#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 0.87 3.76 0.00 0.00 -1.26 -5.01 105.19 103.56 2j48 n GLY 628 Ca 0.00 -0.63 -0.39 0.00 0.00 0.00 0.00 46.02 45.00 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 -3.02 3.70 -0.07 1.61 0.09 -1.26 -4.37 115.29 111.98 2j48 s HIS 629 Ca 0.03 1.24 0.02 0.00 -0.00 0.00 0.00 55.06 56.35 2j48 s HIS 629 Cb -0.01 -2.63 -0.03 0.00 -0.00 0.00 0.00 32.58 29.92 2j48 s HIS 629 CO 0.04 0.36 -0.11 0.42 -0.00 0.00 0.00 174.74 175.45 2j48 s ILE 630 N -0.25 3.31 -0.18 0.60 1.01 -0.76 -3.57 121.20 121.36 2j48 s ILE 630 Ca 0.32 -0.62 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 2j48 s ILE 630 Cb -0.19 -2.33 -0.03 0.00 0.01 0.00 0.00 42.46 39.92 2j48 s ILE 630 CO 0.18 0.58 0.00 -0.22 0.00 0.00 0.00 174.94 175.49 2j48 s LEU 631 N -0.60 3.39 -0.08 2.97 2.96 -1.08 -1.86 118.68 124.38 2j48 s LEU 631 Ca 0.09 -0.11 0.00 0.00 -0.22 0.00 0.00 54.13 53.89 2j48 s LEU 631 Cb -0.11 -1.85 0.02 0.00 0.50 0.00 0.00 46.19 44.75 2j48 s LEU 631 CO 0.01 0.12 -0.06 -0.22 -1.32 0.00 0.00 176.35 174.89 2j48 s LEU 632 N 0.65 1.15 -0.21 -0.68 0.20 -0.87 0.50 118.68 119.42 2j48 s LEU 632 Ca -0.00 -0.22 -0.06 0.00 0.69 0.00 0.00 54.13 54.54 2j48 s LEU 632 Cb -0.14 -0.68 -0.03 0.00 -0.43 0.00 0.00 46.19 44.91 2j48 s LEU 632 CO 0.02 -0.10 0.04 -0.76 -0.29 0.00 0.00 176.35 175.26 2j48 s LEU 633 N 1.45 3.43 0.20 -0.68 1.43 0.14 -2.10 118.68 122.55 2j48 s LEU 633 Ca -0.01 -0.15 -0.22 0.00 -1.03 0.00 0.00 54.13 52.72 2j48 s LEU 633 Cb -0.13 -1.89 0.05 0.00 0.03 0.00 0.00 46.19 44.25 2j48 s LEU 633 CO -0.04 0.05 0.63 -0.70 0.23 0.00 0.00 176.35 176.52 2j48 s GLU 634 N 1.08 1.44 0.25 1.70 2.12 -0.91 -1.12 118.70 123.26 2j48 s GLU 634 Ca 0.03 -0.67 0.07 0.00 0.36 0.00 0.00 54.97 54.76 2j48 s GLU 634 Cb -0.14 0.59 -0.04 0.00 0.26 0.00 0.00 34.13 34.80 2j48 s GLU 634 CO 0.02 -0.64 0.21 -2.00 -0.54 0.00 0.00 175.26 172.31 2j48 s GLU 635 N -3.82 2.96 0.10 4.30 2.12 -1.26 -4.07 118.70 119.04 2j48 s GLU 635 Ca 0.05 -1.03 0.00 0.00 0.36 0.00 0.00 54.97 54.35 2j48 s GLU 635 Cb -0.02 -2.59 0.00 0.00 0.26 0.00 0.00 34.13 31.77 2j48 s GLU 635 CO -0.06 0.41 0.00 -1.91 -0.54 0.00 0.00 175.26 173.16 2j48 n GLU 636 N -1.17 -3.32 -0.01 4.30 2.13 -1.26 -4.15 120.64 117.16 2j48 n GLU 636 Ca -0.08 2.56 0.00 0.00 0.66 0.00 0.00 57.16 60.31 2j48 n GLU 636 Cb 0.58 -2.69 0.31 0.00 0.27 0.00 0.00 31.44 29.91 2j48 n GLU 636 CO 0.00 0.00 0.00 0.38 -0.41 0.00 0.00 177.13 177.10 2j48 h ASP 637 N 2.59 0.51 -0.30 4.31 3.04 -1.98 -0.64 116.42 123.96 2j48 h ASP 637 Ca 0.00 -0.08 -0.04 0.00 -3.24 0.00 0.00 57.03 53.67 2j48 h ASP 637 Cb 0.00 -0.13 -0.01 0.00 -1.04 0.00 0.00 39.33 38.15 2j48 h ASP 637 CO 0.00 0.54 0.01 -0.33 -2.04 0.00 0.00 179.24 177.42 2j48 h GLU 638 N 0.54 0.52 -0.38 4.15 4.39 -1.99 0.33 114.58 122.13 2j48 h GLU 638 Ca 0.12 -0.16 -0.14 0.00 0.34 0.00 0.00 59.36 59.52 2j48 h GLU 638 Cb 0.25 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2j48 h GLU 638 CO 0.00 0.65 -0.31 0.00 -1.16 0.00 0.00 179.01 178.19 2j48 h ALA 639 N 0.85 0.55 -0.34 3.43 0.00 -1.76 -2.70 119.26 119.29 2j48 h ALA 639 Ca 0.09 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 2j48 h ALA 639 Cb 0.41 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2j48 h ALA 639 CO 0.01 0.60 -0.15 0.00 0.00 0.00 0.00 179.25 179.71 2j48 h ALA 640 N 0.78 1.10 -0.29 0.00 0.00 -1.03 -2.79 119.26 117.03 2j48 h ALA 640 Ca 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 2j48 h ALA 640 Cb 0.90 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 2j48 h ALA 640 CO 0.08 0.56 0.14 1.15 0.00 0.00 0.00 179.25 181.18 2j48 h THR 641 N 0.55 1.15 0.01 0.00 2.02 -0.20 0.11 112.91 116.56 2j48 h THR 641 Ca 0.09 -0.43 0.02 0.00 0.77 0.00 0.00 66.41 66.87 2j48 h THR 641 Cb 0.58 0.90 -0.03 0.00 -1.74 0.00 0.00 68.15 67.86 2j48 h THR 641 CO 0.04 0.15 -0.13 0.58 0.37 0.00 0.00 175.52 176.53 2j48 h VAL 642 N 0.34 0.68 -0.19 3.16 2.07 -1.34 1.72 116.25 122.69 2j48 h VAL 642 Ca 0.10 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.62 