#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 -0.36 3.79 0.00 0.00 -1.26 -4.97 105.19 102.39 2j48 n GLY 628 Ca 0.00 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.26 3.69 -0.08 1.61 0.09 -1.26 -4.64 115.29 113.44 2j48 s HIS 629 Ca 0.00 1.10 0.03 0.00 -0.00 0.00 0.00 55.06 56.19 2j48 s HIS 629 Cb 0.00 -2.48 -0.02 0.00 -0.00 0.00 0.00 32.58 30.08 2j48 s HIS 629 CO 0.00 0.45 -0.15 0.42 -0.00 0.00 0.00 174.74 175.46 2j48 s ILE 630 N -0.50 2.92 -0.12 0.60 1.01 -1.05 -1.81 121.20 122.24 2j48 s ILE 630 Ca 0.28 -0.75 0.02 0.00 0.00 0.00 0.00 60.65 60.20 2j48 s ILE 630 Cb -0.18 -2.16 0.01 0.00 0.01 0.00 0.00 42.46 40.14 2j48 s ILE 630 CO 0.15 0.56 -0.19 -0.22 0.00 0.00 0.00 174.94 175.25 2j48 s LEU 631 N -0.27 1.93 -0.07 2.97 0.20 -1.08 -1.25 118.68 121.11 2j48 s LEU 631 Ca 0.01 -0.52 0.04 0.00 0.69 0.00 0.00 54.13 54.36 2j48 s LEU 631 Cb -0.13 -1.28 -0.02 0.00 -0.43 0.00 0.00 46.19 44.34 2j48 s LEU 631 CO 0.03 0.05 -0.20 -0.76 -0.29 0.00 0.00 176.35 175.18 2j48 s LEU 632 N 0.87 2.37 -0.33 -0.68 1.02 -0.89 -2.33 118.68 118.70 2j48 s LEU 632 Ca -0.08 -0.40 -0.08 0.00 0.02 0.00 0.00 54.13 53.60 2j48 s LEU 632 Cb -0.15 -1.47 0.03 0.00 0.02 0.00 0.00 46.19 44.61 2j48 s LEU 632 CO -0.01 0.25 0.12 -0.76 0.02 0.00 0.00 176.35 175.97 2j48 s LEU 633 N -0.18 4.28 0.10 1.79 1.02 0.37 -2.16 118.68 123.90 2j48 s LEU 633 Ca -0.02 -0.98 -0.25 0.00 0.02 0.00 0.00 54.13 52.90 2j48 s LEU 633 Cb -0.14 -1.91 0.07 0.00 0.02 0.00 0.00 46.19 44.23 2j48 s LEU 633 CO 0.03 -0.30 0.63 -0.70 0.02 0.00 0.00 176.35 176.03 2j48 s GLU 634 N 1.47 1.21 0.11 1.70 2.12 -0.90 -2.27 118.70 122.13 2j48 s GLU 634 Ca 0.00 -0.26 0.06 0.00 0.36 0.00 0.00 54.97 55.14 2j48 s GLU 634 Cb -0.19 0.56 -0.04 0.00 0.26 0.00 0.00 34.13 34.72 2j48 s GLU 634 CO 0.04 -0.49 -0.05 -1.21 -0.54 0.00 0.00 175.26 173.01 2j48 s GLU 635 N -3.00 2.32 0.00 4.30 2.02 -1.26 -4.33 118.70 118.75 2j48 s GLU 635 Ca -0.02 -0.97 0.00 0.00 0.02 0.00 0.00 54.97 54.00 2j48 s GLU 635 Cb -0.01 -2.40 0.00 0.00 0.10 0.00 0.00 34.13 31.82 2j48 s GLU 635 CO -0.06 0.51 0.00 -1.91 0.02 0.00 0.00 175.26 173.82 2j48 n GLU 636 N 0.53 0.00 -0.20 1.61 2.13 -1.26 -4.73 120.64 118.72 2j48 n GLU 636 Ca -0.12 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.79 2j48 n GLU 636 Cb 0.53 0.00 0.39 0.00 0.27 0.00 0.00 31.44 32.62 2j48 n GLU 636 CO 0.00 0.00 0.00 0.22 -0.41 0.00 0.00 177.13 176.94 2j48 h ASP 637 N 0.00 0.61 -0.70 4.31 3.58 -1.97 0.12 116.42 122.36 2j48 h ASP 637 Ca 0.00 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.40 2j48 h ASP 637 Cb 0.00 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 2j48 h ASP 637 CO 0.00 0.36 0.19 -0.33 -2.88 0.00 0.00 179.24 176.59 2j48 h GLU 638 N 0.67 1.10 -0.06 0.28 5.08 -1.98 0.56 114.58 120.23 2j48 h GLU 638 Ca 0.35 -0.25 -0.10 0.00 -1.00 0.00 0.00 59.36 58.36 2j48 h GLU 638 Cb 0.47 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.57 2j48 h GLU 638 CO -0.13 0.96 -0.36 0.00 -1.00 0.00 0.00 179.01 178.48 2j48 h ALA 639 N 1.09 0.13 -0.60 3.43 0.00 -1.59 -2.74 119.26 118.99 2j48 h ALA 639 Ca 0.22 -0.46 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 2j48 h ALA 639 Cb 0.34 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2j48 h ALA 639 CO -0.00 0.22 0.06 0.00 0.00 0.00 0.00 179.25 179.53 2j48 h ALA 640 N 0.42 0.98 -0.30 0.00 0.00 -0.72 -2.70 119.26 116.94 2j48 h ALA 640 Ca -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 2j48 h ALA 640 Cb 1.