175.50 2j48 n SER 726 N -0.17 0.00 -3.47 2.29 7.64 -1.23 -2.16 113.62 116.52 2j48 n SER 726 Ca -0.08 -0.73 -0.29 0.00 1.01 0.00 0.00 58.87 58.78 2j48 n SER 726 Cb 0.54 0.00 -0.12 0.00 -1.01 0.00 0.00 64.21 63.62 2j48 n SER 726 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2j48 s LYS 727 N 0.00 0.65 0.41 1.43 2.20 -1.26 -4.98 119.74 118.19 2j48 s LYS 727 Ca 0.00 -1.49 -0.23 0.00 -0.36 0.00 0.00 55.97 53.89 2j48 s LYS 727 Cb 0.00 -1.38 -0.12 0.00 -1.51 0.00 0.00 37.83 34.82 2j48 s LYS 727 CO 0.00 -1.23 0.72 -2.30 -0.36 0.00 0.00 175.35 172.18 2j48 n PRO 728 N 3.83 0.83 0.00 4.03 -0.02 -1.26 -4.81 135.00 137.61 2j48 n PRO 728 Ca 0.14 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 2j48 n PRO 728 Cb 0.38 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 2j48 n PRO 728 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2j48 n LEU 729 N 1.00 0.00 -3.04 2.45 7.94 -1.26 -5.05 117.00 119.04 2j48 n LEU 729 Ca 0.11 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.92 2j48 n LEU 729 Cb 0.39 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.38 2j48 n LEU 729 CO 0.55 0.00 0.13 -0.67 -1.11 0.00 0.00 177.39 176.29 2j48 n ASP 730 N 0.00 -6.62 0.00 1.96 2.03 -1.26 -4.86 116.55 107.80 2j48 n ASP 730 Ca 0.00 -0.44 0.05 0.00 0.52 0.00 0.00 54.79 54.92 2j48 n ASP 730 Cb 0.00 -4.86 0.28 0.00 -0.72 0.00 0.00 41.12 35.83 2j48 n ASP 730 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 2j48 n PRO 731 N -2.60 0.19 0.18 -0.67 -0.04 -1.26 -2.62 135.00 128.18 2j48 n PRO 731 Ca -0.04 0.15 0.02 0.00 -0.04 0.00 0.00 63.50 63.59 2j48 n PRO 731 Cb 0.57 -1.50 0.32 0.00 -0.04 0.00 0.00 33.50 32.85 2j48 n PRO 731 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2j48 h GLN 732 N 0.00 0.00 -0.37 0.54 1.08 -2.00 -2.75 115.11 111.62 2j48 h GLN 732 Ca 0.00 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 2j48 h GLN 732 Cb 0.08 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.50 2j48 h GLN 732 CO 0.00 0.43 0.06 1.25 -0.95 0.00 0.00 178.83 179.62 2j48 h LEU 733 N 0.00 0.58 -0.80 1.46 5.85 -1.87 -0.18 115.31 120.35 2j48 h LEU 733 Ca -0.00 -0.26 0.02 0.00 0.84 0.00 0.00 57.88 58.48 2j48 h LEU 733 Cb 0.79 -0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.63 2j48 h LEU 733 CO 0.06 0.69 0.52 0.25 -0.34 0.00 0.00 178.44 179.61 2j48 h LEU 734 N 0.44 0.89 -0.77 2.25 5.85 -1.73 -1.47 115.31 120.77 2j48 h LEU 734 Ca 0.11 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 2j48 h LEU 734 Cb 0.35 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 2j48 h LEU 734 CO 0.01 0.63 0.37 -0.07 -0.34 0.00 0.00 178.44 179.04 2j48 h LEU 735 N 1.04 1.01 -1.12 2.25 -0.00 -1.19 -2.06 115.31 115.23 2j48 h LEU 735 Ca 0.30 -0.13 0.03 0.00 -0.00 0.00 0.00 57.88 58.08 2j48 h LEU 735 Cb -0.07 -0.26 -0.05 0.00 -0.00 0.00 0.00 40.66 40.29 2j48 h LEU 735 CO -0.08 0.86 0.59 0.74 -0.00 0.00 0.00 178.44 180.55 2j48 h THR 736 N 1.09 1.18 -0.62 0.22 2.02 -0.18 -1.51 112.91 115.11 2j48 h THR 736 Ca 0.27 -0.40 -0.01 0.00 0.77 0.00 0.00 66.41 67.03 2j48 h THR 736 Cb 0.11 -0.08 -0.03 0.00 -1.74 0.00 0.00 68.15 66.41 2j48 h THR 736 CO -0.03 0.21 0.33 0.74 0.37 0.00 0.00 175.52 177.14 2j48 h THR 737 N 1.16 1.20 -0.69 3.16 2.02 -0.61 -1.04 112.91 118.12 2j48 h THR 737 Ca 0.35 -0.53 -0.05 0.00 0.77 0.00 0.00 66.41 66.94 2j48 h THR 737 Cb -0.04 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.75 2j48 h THR 737 CO -0.09 0.23 0.22 0.25 0.37 0.00 0.00 175.52 176.49 2j48 h LEU 738 N 0.85 1.00 -1.88 2.58 5.85 -0.95 -1.59 115.31 121.17 2j48 h LEU 738 Ca 0.22 -0.20 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 2j48 h LEU 738 Cb 0.06 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 40.83 2j48 h LEU 738 CO -0.03 0.93 -0.12 1.56 -0.34 0.00 0.00 178.44 180.44 2j48 h GLN 739 N 1.00 0.00 -0.05 1.25 4.20 -0.90 -2.83 115.11 117.78 2j48 h GLN 739 Ca 0.22 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.95 2j48 h GLN 739 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 2j48 h GLN 739 CO -0.01 0.12 0.72 0.78 -0.67 0.00 0.00 178.83 179.78 2j48 h GLY 740 N 0.87 0.00 1.88 3.46 0.00 -0.15 2.60 103.07 111.73 2j48 h GLY 740 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2j48 h GLY 740 CO 0.02 0.00 -0.06 1.04 0.00 0.00 0.00 176.54 177.53 2j48 n LEU 741 N -2.72 0.15 -3.43 3.11 4.32 -1.07 -4.95 117.00 112.41 2j48 n LEU 741 Ca 0.00 0.45 -0.20 0.00 -0.02 0.00 0.00 56.01 56.24 2j48 n LEU 741 Cb 0.76 -0.45 0.04 0.00 -1.62 0.00 0.00 43.42 42.15 2j48 n LEU 741 CO 0.07 -0.01 0.02 0.00 -1.22 0.00 0.00 177.39 176.26 2j48 s PRO 743 N -4.85 4.05 0.34 0.00 0.04 -1.26 -5.03 135.00 128.30 2j48 s PRO 743 Ca 0.36 1.20 -0.12 0.00 0.04 0.00 0.00 61.00 62.48 2j48 s PRO 743 Cb -0.09 -3.77 -0.08 0.00 0.04 0.00 0.00 34.50 30.60 2j48 s PRO 743 CO 0.80 -0.93 0.72 -1.25 0.04 0.00 0.00 177.00 176.38 2j48 s PRO 744 N 3.75 3.87 0.00 0.56 0.04 -1.26 -5.16 135.00 136.81 2j48 s PRO 744 Ca 0.49 0.51 0.29 0.00 0.04 0.00 0.00 61.00 62.33 2j48 s PRO 744 Cb -0.15 -2.45 1.25 0.00 0.04 0.00 0.00 34.50 33.19 2j48 s PRO 744 CO 0.17 0.11 1.86 0.09 0.04 0.00 0.00 177.00 179.26