2j48 h VAL 642 Cb 0.11 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2j48 h VAL 642 CO -0.01 0.00 0.13 0.58 0.02 0.00 0.00 177.57 178.28 2j48 h VAL 643 N -0.22 1.05 -0.03 2.57 2.07 -1.37 -1.84 116.25 118.47 2j48 h VAL 643 Ca 0.04 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.40 2j48 h VAL 643 Cb 0.28 0.76 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2j48 h VAL 643 CO -0.12 0.05 -0.34 0.00 0.02 0.00 0.00 177.57 177.18 2j48 h GLU 645 N 0.05 0.85 -0.34 0.00 4.57 0.33 1.31 114.58 121.35 2j48 h GLU 645 Ca 0.00 -0.09 -0.07 0.00 -1.18 0.00 0.00 59.36 58.02 2j48 h GLU 645 Cb 0.63 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2j48 h GLU 645 CO 0.05 0.63 -0.07 0.52 -1.18 0.00 0.00 179.01 178.96 2j48 h MET 646 N 0.83 0.64 -0.24 1.92 2.86 -1.04 -0.72 114.93 119.18 2j48 h MET 646 Ca 0.22 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 2j48 h MET 646 Cb 0.02 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 2j48 h MET 646 CO -0.04 0.81 -0.02 -0.07 1.06 0.00 0.00 176.91 178.65 2j48 h LEU 647 N 0.43 0.43 -0.77 1.22 3.38 -1.08 -1.95 115.31 116.95 2j48 h LEU 647 Ca 0.09 -0.33 0.07 0.00 0.09 0.00 0.00 57.88 57.80 2j48 h LEU 647 Cb 0.56 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 2j48 h LEU 647 CO 0.03 0.66 0.45 0.74 0.09 0.00 0.00 178.44 180.41 2j48 h THR 648 N 0.19 0.97 0.00 0.22 2.02 0.17 -0.44 112.91 116.04 2j48 h THR 648 Ca 0.06 -0.28 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 2j48 h THR 648 Cb 0.45 0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 2j48 h THR 648 CO 0.02 0.15 -0.22 0.00 0.37 0.00 0.00 175.52 175.84 2j48 h ALA 649 N 1.40 1.21 0.00 6.16 0.00 -0.95 -2.42 119.26 124.66 2j48 h ALA 649 Ca 0.35 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2j48 h ALA 649 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2j48 h ALA 649 CO -0.20 0.27 0.00 0.00 0.00 0.00 0.00 179.25 179.32 2j48 n ALA 650 N -2.30 1.96 -0.16 0.00 0.00 -0.18 -4.82 120.51 115.01 2j48 n ALA 650 Ca -0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2j48 n ALA 650 Cb 0.34 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.51 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 0.15 0.81 3.85 0.00 0.00 -0.91 -5.05 105.19 104.05 2j48 n GLY 651 Ca 0.09 0.00 -0.37 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 -2.48 3.66 -0.18 1.61 0.08 -1.17 -5.05 117.98 114.44 2j48 s PHE 652 Ca 0.00 0.76 -0.16 0.00 0.12 0.00 0.00 56.93 57.65 2j48 s PHE 652 Cb 0.00 -2.13 -0.04 0.00 -0.57 0.00 0.00 43.02 40.28 2j48 s PHE 652 CO 0.00 0.67 0.40 0.21 -0.10 0.00 0.00 175.22 176.40 2j48 s LYS 653 N -0.98 4.22 0.01 0.44 2.20 -1.26 -3.60 119.74 120.78 2j48 s LYS 653 Ca 0.19 0.24 0.04 0.00 -0.36 0.00 0.00 55.97 56.08 2j48 s LYS 653 Cb -0.14 -3.50 -0.02 0.00 -1.51 0.00 0.00 37.83 32.66 2j48 s LYS 653 CO 0.09 0.04 -0.13 0.54 -0.36 0.00 0.00 175.35 175.53 2j48 s VAL 654 N 1.05 1.02 -0.22 4.02 0.11 -1.26 -1.82 120.40 123.30 2j48 s VAL 654 Ca 0.20 -0.76 -0.06 0.00 -2.93 0.00 0.00 61.98 58.44 2j48 s VAL 654 Cb -0.14 -0.89 -0.02 0.00 -1.53 0.00 0.00 36.38 33.79 2j48 s VAL 654 CO 0.08 0.13 0.02 -0.63 -3.33 0.00 0.00 175.10 171.36 2j48 s ILE 655 N -0.58 4.00 -0.31 7.04 -1.09 -0.78 -4.98 121.20 124.49 2j48 s ILE 655 Ca 0.03 -0.29 -0.16 0.00 -2.23 0.00 0.00 60.65 58.00 2j48 s ILE 655 Cb -0.06 -2.83 -0.02 0.00 -1.58 0.00 0.00 42.46 37.97 2j48 s ILE 655 CO 0.00 0.40 0.40 0.86 -1.23 0.00 0.00 174.94 175.38 2j48 s TRP 656 N 1.22 3.22 0.09 3.97 -0.00 -1.26 -2.04 118.94 124.13 2j48 s TRP 656 Ca 0.04 0.20 0.09 0.00 -0.00 0.00 0.00 56.10 56.42 2j48 s TRP 656 Cb -0.15 -2.69 -0.04 0.00 -0.00 0.00 0.00 33.47 30.60 2j48 s TRP 656 CO 0.02 -0.38 -0.23 -0.51 -0.00 0.00 0.00 176.95 175.84 2j48 s LEU 657 N 2.13 2.40 -0.19 5.86 1.43 -0.89 -4.99 118.68 124.43 2j48 s LEU 657 Ca 0.15 -0.61 0.16 0.00 -1.03 0.00 0.00 54.13 52.80 2j48 s LEU 657 Cb -0.16 -1.36 0.56 0.00 0.03 0.00 0.00 46.19 45.26 2j48 s LEU 657 CO 0.11 0.22 1.46 0.55 0.23 0.00 0.00 