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 2j48 h ALA 640 CO 0.07 0.63 0.15 1.15 0.00 0.00 0.00 179.25 181.25 2j48 h THR 641 N 0.93 1.15 0.10 0.00 2.02 0.09 0.26 112.91 117.46 2j48 h THR 641 Ca 0.18 -0.44 0.02 0.00 0.77 0.00 0.00 66.41 66.94 2j48 h THR 641 Cb 0.45 0.89 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 2j48 h THR 641 CO 0.02 0.16 -0.21 0.58 0.37 0.00 0.00 175.52 176.43 2j48 h VAL 642 N 0.35 0.53 -0.74 3.16 2.07 -1.35 0.07 116.25 120.35 2j48 h VAL 642 Ca 0.10 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.64 2j48 h VAL 642 Cb 0.12 0.53 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 2j48 h VAL 642 CO -0.01 0.00 0.48 0.58 0.02 0.00 0.00 177.57 178.63 2j48 h VAL 643 N -0.39 1.14 -0.93 2.57 2.07 -1.39 -1.93 116.25 117.40 2j48 h VAL 643 Ca 0.03 -0.33 0.05 0.00 0.82 0.00 0.00 66.70 67.27 2j48 h VAL 643 Cb 0.42 0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.23 2j48 h VAL 643 CO -0.12 0.17 0.60 0.00 0.02 0.00 0.00 177.57 178.24 2j48 h GLU 645 N 1.14 1.04 -0.04 0.00 4.81 -0.24 1.55 114.58 122.84 2j48 h GLU 645 Ca 0.38 -0.15 -0.01 0.00 -0.13 0.00 0.00 59.36 59.46 2j48 h GLU 645 Cb 0.06 -0.19 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 2j48 h GLU 645 CO -0.14 0.81 -0.02 0.52 -0.73 0.00 0.00 179.01 179.45 2j48 h MET 646 N 1.04 0.09 -0.32 1.92 2.86 -0.65 -0.51 114.93 119.36 2j48 h MET 646 Ca 0.25 -0.04 -0.10 0.00 -2.06 0.00 0.00 59.70 57.76 2j48 h MET 646 Cb 0.11 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 2j48 h MET 646 CO -0.03 0.46 -0.19 -0.07 1.06 0.00 0.00 176.91 178.14 2j48 h LEU 647 N -0.29 0.71 -0.90 1.22 3.38 -0.70 -2.10 115.31 116.63 2j48 h LEU 647 Ca 0.01 -0.42 0.08 0.00 0.09 0.00 0.00 57.88 57.64 2j48 h LEU 647 Cb 0.43 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 2j48 h LEU 647 CO 0.01 0.98 0.55 0.74 0.09 0.00 0.00 178.44 180.81 2j48 h THR 648 N 0.45 0.98 -0.01 0.22 2.02 0.22 0.91 112.91 117.70 2j48 h THR 648 Ca 0.07 -0.33 -0.07 0.00 0.77 0.00 0.00 66.41 66.85 2j48 h THR 648 Cb 0.73 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.08 2j48 h THR 648 CO 0.05 0.17 -0.34 0.00 0.37 0.00 0.00 175.52 175.78 2j48 h ALA 649 N 1.46 1.42 0.00 6.16 0.00 -0.89 -1.75 119.26 125.66 2j48 h ALA 649 Ca 0.42 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2j48 h ALA 649 Cb 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2j48 h ALA 649 CO -0.21 0.43 0.00 0.00 0.00 0.00 0.00 179.25 179.47 2j48 n ALA 650 N -2.48 2.13 -0.71 0.00 0.00 0.27 -4.84 120.51 114.88 2j48 n ALA 650 Ca -0.02 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2j48 n ALA 650 Cb 0.38 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 0.54 0.73 3.79 0.00 0.00 -0.66 -5.04 105.19 104.56 2j48 n GLY 651 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.57 3.59 -0.23 1.61 0.40 -0.93 -5.02 117.98 114.82 2j48 s PHE 652 Ca 0.00 0.75 -0.16 0.00 -0.60 0.00 0.00 56.93 56.92 2j48 s PHE 652 Cb 0.00 -2.27 -0.03 0.00 0.51 0.00 0.00 43.02 41.23 2j48 s PHE 652 CO 0.00 0.47 0.44 0.21 0.70 0.00 0.00 175.22 177.04 2j48 s LYS 653 N -0.34 4.12 0.08 0.44 2.20 -1.26 -3.81 119.74 121.16 2j48 s LYS 653 Ca 0.20 0.23 0.06 0.00 -0.36 0.00 0.00 55.97 56.10 2j48 s LYS 653 Cb -0.14 -3.59 -0.03 0.00 -1.51 0.00 0.00 37.83 32.55 2j48 s LYS 653 CO 0.08 -0.18 -0.17 0.14 -0.36 0.00 0.00 175.35 174.85 2j48 s VAL 654 N 1.77 1.37 -0.13 4.02 -7.23 -1.26 -2.54 120.40 116.40 2j48 s VAL 654 Ca 0.19 -1.41 -0.00 0.00 -1.81 0.00 0.00 61.98 58.95 2j48 s VAL 654 Cb -0.15 -1.28 -0.01 0.00 0.56 0.00 0.00 36.38 35.49 2j48 s VAL 654 CO 0.09 -0.16 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.96 2j48 s ILE 655 N -1.23 3.04 -0.13 -0.62 -1.09 -0.38 -4.99 121.20 115.80 2j48 s ILE 655 Ca 0.02 -0.67 -0.12 0.00 -2.23 0.00 0.00 60.65 57.65 2j48 s ILE 655 Cb -0.10 -2.27 -0.05 0.00 -1.58 0.00 0.00 42.46 38.46 2j48 s ILE 655 CO 0.03 0.52 0.27 0.86 -1.23 0.00 0.00 174.94 175.39 2j48 s TRP 656 N 0.36 3.53 -0.01 3.97 -0.11 -1.26 -2.10 118.94 123.33 2j48 s TRP 656 Ca -0.11 0.63 0.08 0.00 1.22 0.00 0.00 56.10 57.92 2j48 s TRP 656 Cb -0.16 -2.23 -0.02 0.00 -1.50 0.00 0.00 33.47 29.55 2j48 s TRP 656 CO 0.06 0.42 -0.26 -0.51 -4.62 0.00 0.00 176.95 172.03 2j48 s LEU 657 N -0.12 2.08 0.00 5.86 2.01 -0.92 -5.01 118.68 122.58 2j48 s LEU 657 Ca 0.17 -0.49 0.15 0.00 0.01 0.00 0.00 54.13 53.96 2j48 s LEU 657 Cb -0.13 -1.32 0.31 0.00 0.01 0.00 0.00 46.19 45.06 2j48 s LEU 657 CO 0.05 0.30 1.21 1.33 1.01 0.00 0.00 176.35 180.26 2j48 n VAL 658 N 2.30 0.65 -3.21 -1.59 0.24 -1.26 -2.13 118.33 113.34 2j48 n VAL 658 Ca -0.16 -0.83 0.00 0.00 -2.04 0.00 0.00 64.34 61.31 2j48 n VAL 658 Cb 0.51 0.78 0.00 0.00 -1.47 0.00 0.00 33.84 33.66 2j48 n VAL 658 CO 0.00 0.00 0.00 -0.90 -2.14 0.00 0.00 176.83 173.79 2j48 n ASP 659 N 0.86 0.00 -0.04 -1.34 5.68 -1.26 -4.87 116.55 115.57 2j48 n ASP 659 Ca 0.13 -0.88 -0.05 0.00 -0.50 0.00 0.00 54.79 53.49 2j48 n ASP 659 Cb 0.45 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.38 2j48 n ASP 659 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j48 n GLY 660 N 0.00 -0.18 0.19 6.12 0.00 -1.26 -4.36 105.19 105.70 2j48 n GLY 660 Ca 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 46.02 45.88 2j48 n GLY 660 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2j48 h SER 661 N 0.00 0.44 -0.38 1.61 0.02 -1.98 -0.71 113.55 112.55 2j48 h SER 661 Ca -0.20 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.69 2j48 h SER 661 Cb 1.34 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 63.77 2j48 h SER 661 CO -0.02 0.31 0.00 0.74 -1.14 0.00 0.00 176.83 176.73 2j48 h THR 662 N 0.55 1.24 -0.36 -2.27 2.02 -2.01 -2.74 112.91 109.33 2j48 h THR 662 Ca 0.18 -0.97 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 2j48 h THR 662 Cb 0.02 0.88 -0.02 0.00 -1.74 0.00 0.00 68.15 67.29 2j48 h THR 662 CO -0.09 0.34 0.18 0.00 0.37 0.00 0.00 175.52 176.33 2j48 h ALA 663 N 1.29 0.46 -0.55 6.16 0.00 -1.57 -1.91 119.26 123.14 2j48 h ALA 663 Ca 0.14 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.99 2j48 h ALA 663 Cb 0.43 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 2j48 h ALA 663 CO 0.02 0.01 0.31 -0.07 0.00 0.00 0.00 179.25 179.52 2j48 h LEU 664 N 0.45 0.48 -0.72 0.00 3.38 -0.93 3.73 115.31 121.68 2j48 h LEU 664 Ca 0.12 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2j48 h LEU 664 Cb 0.10 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 2j48 h LEU 664 CO -0.02 0.33 0.30 -0.78 0.09 0.00 0.00 178.44 178.36 2j48 h ASP 665 N 0.60 0.98 0.03 -0.43 3.58 -1.28 -2.75 116.42 117.16 2j48 h ASP 665 Ca 0.23 -0.17 -0.36 0.00 0.42 0.00 0.00 57.03 57.16 2j48 h ASP 665 Cb 0.09 -0.26 -0.05 0.00 1.72 0.00 0.00 39.33 40.84 2j48 h ASP 665 CO -0.13 0.88 -2.00 0.00 -2.88 0.00 0.00 179.24 175.11 2j48 n GLN 666 N -4.36 0.63 -0.32 0.28 10.64 -0.74 -4.17 117.38 119.34 2j48 n GLN 666 Ca 0.06 0.34 0.15 0.00 -1.83 0.00 0.00 57.00 55.72 2j48 n GLN 666 Cb 0.17 -1.63 0.34 0.00 -0.86 0.00 0.00 30.24 28.26 2j48 n GLN 666 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 2j48 h LEU 667 N -0.56 0.48 -1.35 2.61 6.46 0.70 0.64 115.31 124.28 2j48 h LEU 667 Ca -0.50 0.15 -0.02 0.00 -0.12 0.00 0.00 57.88 57.39 2j48 h LEU 667 Cb 1.67 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 41.67 2j48 h LEU 667 CO -0.17 0.04 0.23 -0.78 -0.62 0.00 0.00 178.44 177.13 2j48 h ASP 668 N 0.47 0.60 0.02 1.25 1.82 -1.58 0.41 116.42 119.41 2j48 h ASP 668 Ca 0.60 -0.05 -0.16 0.00 -0.39 0.00 0.00 57.03 57.02 2j48 h ASP 668 Cb 1.14 -0.15 0.01 0.00 0.68 0.00 0.00 39.33 41.01 2j48 h ASP 668 CO -0.51 0.52 -0.64 -0.07 -1.61 0.00 0.00 179.24 176.92 2j48 h LEU 669 N 0.67 0.53 0.00 2.28 3.38 0.01 -3.29 115.31 118.89 2j48 h LEU 669 Ca 0.17 -0.79 0.00 0.00 0.09 0.00 0.00 57.88 57.35 2j48 h LEU 669 Cb 0.08 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.67 2j48 h LEU 669 CO -0.02 1.25 -0.12 0.17 0.09 0.00 0.00 178.44 179.81 2j48 h LEU 670 N -0.14 0.00 -3.29 1.67 8.10 -0.81 -3.48 115.31 117.36 2j48 h LEU 670 Ca -0.09 -0.03 -0.38 0.00 0.11 0.00 0.00 57.88 57.49 2j48 h LEU 670 Cb 1.37 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 41.61 2j48 h LEU 670 CO 0.13 0.02 -1.09 0.00 -4.11 0.00 0.00 178.44 173.39 2j48 n GLN 671 N -2.37 -1.67 -1.54 0.17 1.13 0.14 -4.70 117.38 108.55 2j48 n GLN 671 Ca 0.05 1.15 -0.32 0.00 -1.94 0.00 0.00 57.00 55.94 2j48 n GLN 671 Cb 0.45 -1.83 0.07 0.00 0.11 0.00 0.00 30.24 29.04 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 -2.70 2.54 0.02 -1.09 0.04 -1.26 -4.70 135.00 127.85 2j48 s PRO 672 Ca 