176.35 178.92 2j48 n VAL 658 N 1.25 2.36 -3.68 -1.59 3.14 -1.26 -2.13 118.33 116.42 2j48 n VAL 658 Ca -0.17 -1.89 -0.11 0.00 -2.96 0.00 0.00 64.34 59.21 2j48 n VAL 658 Cb 0.52 -0.27 -0.12 0.00 -1.06 0.00 0.00 33.84 32.92 2j48 n VAL 658 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2j48 s ASP 659 N -1.87 -0.11 0.25 6.55 2.15 -1.26 -4.99 116.67 117.38 2j48 s ASP 659 Ca 0.44 0.77 -0.06 0.00 0.43 0.00 0.00 52.55 54.12 2j48 s ASP 659 Cb 0.35 0.87 0.25 0.00 -0.30 0.00 0.00 42.92 44.09 2j48 s ASP 659 CO 0.09 -0.22 1.91 1.23 -0.17 0.00 0.00 175.17 178.02 2j48 h GLY 660 N 7.84 1.40 1.14 2.66 0.00 -1.91 -1.99 103.07 112.21 2j48 h GLY 660 Ca -0.23 -0.55 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2j48 h GLY 660 CO 0.20 0.53 0.56 1.48 0.00 0.00 0.00 176.54 179.31 2j48 h SER 661 N 1.35 1.01 -0.25 0.19 4.64 -1.96 -0.99 113.55 117.53 2j48 h SER 661 Ca 0.36 -0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 61.57 2j48 h SER 661 Cb -0.12 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 61.70 2j48 h SER 661 CO -0.07 0.74 -0.06 0.74 -0.87 0.00 0.00 176.83 177.31 2j48 h THR 662 N 1.18 1.23 -0.38 2.95 2.02 -1.81 -2.74 112.91 115.37 2j48 h THR 662 Ca 0.32 -0.98 -0.03 0.00 0.77 0.00 0.00 66.41 66.49 2j48 h THR 662 Cb -0.11 1.02 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2j48 h THR 662 CO -0.07 0.33 0.13 0.00 0.37 0.00 0.00 175.52 176.29 2j48 h ALA 663 N 1.36 0.49 -0.90 6.16 0.00 -0.56 -2.03 119.26 123.78 2j48 h ALA 663 Ca 0.11 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.88 2j48 h ALA 663 Cb 0.46 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 2j48 h ALA 663 CO 0.02 0.12 0.60 -0.07 0.00 0.00 0.00 179.25 179.92 2j48 h LEU 664 N 0.46 1.03 -0.60 0.00 3.38 -1.16 2.90 115.31 121.32 2j48 h LEU 664 Ca 0.12 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 2j48 h LEU 664 Cb 0.23 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2j48 h LEU 664 CO -0.01 0.74 0.25 0.44 0.09 0.00 0.00 178.44 179.95 2j48 h ASP 665 N 1.21 0.81 0.13 -0.43 3.32 -1.25 -2.77 116.42 117.44 2j48 h ASP 665 Ca 0.34 -0.16 -0.30 0.00 0.02 0.00 0.00 57.03 56.93 2j48 h ASP 665 Cb -0.11 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.22 2j48 h ASP 665 CO -0.08 0.75 -1.54 1.56 -1.72 0.00 0.00 179.24 178.21 2j48 h GLN 666 N 0.82 0.28 -0.88 3.56 1.08 -0.91 -3.35 115.11 115.71 2j48 h GLN 666 Ca 0.20 -0.48 0.24 0.00 -1.45 0.00 0.00 58.65 57.16 2j48 h GLN 666 Cb 0.18 0.18 -0.14 0.00 -0.05 0.00 0.00 27.48 27.64 2j48 h GLN 666 CO -0.02 1.23 0.22 1.25 -0.95 0.00 0.00 178.83 180.56 2j48 h LEU 667 N -0.18 -0.03 -1.39 1.46 6.46 0.52 1.04 115.31 123.19 2j48 h LEU 667 Ca -0.32 0.20 -0.02 0.00 -0.12 0.00 0.00 57.88 57.62 2j48 h LEU 667 Cb 1.86 0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 42.05 2j48 h LEU 667 CO 0.09 -0.17 0.15 -0.78 -0.62 0.00 0.00 178.44 177.11 2j48 h ASP 668 N 0.19 0.51 0.06 1.25 3.58 -1.64 0.33 116.42 120.71 2j48 h ASP 668 Ca 0.55 -0.05 -0.13 0.00 0.42 0.00 0.00 57.03 57.82 2j48 h ASP 668 Cb 1.11 -0.13 0.01 0.00 1.72 0.00 0.00 39.33 42.05 2j48 h ASP 668 CO -0.67 0.47 -0.53 -0.07 -2.88 0.00 0.00 179.24 175.56 2j48 h LEU 669 N 0.57 0.36 0.00 2.28 3.38 0.82 -3.33 115.31 119.39 2j48 h LEU 669 Ca 0.14 -0.89 0.00 0.00 0.09 0.00 0.00 57.88 57.22 2j48 h LEU 669 Cb 0.13 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2j48 h LEU 669 CO -0.01 1.22 -0.24 0.00 0.09 0.00 0.00 178.44 179.50 2j48 n LEU 670 N -4.29 0.61 -3.50 1.67 -0.00 0.64 -4.98 117.00 107.15 2j48 n LEU 670 Ca -0.12 0.40 -0.29 0.00 -0.00 0.00 0.00 56.01 56.00 2j48 n LEU 670 Cb 0.68 -0.30 0.02 0.00 -0.00 0.00 0.00 43.42 43.81 2j48 n LEU 670 CO 0.44 -0.08 -0.25 0.00 -0.00 0.00 0.00 177.39 177.50 2j48 n GLN 671 N -2.02 -1.58 -2.63 1.47 6.02 0.12 -4.64 117.38 114.12 2j48 n GLN 671 Ca 0.05 0.97 -0.36 0.00 -0.01 0.00 0.00 57.00 57.65 2j48 n GLN 671 Cb 0.41 -1.92 -0.05 0.00 1.02 0.00 0.00 30.24 29.70 2j48 n GLN 671 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 2j48 s PRO 672 N -3.53 