0.28 1.32 0.18 0.00 0.04 0.00 0.00 61.00 62.82 2j48 s PRO 672 Cb -0.03 -1.92 -0.17 0.00 0.04 0.00 0.00 34.50 32.42 2j48 s PRO 672 CO 0.79 -1.45 0.68 -0.89 0.04 0.00 0.00 177.00 176.17 2j48 n ILE 673 N -2.88 0.98 -3.84 0.56 2.08 -0.75 -4.93 119.36 110.58 2j48 n ILE 673 Ca 0.10 -0.67 -0.12 0.00 0.56 0.00 0.00 62.75 62.62 2j48 n ILE 673 Cb 0.52 -0.54 -0.12 0.00 -0.75 0.00 0.00 39.64 38.75 2j48 n ILE 673 CO 0.00 0.00 0.00 0.54 0.56 0.00 0.00 176.55 177.65 2j48 s VAL 674 N -2.99 0.02 -0.08 1.39 0.11 -1.26 -3.59 120.40 113.99 2j48 s VAL 674 Ca -0.05 -0.16 0.02 0.00 -2.93 0.00 0.00 61.98 58.86 2j48 s VAL 674 Cb 0.09 -0.23 0.02 0.00 -1.53 0.00 0.00 36.38 34.73 2j48 s VAL 674 CO 0.83 -0.09 -0.12 -0.63 -3.33 0.00 0.00 175.10 171.76 2j48 s ILE 675 N -0.24 1.23 -0.13 7.04 1.01 -0.97 -2.63 121.20 126.50 2j48 s ILE 675 Ca -0.03 -0.50 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 2j48 s ILE 675 Cb -0.02 -1.14 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 2j48 s ILE 675 CO 0.00 0.38 -0.10 -0.76 0.00 0.00 0.00 174.94 174.47 2j48 s LEU 676 N 0.90 2.91 -0.03 2.97 1.02 -0.98 -2.63 118.68 122.84 2j48 s LEU 676 Ca -0.10 -0.24 -0.00 0.00 0.02 0.00 0.00 54.13 53.81 2j48 s LEU 676 Cb -0.15 -1.66 0.03 0.00 0.02 0.00 0.00 46.19 44.43 2j48 s LEU 676 CO 0.01 0.20 0.04 -0.32 0.02 0.00 0.00 176.35 176.29 2j48 s MET 677 N 0.18 -0.04 0.65 1.70 1.75 -1.05 0.14 119.30 122.63 2j48 s MET 677 Ca -0.06 0.23 -0.17 0.00 -1.25 0.00 0.00 55.69 54.45 2j48 s MET 677 Cb -0.15 -0.32 -0.01 0.00 2.84 0.00 0.00 34.83 37.20 2j48 s MET 677 CO 0.04 -0.21 1.19 0.00 -0.65 0.00 0.00 175.02 175.39 2j48 s ALA 678 N 1.34 2.40 -0.59 4.11 0.00 -0.96 -2.43 121.76 125.63 2j48 s ALA 678 Ca -0.06 0.88 0.06 0.00 0.00 0.00 0.00 51.96 52.84 2j48 s ALA 678 Cb -0.13 -3.43 0.23 0.00 0.00 0.00 0.00 23.12 19.79 2j48 s ALA 678 CO -0.03 -1.40 0.64 1.87 0.00 0.00 0.00 175.76 176.85 2j48 n TRP 679 N -2.09 2.58 -3.20 0.00 -0.00 -0.64 -4.84 117.44 109.26 2j48 n TRP 679 Ca 0.13 -4.02 -0.36 0.00 -0.00 0.00 0.00 57.50 53.25 2j48 n TRP 679 Cb 0.50 -0.49 -0.06 0.00 -0.00 0.00 0.00 31.31 31.27 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 -1.95 4.15 0.17 5.87 0.04 -1.26 -4.28 135.00 137.75 2j48 s PRO 680 Ca 0.36 0.73 -0.17 0.00 0.04 0.00 0.00 61.00 61.96 2j48 s PRO 680 Cb 0.12 -2.92 0.11 0.00 0.04 0.00 0.00 34.50 31.84 2j48 s PRO 680 CO -0.06 0.44 1.66 -1.35 0.04 0.00 0.00 177.00 177.72 2j48 h PRO 681 N 3.54 -0.03 0.00 0.56 0.10 -2.00 -2.04 132.00 132.14 2j48 h PRO 681 Ca -0.48 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.62 2j48 h PRO 681 Cb 1.19 0.01 0.00 0.00 0.10 0.00 0.00 31.00 32.30 2j48 h PRO 681 CO 0.65 -0.02 0.53 -2.30 0.10 0.00 0.00 178.00 176.97 2j48 n PRO 682 N -5.33 0.00 -1.94 1.05 -0.02 -1.26 -4.66 135.00 122.84 2j48 n PRO 682 Ca 0.03 0.14 -0.02 0.00 -2.02 0.00 0.00 63.50 61.63 2j48 n PRO 682 Cb 0.24 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 2j48 n PRO 682 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2j48 n ASP 683 N -1.15 -3.86 -4.77 2.55 2.03 -0.76 -4.96 116.55 105.62 2j48 n ASP 683 Ca 0.00 0.13 -0.41 0.00 0.52 0.00 0.00 54.79 55.03 2j48 n ASP 683 Cb 0.53 -2.38 -0.00 0.00 -0.72 0.00 0.00 41.12 38.55 2j48 n ASP 683 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2j48 s GLN 684 N -1.78 4.11 0.49 -0.67 0.74 -1.25 -4.88 119.66 116.41 2j48 s GLN 684 Ca 0.06 2.58 0.17 0.00 0.05 0.00 0.00 55.36 58.22 2j48 s GLN 684 Cb -0.02 -2.98 1.17 0.00 1.10 0.00 0.00 33.01 32.29 2j48 s GLN 684 CO 0.24 -0.57 2.07 0.77 -0.55 0.00 0.00 175.29 177.25 2j48 h SER 685 N 3.45 0.00 0.00 6.67 0.02 -1.92 -0.88 113.55 120.89 2j48 h SER 685 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 2j48 h SER 685 Cb 1.23 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2j48 h SER 685 CO 0.68 0.11 0.23 0.00 -1.14 0.00 0.00 176.83 176.70 2j48 h LEU 687 N 0.00 0.27 -0.76 0.00 3.38 -1.52 -1.60 115.31 115.07 2j48 h LEU 687 Ca 0.00 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 2j48 h LEU 687 Cb 0.45 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 2j48 h LEU 687 CO 0.00 0.33 0.20 -0.07 0.09 0.00 0.00 178.44 178.99 2j48 h LEU 688 N 0.29 1.07 -0.59 1.67 3.38 -0.57 -2.21 115.31 118.34 2j48 h LEU 688 Ca 0.07 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2j48 h LEU 688 Cb 0.21 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.66 2j48 h LEU 688 CO 0.01 1.01 0.38 0.25 0.09 0.00 0.00 178.44 180.17 2j48 h LEU 689 N 1.08 0.68 -1.05 1.67 7.12 -1.44 -2.20 115.31 121.17 2j48 h LEU 689 Ca 0.23 -0.03 0.03 0.00 0.13 0.00 0.00 57.88 58.24 2j48 h LEU 689 Cb 0.34 -0.17 -0.05 0.00 -0.53 0.00 0.00 40.66 40.25 2j48 h LEU 689 CO -0.00 0.51 0.64 0.25 -0.13 0.00 0.00 178.44 179.70 2j48 h LEU 690 N 0.79 1.08 -1.07 2.25 5.85 -1.02 -1.53 115.31 121.65 2j48 h LEU 690 Ca 0.21 -0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.92 2j48 h LEU 690 Cb -0.07 -0.26 -0.05 0.00 0.37 0.00 0.00 40.66 40.65 2j48 h LEU 690 CO -0.04 0.76 0.60 1.56 -0.34 0.00 0.00 178.44 180.97 2j48 h GLN 691 N 1.26 1.22 -0.12 1.25 4.20 -0.81 -2.02 115.11 120.08 2j48 h GLN 691 Ca 0.37 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 59.03 2j48 h GLN 691 Cb -0.06 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.43 2j48 h GLN 691 CO -0.10 0.82 -0.03 1.25 -0.67 0.00 0.00 178.83 180.09 2j48 h HIS 692 N 1.25 -0.07 -0.73 2.96 2.76 -0.89 -1.24 115.15 119.19 2j48 h HIS 692 Ca 0.33 0.01 0.10 0.00 -2.20 0.00 0.00 60.37 58.62 2j48 h HIS 692 Cb -0.12 0.05 -0.05 0.00 1.55 0.00 0.00 27.41 28.84 2j48 h HIS 692 CO 0.00 -0.05 0.48 -0.07 -1.30 0.00 0.00 177.93 176.99 2j48 h LEU 693 N -0.00 0.54 -1.18 0.26 3.38 -1.10 0.25 115.31 117.45 2j48 h LEU 693 Ca 0.06 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 2j48 h LEU 693 Cb 0.09 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 2j48 h LEU 693 CO -0.13 0.31 0.27 0.03 0.09 0.00 0.00 178.44 179.02 2j48 h ARG 694 N 0.59 0.85 -0.18 1.13 2.47 -0.55 1.88 114.38 120.57 2j48 h ARG 694 Ca 0.34 -0.11 -0.11 0.00 -1.26 0.00 0.00 59.98 58.84 2j48 h ARG 694 Cb 0.54 -0.16 -0.01 0.00 -1.65 0.00 0.00 29.97 28.69 2j48 h ARG 694 CO -0.12 0.67 -0.37 0.93 0.56 0.00 0.00 179.97 181.63 2j48 h GLU 695 N 0.84 0.38 -0.26 0.04 4.39 -0.46 -3.04 114.58 116.47 2j48 h GLU 695 Ca 0.21 -0.18 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 2j48 h GLU 695 Cb 0.11 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 28.72 2j48 h GLU 695 CO -0.02 0.70 -0.03 0.72 -1.16 0.00 0.00 179.01 179.22 2j48 n HIS 696 N -4.05 0.87 0.25 4.33 8.25 -0.68 -4.67 115.22 119.53 2j48 n HIS 696 Ca -0.01 -1.16 0.14 0.00 -0.26 0.00 0.00 57.72 56.43 2j48 n HIS 696 Cb 0.47 -0.36 0.74 0.00 1.12 0.00 0.00 29.99 31.96 2j48 n HIS 696 CO 0.00 0.00 0.00 -0.56 0.64 0.00 0.00 176.34 176.42 2j48 h GLN 697 N 1.28 0.00 0.00 -0.41 3.07 0.30 -3.44 115.11 115.90 2j48 h GLN 697 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.82 2j48 h GLN 697 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.02 2j48 h GLN 697 CO 0.25 0.00 0.00 0.00 0.09 0.00 0.00 178.83 179.17 2j48 n ALA 698 N -1.82 0.00 0.00 0.06 0.00 -1.26 -4.45 120.51 113.04 2j48 n ALA 698 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2j48 n ALA 698 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 2j48 n ALA 698 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2j48 n ASP 699 N 0.62 0.00 0.22 0.00 -0.08 -1.26 -4.94 116.55 111.12 2j48 n ASP 699 Ca 0.00 0.00 -0.15 0.00 -1.51 0.00 0.00 54.79 53.13 2j48 n ASP 699 Cb 0.00 0.00 -0.07 0.00 2.34 0.00 0.00 41.12 43.39 2j48 n ASP 699 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2j48 h PRO 700 N 0.00 -0.66 -2.03 -0.67 0.11 -2.01 -3.36 132.00 123.39 2j48 h PRO 700 Ca 0.00 0.04 -0.55 0.00 0.11 0.00 0.00 66.00 65.60 2j48 h PRO 700 Cb 0.00 0.15 -0.40 0.00 0.11 0.00 0.00 31.00 30.86 2j48 h PRO 700 CO 0.00 -0.44 -1.06 1.58 -0.21 0.00 0.00 178.00 177.88 2j48 n HIS 701 N -5.43 0.27 -2.07 0.65 -0.00 -1.26 -5.12 115.22 102.25 2j48 n HIS 701 Ca -0.10 -3.68 -0.39 