4.25 0.05 -1.09 0.04 -1.26 -4.75 135.00 128.70 2j48 s PRO 672 Ca 0.17 1.41 0.23 0.00 0.04 0.00 0.00 61.00 62.86 2j48 s PRO 672 Cb -0.02 -2.53 0.19 0.00 0.04 0.00 0.00 34.50 32.19 2j48 s PRO 672 CO 0.81 -0.05 1.16 0.44 0.04 0.00 0.00 177.00 179.41 2j48 n ILE 673 N -0.06 0.15 -3.80 0.56 -5.35 -1.23 -4.88 119.36 104.74 2j48 n ILE 673 Ca 0.05 -0.17 -0.13 0.00 -0.27 0.00 0.00 62.75 62.23 2j48 n ILE 673 Cb 0.50 0.22 -0.12 0.00 -1.74 0.00 0.00 39.64 38.50 2j48 n ILE 673 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2j48 s VAL 674 N -3.13 -0.00 -0.12 7.28 0.11 -1.26 -3.81 120.40 119.48 2j48 s VAL 674 Ca 0.06 0.02 0.02 0.00 -2.93 0.00 0.00 61.98 59.15 2j48 s VAL 674 Cb 0.15 -0.26 0.01 0.00 -1.53 0.00 0.00 36.38 34.75 2j48 s VAL 674 CO 0.77 0.01 -0.17 -0.63 -3.33 0.00 0.00 175.10 171.75 2j48 s ILE 675 N 0.20 1.61 -0.12 7.04 1.01 -0.85 -2.63 121.20 127.47 2j48 s ILE 675 Ca -0.01 -0.71 -0.04 0.00 0.00 0.00 0.00 60.65 59.89 2j48 s ILE 675 Cb -0.02 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 2j48 s ILE 675 CO -0.00 0.46 0.03 -0.76 0.00 0.00 0.00 174.94 174.67 2j48 s LEU 676 N 0.97 3.74 -0.08 2.97 1.02 0.18 -1.94 118.68 125.55 2j48 s LEU 676 Ca -0.06 0.16 -0.03 0.00 0.02 0.00 0.00 54.13 54.22 2j48 s LEU 676 Cb -0.15 -1.89 0.04 0.00 0.02 0.00 0.00 46.19 44.21 2j48 s LEU 676 CO -0.02 0.32 0.08 -0.04 0.02 0.00 0.00 176.35 176.71 2j48 s MET 677 N -0.52 -0.03 0.64 1.70 -1.94 0.03 -0.68 119.30 118.49 2j48 s MET 677 Ca 0.10 0.29 -0.16 0.00 -1.71 0.00 0.00 55.69 54.20 2j48 s MET 677 Cb -0.12 -0.80 -0.01 0.00 2.01 0.00 0.00 34.83 35.91 2j48 s MET 677 CO 0.02 -0.41 1.15 0.00 -0.01 0.00 0.00 175.02 175.77 2j48 s ALA 678 N 2.18 2.46 -0.54 3.03 0.00 -0.28 -2.40 121.76 126.21 2j48 s ALA 678 Ca 0.04 0.74 0.05 0.00 0.00 0.00 0.00 51.96 52.80 2j48 s ALA 678 Cb -0.13 -3.38 0.36 0.00 0.00 0.00 0.00 23.12 19.97 2j48 s ALA 678 CO -0.05 -1.27 0.97 1.87 0.00 0.00 0.00 175.76 177.28 2j48 n TRP 679 N -2.12 3.76 -2.39 0.00 -0.00 0.51 -4.78 117.44 112.43 2j48 n TRP 679 Ca 0.12 -3.81 -0.33 0.00 -0.00 0.00 0.00 57.50 53.48 2j48 n TRP 679 Cb 0.51 -0.41 -0.03 0.00 -0.00 0.00 0.00 31.31 31.39 2j48 n TRP 679 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 177.69 176.44 2j48 s PRO 680 N -3.45 3.76 0.12 5.87 0.04 -1.26 -4.13 135.00 135.95 2j48 s PRO 680 Ca 0.48 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.38 2j48 s PRO 680 Cb 0.31 -2.10 -0.08 0.00 0.04 0.00 0.00 34.50 32.67 2j48 s PRO 680 CO -0.15 -0.44 1.58 -1.00 0.04 0.00 0.00 177.00 177.04 2j48 h PRO 681 N 1.07 -0.55 0.00 0.56 0.13 -2.00 -0.25 132.00 130.97 2j48 h PRO 681 Ca -0.48 0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2j48 h PRO 681 Cb 1.20 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2j48 h PRO 681 CO 0.60 -0.36 0.00 -0.35 -0.23 0.00 0.00 178.00 177.65 2j48 n PRO 682 N -5.45 0.00 -2.62 1.56 -0.04 -1.26 -4.66 135.00 122.53 2j48 n PRO 682 Ca -0.06 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.06 2j48 n PRO 682 Cb 0.37 -1.19 -0.05 0.00 -0.04 0.00 0.00 33.50 32.60 2j48 n PRO 682 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2j48 s ASP 683 N -1.47 6.61 0.00 3.54 2.15 -0.11 -4.82 116.67 122.57 2j48 s ASP 683 Ca 0.00 1.89 0.00 0.00 0.43 0.00 0.00 52.55 54.87 2j48 s ASP 683 Cb 0.00 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 40.06 2j48 s ASP 683 CO 0.00 -0.59 0.00 0.00 -0.17 0.00 0.00 175.17 174.41 2j48 n GLN 684 N -0.63 0.00 0.21 4.34 10.64 -1.26 -4.94 117.38 125.73 2j48 n GLN 684 Ca 0.08 0.00 0.05 0.00 -1.83 0.00 0.00 57.00 55.29 2j48 n GLN 684 Cb 0.52 0.00 0.48 0.00 -0.86 0.00 0.00 30.24 30.38 2j48 n GLN 684 CO 0.00 0.00 0.00 1.03 -1.83 0.00 0.00 177.06 176.26 2j48 h SER 685 N 0.00 0.02 -0.04 2.61 0.87 -2.00 -1.81 113.55 113.20 2j48 h SER 685 Ca 0.00 -0.00 0.01 0.00 -1.23 0.00 0.00 61.79 60.57 2j48 h SER 685 Cb 0.00 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2j48 h SER 685 CO 0.00 0.22 0.07 0.00 -0.53 0.00 0.00 176.83 176.58 2j48 h LEU 687 N 0.00 0.88 -0.32 0.00 