0.00 -0.00 0.00 0.00 57.72 53.56 2j48 n HIS 701 Cb 0.34 -0.39 0.00 0.00 -0.00 0.00 0.00 29.99 29.94 2j48 n HIS 701 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.34 175.09 2j48 s PRO 702 N -1.57 3.80 0.91 1.57 0.04 -1.26 -5.00 135.00 133.48 2j48 s PRO 702 Ca 0.37 2.07 -0.10 0.00 0.04 0.00 0.00 61.00 63.37 2j48 s PRO 702 Cb 0.20 -2.60 0.14 0.00 0.04 0.00 0.00 34.50 32.28 2j48 s PRO 702 CO -0.10 -0.60 1.12 -1.25 0.04 0.00 0.00 177.00 176.21 2j48 s PRO 703 N -2.44 1.11 -0.08 0.56 0.04 -1.26 -4.95 135.00 127.98 2j48 s PRO 703 Ca 0.61 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.71 2j48 s PRO 703 Cb -0.36 -1.75 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 2j48 s PRO 703 CO 0.45 -2.50 1.15 -1.17 0.04 0.00 0.00 177.00 174.97 2j48 s LEU 704 N -6.50 4.26 -0.07 -3.56 2.96 -1.24 -4.91 118.68 109.62 2j48 s LEU 704 Ca 0.65 1.73 0.04 0.00 -0.22 0.00 0.00 54.13 56.34 2j48 s LEU 704 Cb -0.21 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 42.92 2j48 s LEU 704 CO 0.58 -0.56 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.15 2j48 s VAL 705 N 2.25 1.79 0.05 1.68 1.01 -1.26 -2.30 120.40 123.62 2j48 s VAL 705 Ca 0.54 -0.89 0.07 0.00 0.00 0.00 0.00 61.98 61.70 2j48 s VAL 705 Cb -0.23 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 2j48 s VAL 705 CO 0.20 0.50 -0.20 -0.76 0.00 0.00 0.00 175.10 174.84 2j48 s LEU 706 N 0.22 2.19 -0.22 3.92 1.02 -1.08 0.18 118.68 124.91 2j48 s LEU 706 Ca -0.12 -0.54 -0.07 0.00 0.02 0.00 0.00 54.13 53.42 2j48 s LEU 706 Cb -0.15 -0.94 -0.03 0.00 0.02 0.00 0.00 46.19 45.09 2j48 s LEU 706 CO 0.06 0.14 0.05 -0.36 0.02 0.00 0.00 176.35 176.25 2j48 s PHE 707 N -0.86 3.10 0.14 0.29 0.40 -0.95 -2.54 117.98 117.56 2j48 s PHE 707 Ca 0.07 -0.32 -0.03 0.00 -0.60 0.00 0.00 56.93 56.05 2j48 s PHE 707 Cb -0.09 -2.16 -0.05 0.00 0.51 0.00 0.00 43.02 41.23 2j48 s PHE 707 CO 0.02 -0.22 0.34 -0.51 0.70 0.00 0.00 175.22 175.55 2j48 s LEU 708 N 1.19 4.28 0.00 -0.37 1.43 -1.02 0.52 118.68 124.71 2j48 s LEU 708 Ca 0.04 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 2j48 s LEU 708 Cb -0.14 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 42.87 2j48 s LEU 708 CO 0.03 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.28 2j48 n GLY 709 N -0.01 1.36 3.90 -3.19 0.00 -1.21 -1.62 105.19 104.43 2j48 n GLY 709 Ca -0.03 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 44.97 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 3.64 0.67 1.61 2.02 -1.26 -3.68 118.70 121.71 2j48 s GLU 710 Ca 0.00 0.13 -0.14 0.00 0.02 0.00 0.00 54.97 54.98 2j48 s GLU 710 Cb 0.00 -2.54 0.01 0.00 0.10 0.00 0.00 34.13 31.70 2j48 s GLU 710 CO 0.00 0.07 1.09 -1.25 0.02 0.00 0.00 175.26 175.19 2j48 s PRO 711 N -3.90 2.80 0.00 0.39 0.04 -1.26 -4.46 135.00 128.60 2j48 s PRO 711 Ca 0.46 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.77 2j48 s PRO 711 Cb -0.10 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2j48 s PRO 711 CO 0.33 -1.24 0.00 -0.35 0.04 0.00 0.00 177.00 175.79 2j48 n PRO 712 N -2.63 1.90 0.04 0.56 -0.04 -1.26 -5.04 135.00 128.53 2j48 n PRO 712 Ca 0.10 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 2j48 n PRO 712 Cb 0.52 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.98 2j48 n PRO 712 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2j48 n VAL 713 N -0.21 0.00 -2.33 0.52 0.31 -1.26 -5.10 118.33 110.26 2j48 n VAL 713 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.95 2j48 n VAL 713 Cb 0.00 -0.37 -0.02 0.00 -0.91 0.00 0.00 33.84 32.54 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 -4.23 6.46 0.42 4.52 1.01 -1.26 -4.92 116.67 118.66 2j48 s ASP 714 Ca 0.00 2.28 0.29 0.00 0.71 0.00 0.00 52.55 55.83 2j48 s ASP 714 Cb 0.00 -2.61 1.18 0.00 1.01 0.00 0.00 42.92 42.50 2j48 s ASP 714 CO 0.00 -0.71 1.86 1.55 0.21 0.00 0.00 175.17 178.08 2j48 h PRO 715 N 2.44 0.00 -0.18 8.23 0.13 -1.99 -2.94 132.00 137.70 2j48 h PRO 715 Ca -0.49 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 2j48 h PRO 715 Cb 1.23 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 2j48 h PRO 715 CO 0.62 0.00 -0.48 1.25 -0.23 0.00 0.00 178.00 179.16 2j48 h LEU 716 N 0.00 0.50 -0.05 1.56 5.85 -1.99 0.60 115.31 121.79 2j48 h LEU 716 Ca 0.00 -0.24 -0.25 0.00 0.84 0.00 0.00 57.88 58.22 2j48 h LEU 716 Cb 0.46 -0.14 0.01 0.00 0.37 0.00 0.00 40.66 41.37 2j48 h LEU 716 CO 0.00 0.90 -1.04 -0.07 -0.34 0.00 0.00 178.44 177.89 2j48 h LEU 717 N 0.37 0.72 -0.46 2.25 3.38 -1.92 -1.98 115.31 117.68 2j48 h LEU 717 Ca 0.02 -0.60 -0.06 0.00 0.09 0.00 0.00 57.88 57.33 2j48 h LEU 717 Cb 0.97 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2j48 h LEU 717 CO 0.09 1.41 0.04 0.74 0.09 0.00 0.00 178.44 180.80 2j48 h THR 718 N 0.29 1.25 -0.58 0.22 2.02 -1.47 0.75 112.91 115.39 2j48 h THR 718 Ca -0.12 -0.97 -0.08 0.00 0.77 0.00 0.00 66.41 66.01 2j48 h THR 718 Cb 1.69 0.99 -0.02 0.00 -1.74 0.00 0.00 68.15 69.07 2j48 h THR 718 CO 0.19 0.34 0.06 0.00 0.37 0.00 0.00 175.52 176.48 2j48 h ALA 719 N 0.93 0.77 0.00 6.16 0.00 -0.91 -2.70 119.26 123.53 2j48 h ALA 719 Ca 0.13 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.71 2j48 h ALA 719 Cb 0.44 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2j48 h ALA 719 CO 0.02 0.56 -0.27 0.37 0.00 0.00 0.00 179.25 179.92 2j48 h GLN 720 N 0.88 0.00 -6.80 0.00 4.15 -1.19 -3.45 115.11 108.70 2j48 h GLN 720 Ca 0.17 0.00 -0.51 0.00 0.77 0.00 0.00 58.65 59.08 2j48 h GLN 720 Cb 0.47 0.00 0.03 0.00 0.21 0.00 0.00 27.48 28.19 2j48 h GLN 720 CO 0.02 0.27 0.51 0.00 -1.93 0.00 0.00 178.83 177.70 2j48 s ALA 721 N -3.17 3.43 0.01 3.38 0.00 0.26 -4.60 121.76 121.06 2j48 s ALA 721 Ca 0.04 0.96 0.10 0.00 0.00 0.00 0.00 51.96 53.07 2j48 s ALA 721 Cb 0.07 -3.36 -0.23 0.00 0.00 0.00 0.00 23.12 19.60 2j48 s ALA 721 CO 0.70 -0.26 0.86 1.03 0.00 0.00 0.00 175.76 178.08 2j48 h SER 722 N 3.90 0.02 -1.60 0.00 0.87 0.17 -3.47 113.55 113.43 2j48 h SER 722 Ca -0.47 -0.03 0.16 0.00 -1.23 0.00 0.00 61.79 60.22 2j48 h SER 722 Cb 1.21 -0.00 -0.26 0.00 -0.44 0.00 0.00 62.40 62.91 2j48 h SER 722 CO 0.67 1.02 0.32 0.00 -0.53 0.00 0.00 176.83 178.32 2j48 s ALA 723 N -2.63 -2.57 -0.18 6.23 0.00 -1.00 -4.98 121.76 116.63 2j48 s ALA 723 Ca -0.03 2.10 -0.19 0.00 0.00 0.00 0.00 51.96 53.84 2j48 s ALA 723 Cb 0.09 -1.93 -0.03 0.00 0.00 0.00 0.00 23.12 21.24 2j48 s ALA 723 CO 0.82 -0.70 0.52 0.42 0.00 0.00 0.00 175.76 176.83 2j48 s ILE 724 N 1.95 5.12 0.05 0.00 1.01 -1.26 -2.25 121.20 125.81 2j48 s ILE 724 Ca -0.05 0.98 0.03 0.00 0.00 0.00 0.00 60.65 61.61 2j48 s ILE 724 Cb -0.05 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 2j48 s ILE 724 CO -0.16 0.21 0.03 -0.76 0.00 0.00 0.00 174.94 174.25 2j48 s LEU 725 N 1.41 3.61 0.00 2.97 1.02 0.18 -4.90 118.68 122.97 2j48 s LEU 725 Ca 0.25 -0.05 0.00 0.00 0.02 0.00 0.00 54.13 54.35 2j48 s LEU 725 Cb -0.15 -2.22 0.00 0.00 0.02 0.00 0.00 46.19 43.83 2j48 s LEU 725 CO 0.10 0.22 0.00 -1.20 0.02 0.00 0.00 176.35 175.49 2j48 n SER 726 N 0.85 0.00 -3.55 2.29 7.64 -1.24 -3.30 113.62 116.31 2j48 n SER 726 Ca -0.12 -0.43 -0.27 0.00 1.01 0.00 0.00 58.87 59.06 2j48 n SER 726 Cb 0.52 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.62 2j48 n SER 726 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 2j48 n LYS 727 N 0.00 0.77 -1.58 1.43 3.00 -1.26 -4.92 118.16 115.60 2j48 n LYS 727 Ca 0.00 -3.62 -0.44 0.00 -0.00 0.00 0.00 58.31 54.25 2j48 n LYS 727 Cb 0.11 -1.87 -0.01 0.00 0.00 0.00 0.00 35.03 33.26 2j48 n LYS 727 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 2j48 n PRO 728 N 2.49 1.28 -3.16 1.64 -0.02 -1.26 -4.99 135.00 130.97 2j48 n PRO 728 Ca 0.27 0.45 0.05 0.00 -2.02 0.00 0.00 63.50 62.24 2j48 n PRO 728 Cb 0.44 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.04 2j48 n PRO 728 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2j48 s LEU 729 N 0.41 -0.06 0.20 2.45 0.20 -1.26 -5.12 118.68 115.50 2j48 s LEU 729 Ca 0.60 0.06 0.00 0.00 0.69 0.00 0.00 54.13 55.48 2j48 s LEU 729 Cb -0.67 1.06 0.00 0.00 -0.43 0.00 0.00 46.19 