3.38 -1.73 -2.09 115.31 115.43 2j48 h LEU 687 Ca 0.02 -0.15 -0.18 0.00 0.09 0.00 0.00 57.88 57.65 2j48 h LEU 687 Cb 0.15 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 2j48 h LEU 687 CO -0.00 0.84 -0.54 0.17 0.09 0.00 0.00 178.44 178.99 2j48 h LEU 688 N 0.91 0.95 -0.76 1.67 8.10 -1.49 -2.83 115.31 121.85 2j48 h LEU 688 Ca 0.20 -0.51 -0.00 0.00 0.11 0.00 0.00 57.88 57.68 2j48 h LEU 688 Cb 0.28 -0.27 -0.04 0.00 -0.44 0.00 0.00 40.66 40.19 2j48 h LEU 688 CO -0.01 1.30 0.46 0.25 -4.11 0.00 0.00 178.44 176.33 2j48 h LEU 689 N 0.65 0.91 -0.40 0.17 6.46 -1.51 -1.68 115.31 119.91 2j48 h LEU 689 Ca 0.02 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 2j48 h LEU 689 Cb 1.15 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 40.83 2j48 h LEU 689 CO 0.12 0.70 0.25 -0.07 -0.62 0.00 0.00 178.44 178.83 2j48 h LEU 690 N 1.04 0.47 -0.73 2.25 3.38 -1.33 -1.87 115.31 118.51 2j48 h LEU 690 Ca 0.27 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.17 2j48 h LEU 690 Cb -0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2j48 h LEU 690 CO -0.05 0.37 0.30 1.56 0.09 0.00 0.00 178.44 180.70 2j48 h GLN 691 N 0.54 1.09 0.91 1.13 4.20 -1.24 -0.47 115.11 121.27 2j48 h GLN 691 Ca 0.15 -0.19 -0.04 0.00 0.06 0.00 0.00 58.65 58.62 2j48 h GLN 691 Cb -0.03 -0.18 0.01 0.00 0.30 0.00 0.00 27.48 27.58 2j48 h GLN 691 CO -0.03 0.89 -0.44 1.25 -0.67 0.00 0.00 178.83 179.83 2j48 h HIS 692 N 1.05 -1.14 -1.00 2.96 2.76 -1.01 0.71 115.15 119.47 2j48 h HIS 692 Ca 0.24 -0.03 0.10 0.00 -2.20 0.00 0.00 60.37 58.49 2j48 h HIS 692 Cb 0.20 0.38 -0.08 0.00 1.55 0.00 0.00 27.41 29.46 2j48 h HIS 692 CO 0.02 -0.71 0.64 1.37 -1.30 0.00 0.00 177.93 177.95 2j48 h LEU 693 N -1.24 0.96 -1.19 0.26 8.10 -1.35 -0.45 115.31 120.41 2j48 h LEU 693 Ca -0.13 0.04 -0.06 0.00 0.11 0.00 0.00 57.88 57.84 2j48 h LEU 693 Cb 0.94 -0.16 -0.02 0.00 -0.44 0.00 0.00 40.66 40.98 2j48 h LEU 693 CO 0.21 0.54 -0.10 -0.09 -4.11 0.00 0.00 178.44 174.88 2j48 h ARG 694 N 1.05 0.44 -0.43 0.17 2.43 -0.92 0.15 114.38 117.25 2j48 h ARG 694 Ca 0.48 -0.11 -0.08 0.00 -0.81 0.00 0.00 59.98 59.45 2j48 h ARG 694 Cb 0.39 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 2j48 h ARG 694 CO -0.23 0.55 -0.05 1.49 -1.51 0.00 0.00 179.97 180.21 2j48 h GLU 695 N 0.41 0.74 0.00 0.20 4.81 0.85 -3.44 114.58 118.15 2j48 h GLU 695 Ca 0.08 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2j48 h GLU 695 Cb 0.44 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.74 2j48 h GLU 695 CO 0.02 0.79 0.00 -2.39 -0.73 0.00 0.00 179.01 176.70 2j48 n HIS 696 N -4.20 0.00 0.13 0.92 1.44 -0.97 -5.03 115.22 107.51 2j48 n HIS 696 Ca 0.02 0.00 -0.14 0.00 -2.01 0.00 0.00 57.72 55.59 2j48 n HIS 696 Cb 0.32 0.00 -0.08 0.00 0.12 0.00 0.00 29.99 30.35 2j48 n HIS 696 CO 0.00 0.00 0.00 0.37 -2.81 0.00 0.00 176.34 173.90 2j48 h GLN 697 N 0.00 -0.25 0.00 -1.40 4.15 -0.89 -3.43 115.11 113.29 2j48 h GLN 697 Ca 0.00 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2j48 h GLN 697 Cb 0.00 0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.75 2j48 h GLN 697 CO 0.00 -0.11 0.00 0.00 -1.93 0.00 0.00 178.83 176.79 2j48 n ALA 698 N -2.25 0.00 -3.59 3.38 0.00 -1.26 -5.05 120.51 111.74 2j48 n ALA 698 Ca -0.09 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.31 2j48 n ALA 698 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.59 2j48 n ALA 698 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2j48 s ASP 699 N 0.00 -0.15 0.00 0.00 -4.77 -1.26 -5.00 116.67 105.50 2j48 s ASP 699 Ca 0.00 -0.01 0.00 0.00 -3.30 0.00 0.00 52.55 49.24 2j48 s ASP 699 Cb 0.00 0.16 0.01 0.00 -1.09 0.00 0.00 42.92 42.00 2j48 s ASP 699 CO 0.00 -0.26 0.94 -0.81 0.70 0.00 0.00 175.17 175.74 2j48 n PRO 700 N -0.12 0.00 -3.61 2.11 -0.04 -1.26 -3.24 135.00 128.84 2j48 n PRO 700 Ca -0.01 0.43 -0.27 0.00 -0.04 0.00 0.00 63.50 63.61 2j48 n PRO 700 Cb 0.59 -1.58 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 2j48 n PRO 700 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2j48 n HIS 701 N -1.44 2.63 -1.59 0.54 8.25 -1.26 -5.10 115.22 117.25 2j48 n HIS 701 Ca -0.00 -4.08 -0.38 0.00 -0.26 0.00 0.00 57.72 53.00 2j48 n HIS 701 Cb 0.07 -0.48 0.05 0.00 1.12 0.00 0.00 29.99 30.75 2j48 n HIS 701 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 2j48 n PRO 702 N 1.60 0.83 -0.76 -0.41 -0.02 -1.20 -4.95 135.00 130.09 2j48 n PRO 702 Ca 0.25 0.32 -0.25 0.00 -2.02 0.00 0.00 63.50 61.80 2j48 n PRO 702 Cb 0.40 -2.10 0.09 0.00 -0.02 0.00 0.00 33.50 31.87 2j48 n PRO 702 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2j48 n PRO 703 N -0.89 -0.94 -2.60 0.52 -0.02 -1.26 -4.88 135.00 124.93 2j48 n PRO 703 Ca 0.13 -0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 60.94 2j48 n PRO 703 Cb 0.47 -1.28 -0.05 0.00 -0.02 0.00 0.00 33.50 32.63 2j48 n PRO 703 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2j48 s LEU 704 N 3.93 4.54 -0.08 2.45 2.01 -1.25 -4.91 118.68 125.37 2j48 s LEU 704 Ca 0.34 2.04 0.04 0.00 0.01 0.00 0.00 54.13 56.56 2j48 s LEU 704 Cb -0.00 -3.61 0.00 0.00 0.01 0.00 0.00 46.19 42.59 2j48 s LEU 704 CO 0.46 -0.09 -0.21 -0.69 1.01 0.00 0.00 176.35 176.82 2j48 s VAL 705 N -0.59 1.84 -0.10 -1.59 1.01 -1.26 -2.00 120.40 117.71 2j48 s VAL 705 Ca 0.46 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.54 2j48 s VAL 705 Cb -0.28 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.48 2j48 s VAL 705 CO 0.34 0.51 -0.10 -0.76 0.00 0.00 0.00 175.10 175.09 2j48 s LEU 706 N 0.30 2.92 -0.12 3.92 1.02 -0.82 -0.44 118.68 125.47 2j48 s LEU 706 Ca -0.15 -0.19 0.01 0.00 0.02 0.00 0.00 54.13 53.82 2j48 s LEU 706 Cb -0.16 -1.65 -0.01 0.00 0.02 0.00 0.00 46.19 44.39 2j48 s LEU 706 CO 0.07 0.25 -0.16 -0.36 0.02 0.00 0.00 176.35 176.17 2j48 s PHE 707 N -0.17 2.75 -0.08 0.29 0.40 -0.99 -0.79 117.98 119.38 2j48 s PHE 707 Ca 0.01 -0.75 -0.02 0.00 -0.60 0.00 0.00 56.93 55.56 2j48 s PHE 707 Cb -0.13 -1.81 -0.03 0.00 0.51 0.00 0.00 43.02 41.55 2j48 s PHE 707 CO 0.03 -0.27 0.02 -0.51 0.70 0.00 0.00 175.22 175.19 2j48 s LEU 708 N 0.35 3.68 0.00 -0.37 1.43 -1.01 -0.90 118.68 121.87 2j48 s LEU 708 Ca -0.13 0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.14 2j48 s LEU 708 Cb -0.16 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.18 2j48 s LEU 708 CO 0.06 0.37 0.00 0.61 0.23 0.00 0.00 176.35 177.63 2j48 n GLY 709 N 2.04 0.17 3.95 -3.19 0.00 -1.19 0.19 105.19 107.17 2j48 n GLY 709 Ca -0.18 -1.88 -0.23 0.00 0.00 0.00 0.00 46.02 43.73 2j48 n GLY 709 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2j48 s GLU 710 N 0.00 2.92 0.77 1.61 -1.05 -1.26 -4.06 118.70 117.63 2j48 s GLU 710 Ca 0.00 -0.51 -0.15 0.00 -0.15 0.00 0.00 54.97 54.16 2j48 s GLU 710 Cb 0.00 -2.51 -0.01 0.00 -0.44 0.00 0.00 34.13 31.16 2j48 s GLU 710 CO 0.00 -0.42 0.58 -2.30 0.95 0.00 0.00 175.26 174.07 2j48 n PRO 711 N -2.20 0.21 -0.47 -4.83 -0.02 -1.26 -4.87 135.00 121.56 2j48 n PRO 711 Ca 0.03 0.12 -0.28 0.00 -2.02 0.00 0.00 63.50 61.35 2j48 n PRO 711 Cb 0.58 -1.90 0.26 0.00 -0.02 0.00 0.00 33.50 32.42 2j48 n PRO 711 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2j48 s PRO 712 N -3.05 -1.10 0.00 0.52 0.04 -1.26 -4.89 135.00 125.26 2j48 s PRO 712 Ca 0.65 0.89 0.31 0.00 0.04 0.00 0.00 61.00 62.88 2j48 s PRO 712 Cb -0.32 -1.53 1.80 0.00 0.04 0.00 0.00 34.50 34.49 2j48 s PRO 712 CO 0.59 -3.86 2.16 0.28 0.04 0.00 0.00 177.00 176.21 2j48 n VAL 713 N -5.02 0.00 -3.60 -0.36 0.31 -1.26 -4.78 118.33 103.62 2j48 n VAL 713 Ca 0.03 -0.01 -0.14 0.00 -0.01 0.00 0.00 64.34 64.20 2j48 n VAL 713 Cb 0.54 -0.43 -0.07 0.00 -0.91 0.00 0.00 33.84 32.97 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 -1.96 -0.66 0.06 4.52 1.01 -1.26 -5.02 116.67 113.36 2j48 s ASP 714 Ca 0.46 1.12 0.09 0.00 0.71 0.00 0.00 52.55 54.93 2j48 s ASP 714 Cb 0.21 1.08 0.42 0.00 1.01 0.00 0.00 42.92 45.64 2j48 s ASP 714 CO 0.36 -0.33 1.29 -0.81 0.21 0.00 0.00 175.17 175.89 2j48 n PRO 715 N 2.06 0.03 0.01 8.23 -0.04 -1.26 -2.15 135.00 141.88 2j48 n PRO 715 Ca -0.15 0.43 -0.06 0.00 -0.04 0.00 0.00 63.50 63.68 