46.14 2j48 s LEU 729 CO 0.59 -0.01 0.00 -0.67 -0.29 0.00 0.00 176.35 175.97 2j48 n ASP 730 N 4.87 -7.67 0.05 3.68 -0.08 -1.26 -4.48 116.55 111.66 2j48 n ASP 730 Ca -0.07 1.36 0.09 0.00 -1.51 0.00 0.00 54.79 54.65 2j48 n ASP 730 Cb 0.55 -4.59 0.39 0.00 2.34 0.00 0.00 41.12 39.81 2j48 n ASP 730 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2j48 n PRO 731 N 1.75 0.08 0.18 -0.67 -0.04 -1.26 -2.51 135.00 132.52 2j48 n PRO 731 Ca 0.00 0.31 0.04 0.00 -0.04 0.00 0.00 63.50 63.81 2j48 n PRO 731 Cb 0.00 -1.65 0.31 0.00 -0.04 0.00 0.00 33.50 32.13 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 -0.02 0.54 1.08 -1.99 -2.75 115.11 111.97 2j48 h GLN 732 Ca 0.00 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 2j48 h GLN 732 Cb 0.30 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.73 2j48 h GLN 732 CO 0.00 0.43 0.00 1.25 -0.95 0.00 0.00 178.83 179.56 2j48 h LEU 733 N 0.00 0.03 -0.73 1.46 5.85 -1.71 0.62 115.31 120.82 2j48 h LEU 733 Ca -0.00 -0.31 0.03 0.00 0.84 0.00 0.00 57.88 58.44 2j48 h LEU 733 Cb 0.90 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.88 2j48 h LEU 733 CO 0.06 0.33 0.47 -0.07 -0.34 0.00 0.00 178.44 178.88 2j48 h LEU 734 N -0.27 0.77 -0.80 2.25 4.07 -1.71 -1.38 115.31 118.24 2j48 h LEU 734 Ca 0.00 -0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.93 2j48 h LEU 734 Cb 0.31 -0.17 -0.04 0.00 1.08 0.00 0.00 40.66 41.84 2j48 h LEU 734 CO 0.00 0.54 0.38 0.25 -1.08 0.00 0.00 178.44 178.53 2j48 h LEU 735 N 0.92 1.04 -1.01 1.67 5.85 -1.36 -2.35 115.31 120.07 2j48 h LEU 735 Ca 0.29 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.88 2j48 h LEU 735 Cb -0.00 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.71 2j48 h LEU 735 CO -0.10 0.88 0.59 0.74 -0.34 0.00 0.00 178.44 180.21 2j48 h THR 736 N 1.13 1.25 -0.53 1.05 2.02 -0.01 -0.83 112.91 116.98 2j48 h THR 736 Ca 0.27 -0.51 -0.01 0.00 0.77 0.00 0.00 66.41 66.93 2j48 h THR 736 Cb 0.12 -0.10 -0.03 0.00 -1.74 0.00 0.00 68.15 66.40 2j48 h THR 736 CO -0.03 0.26 0.30 0.74 0.37 0.00 0.00 175.52 177.15 2j48 h THR 737 N 1.29 1.18 -0.48 3.16 2.02 -0.76 -0.58 112.91 118.73 2j48 h THR 737 Ca 0.34 -0.44 -0.08 0.00 0.77 0.00 0.00 66.41 67.00 2j48 h THR 737 Cb -0.09 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.80 2j48 h THR 737 CO -0.07 0.19 -0.03 -0.07 0.37 0.00 0.00 175.52 175.92 2j48 h LEU 738 N 0.71 0.79 -1.51 2.58 3.38 -1.08 -2.18 115.31 118.01 2j48 h LEU 738 Ca 0.19 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2j48 h LEU 738 Cb 0.04 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2j48 h LEU 738 CO -0.03 0.87 -0.21 -0.61 0.09 0.00 0.00 178.44 178.55 2j48 h GLN 739 N 0.76 0.05 0.00 1.13 4.15 -0.62 -2.90 115.11 117.68 2j48 h GLN 739 Ca 0.14 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.55 2j48 h GLN 739 Cb 0.49 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.18 2j48 h GLN 739 CO 0.02 0.26 0.26 0.41 -1.93 0.00 0.00 178.83 177.86 2j48 n GLY 740 N -0.87 -0.06 0.15 2.39 0.00 -0.28 0.62 105.19 107.14 2j48 n GLY 740 Ca -0.02 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 2j48 n GLY 740 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2j48 h LEU 741 N 0.00 0.70 -3.04 0.99 3.38 -1.71 -3.48 115.31 112.14 2j48 h LEU 741 Ca 0.00 -0.83 -0.48 0.00 0.09 0.00 0.00 57.88 56.66 2j48 h LEU 741 Cb 0.52 -0.22 0.03 0.00 0.09 0.00 0.00 40.66 41.09 2j48 h LEU 741 CO 0.00 1.45 -0.94 0.00 0.09 0.00 0.00 178.44 179.04 2j48 s PRO 743 N -6.40 4.03 0.06 0.00 0.04 -1.26 -5.03 135.00 126.45 2j48 s PRO 743 Ca 0.37 0.91 -0.25 0.00 0.04 0.00 0.00 61.00 62.08 2j48 s PRO 743 Cb -0.15 -3.73 -0.06 0.00 0.04 0.00 0.00 34.50 30.60 2j48 s PRO 743 CO 0.89 -0.82 0.75 -1.25 0.04 0.00 0.00 177.00 176.61 2j48 s PRO 744 N 3.40 4.49 0.00 0.56 0.04 -1.26 -5.05 135.00 137.18 2j48 s PRO 744 Ca 0.41 1.05 0.28 0.00 0.04 0.00 0.00 61.00 62.78 2j48 s PRO 744 Cb -0.13 -3.34 1.04 0.00 0.04 0.00 0.00 34.50 32.11 2j48 s PRO 744 CO 0.14 0.35 1.74 0.09 0.04 0.00 0.00 177.00 179.36