2j48 n PRO 715 Cb 0.56 -1.59 0.12 0.00 -0.04 0.00 0.00 33.50 32.55 2j48 n PRO 715 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2j48 h LEU 716 N 0.00 0.54 -0.36 1.53 -0.00 -1.98 -1.97 115.31 113.07 2j48 h LEU 716 Ca 0.00 -0.24 -0.18 0.00 -0.00 0.00 0.00 57.88 57.46 2j48 h LEU 716 Cb 0.11 -0.15 -0.02 0.00 -0.00 0.00 0.00 40.66 40.60 2j48 h LEU 716 CO 0.00 0.89 -0.83 -0.07 -0.00 0.00 0.00 178.44 178.43 2j48 h LEU 717 N 0.42 0.13 -0.55 1.67 3.38 -1.85 -2.59 115.31 115.92 2j48 h LEU 717 Ca 0.03 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 2j48 h LEU 717 Cb 0.90 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 2j48 h LEU 717 CO 0.08 0.90 0.33 0.74 0.09 0.00 0.00 178.44 180.57 2j48 h THR 718 N 0.06 1.17 -0.46 0.22 2.02 -1.52 0.98 112.91 115.37 2j48 h THR 718 Ca -0.03 -0.38 -0.08 0.00 0.77 0.00 0.00 66.41 66.69 2j48 h THR 718 Cb 1.44 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 68.27 2j48 h THR 718 CO 0.12 0.17 -0.04 0.00 0.37 0.00 0.00 175.52 176.14 2j48 h ALA 719 N 1.16 1.06 0.00 6.16 0.00 -1.31 -2.15 119.26 124.18 2j48 h ALA 719 Ca 0.20 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2j48 h ALA 719 Cb -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2j48 h ALA 719 CO -0.04 0.58 0.00 0.37 0.00 0.00 0.00 179.25 180.17 2j48 h GLN 720 N 0.73 0.00 -6.77 0.00 4.15 -0.96 -3.45 115.11 108.81 2j48 h GLN 720 Ca 0.14 0.00 -0.52 0.00 0.77 0.00 0.00 58.65 59.04 2j48 h GLN 720 Cb 0.50 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.23 2j48 h GLN 720 CO 0.03 0.00 0.58 0.00 -1.93 0.00 0.00 178.83 177.51 2j48 s ALA 721 N -3.33 3.47 0.01 3.38 0.00 0.33 -4.78 121.76 120.84 2j48 s ALA 721 Ca 0.05 1.06 0.11 0.00 0.00 0.00 0.00 51.96 53.19 2j48 s ALA 721 Cb 0.06 -3.42 -0.21 0.00 0.00 0.00 0.00 23.12 19.54 2j48 s ALA 721 CO 0.64 -0.43 0.91 0.77 0.00 0.00 0.00 175.76 177.65 2j48 h SER 722 N 4.31 0.00 -0.41 0.00 0.02 -1.04 -3.46 113.55 112.98 2j48 h SER 722 Ca -0.46 0.00 0.20 0.00 -0.84 0.00 0.00 61.79 60.69 2j48 h SER 722 Cb 1.22 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.55 2j48 h SER 722 CO 0.70 0.98 0.01 0.00 -1.14 0.00 0.00 176.83 177.38 2j48 s ALA 723 N -2.66 -3.48 -0.13 3.77 0.00 -0.81 -4.91 121.76 113.54 2j48 s ALA 723 Ca -0.02 1.40 -0.17 0.00 0.00 0.00 0.00 51.96 53.17 2j48 s ALA 723 Cb 0.09 -2.60 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 2j48 s ALA 723 CO 0.82 -1.70 0.42 0.42 0.00 0.00 0.00 175.76 175.72 2j48 s ILE 724 N 2.94 5.22 -0.47 0.00 1.01 -1.26 -2.35 121.20 126.28 2j48 s ILE 724 Ca 0.11 0.83 -0.04 0.00 0.00 0.00 0.00 60.65 61.55 2j48 s ILE 724 Cb -0.08 -3.76 0.12 0.00 0.01 0.00 0.00 42.46 38.76 2j48 s ILE 724 CO -0.17 0.34 0.29 -0.76 0.00 0.00 0.00 174.94 174.64 2j48 s LEU 725 N 0.63 5.38 0.00 2.97 1.02 -0.07 -4.91 118.68 123.70 2j48 s LEU 725 Ca 0.23 -2.18 0.24 0.00 0.02 0.00 0.00 54.13 52.44 2j48 s LEU 725 Cb -0.14 -1.88 1.44 0.00 0.02 0.00 0.00 46.19 45.62 2j48 s LEU 725 CO 0.08 -0.54 1.81 -1.54 0.02 0.00 0.00 176.35 176.18 2j48 n SER 726 N 4.43 0.00 -3.78 2.29 3.41 -1.26 -3.15 113.62 115.56 2j48 n SER 726 Ca -0.01 -0.79 -0.30 0.00 -0.26 0.00 0.00 58.87 57.52 2j48 n SER 726 Cb 0.41 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.22 2j48 n SER 726 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2j48 s LYS 727 N -2.00 1.53 0.76 4.33 -2.85 -1.26 -4.84 119.74 115.41 2j48 s LYS 727 Ca 0.36 -2.24 -0.16 0.00 -1.00 0.00 0.00 55.97 52.94 2j48 s LYS 727 Cb 0.17 -2.65 -0.02 0.00 -2.06 0.00 0.00 37.83 33.26 2j48 s LYS 727 CO 0.28 -1.15 0.56 -2.30 0.10 0.00 0.00 175.35 172.84 2j48 n PRO 728 N 3.34 0.23 0.00 1.78 -0.02 -1.26 -4.76 135.00 134.31 2j48 n PRO 728 Ca 0.08 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2j48 n PRO 728 Cb 0.34 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 -0.62 0.00 -3.60 2.45 7.94 -1.26 -5.03 117.00 116.88 2j48 n LEU 729 Ca 0.10 0.00 -0.26 0.00 -1.11 0.00 0.00 56.01 54.74 2j48 n LEU 729 Cb 0.50 0.00 0.03 0.00 0.53 0.00 0.00 43.42 44.49 2j48 n LEU 729 CO 0.50 0.00 -0.04 0.47 -1.11 0.00 0.00 177.39 177.22 2j48 n ASP 730 N 0.02 -5.65 0.32 1.96 8.00 -1.26 -4.77 116.55 115.16 2j48 n ASP 730 Ca 0.00 -0.87 0.21 0.00 0.71 0.00 0.00 54.79 54.84 2j48 n ASP 730 Cb 0.00 -3.45 1.12 0.00 -0.02 0.00 0.00 41.12 38.77 2j48 n ASP 730 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 2j48 h PRO 731 N -1.33 0.00 -0.09 -0.24 0.13 -1.98 -1.30 132.00 127.19 2j48 h PRO 731 Ca -0.57 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.36 2j48 h PRO 731 Cb 1.32 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 2j48 h PRO 731 CO 0.44 0.00 -0.76 1.96 -0.23 0.00 0.00 178.00 179.41 2j48 h GLN 732 N 0.00 0.50 0.00 0.86 4.20 -1.99 -1.81 115.11 116.87 2j48 h GLN 732 Ca 0.00 -0.42 -0.00 0.00 0.06 0.00 0.00 58.65 58.29 2j48 h GLN 732 Cb 0.04 0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.91 2j48 h GLN 732 CO 0.00 1.05 -0.00 1.25 -0.67 0.00 0.00 178.83 180.46 2j48 h LEU 733 N 0.34 -0.00 -0.81 1.46 5.85 -1.57 -2.39 115.31 118.18 2j48 h LEU 733 Ca -0.04 -0.50 0.04 0.00 0.84 0.00 0.00 57.88 58.22 2j48 h LEU 733 Cb 1.35 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.33 2j48 h LEU 733 CO 0.14 0.50 0.51 0.25 -0.34 0.00 0.00 178.44 179.50 2j48 h LEU 734 N -0.51 0.82 -0.92 2.25 5.85 -1.57 -2.07 115.31 119.18 2j48 h LEU 734 Ca -0.00 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.69 2j48 h LEU 734 Cb 0.51 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2j48 h LEU 734 CO 0.00 0.55 0.31 0.25 -0.34 0.00 0.00 178.44 179.22 2j48 h LEU 735 N 0.97 1.01 -0.30 2.25 5.85 -1.33 -1.17 115.31 122.59 2j48 h LEU 735 Ca 0.34 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.94 2j48 h LEU 735 Cb 0.08 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2j48 h LEU 735 CO -0.14 0.89 0.14 0.74 -0.34 0.00 0.00 178.44 179.73 2j48 h THR 736 N 1.08 0.98 -0.62 1.05 2.02 -0.84 0.36 112.91 116.95 2j48 h THR 736 Ca 0.25 -0.10 -0.07 0.00 0.77 0.00 0.00 66.41 67.26 2j48 h THR 736 Cb 0.18 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2j48 h THR 736 CO -0.02 0.06 0.10 0.74 0.37 0.00 0.00 175.52 176.76 2j48 h THR 737 N 0.30 1.26 -0.32 3.16 2.02 -1.25 -0.45 112.91 117.63 2j48 h THR 737 Ca 0.12 -1.01 -0.03 0.00 0.77 0.00 0.00 66.41 66.27 2j48 h THR 737 Cb 0.05 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 2j48 h THR 737 CO -0.09 0.37 0.10 0.25 0.37 0.00 0.00 175.52 176.52 2j48 h LEU 738 N 0.94 0.47 -1.55 2.58 6.46 -0.69 -2.30 115.31 121.22 2j48 h LEU 738 Ca 0.19 -0.21 -0.05 0.00 -0.12 0.00 0.00 57.88 57.69 2j48 h LEU 738 Cb 0.43 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.23 2j48 h LEU 738 CO 0.01 0.55 -0.23 1.56 -0.62 0.00 0.00 178.44 179.71 2j48 h GLN 739 N 0.36 0.00 -0.66 1.25 4.20 -0.17 -3.20 115.11 116.89 2j48 h GLN 739 Ca 0.10 0.00 0.21 0.00 0.06 0.00 0.00 58.65 59.02 2j48 h GLN 739 Cb 0.25 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.99 2j48 h GLN 739 CO -0.00 0.23 0.45 0.41 -0.67 0.00 0.00 178.83 179.25 2j48 n GLY 740 N -0.61 -0.36 0.00 3.46 0.00 -0.19 -0.48 105.19 107.01 2j48 n GLY 740 Ca -0.02 0.28 0.00 0.00 0.00 0.00 0.00 46.02 46.29 2j48 n GLY 740 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2j48 n LEU 741 N -3.09 0.69 -3.34 0.99 4.32 -1.21 -5.01 117.00 110.36 2j48 n LEU 741 Ca 0.17 0.26 -0.17 0.00 -0.02 0.00 0.00 56.01 56.25 2j48 n LEU 741 Cb 0.70 -0.35 0.05 0.00 -1.62 0.00 0.00 43.42 42.20 2j48 n LEU 741 CO 0.12 -0.35 0.05 0.00 -1.22 0.00 0.00 177.39 176.00 2j48 s PRO 743 N -4.54 4.03 0.00 0.00 0.04 -1.26 -4.92 135.00 128.36 2j48 s PRO 743 Ca 0.37 0.88 0.26 0.00 0.04 0.00 0.00 61.00 62.55 2j48 s PRO 743 Cb -0.07 -3.73 0.68 0.00 0.04 0.00 0.00 34.50 31.42 2j48 s PRO 743 CO 0.78 -0.78 1.53 -0.35 0.04 0.00 0.00 177.00 178.21 2j48 n PRO 744 N 6.53 0.19 0.00 0.56 -0.04 -1.26 -5.06 135.00 135.93 2j48 n PRO 744 Ca 0.08 -0.10 0.14 0.00 -0.04 0.00 0.00 63.50 63.59 2j48 n PRO 744 Cb 0.47 -1.50 0.57 0.00 -0.04 0.00 0.00 33.50 33.01 2j48 n PRO 744 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55