#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a0b h SER 659 N 0.00 -0.47 -0.36 3.14 4.64 -1.96 -2.61 113.55 115.93 1a0b h SER 659 Ca 0.00 -0.06 0.10 0.00 -0.47 0.00 0.00 61.79 61.36 1a0b h SER 659 Cb 0.00 0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1a0b h SER 659 CO 0.00 -0.03 0.39 -0.33 -0.87 0.00 0.00 176.83 175.99 1a0b h GLU 660 N -1.08 0.00 0.05 4.77 5.08 -2.03 -0.64 114.58 120.73 1a0b h GLU 660 Ca -0.06 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.97 1a0b h GLU 660 Cb 0.50 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.71 1a0b h GLU 660 CO 0.09 0.00 -1.93 0.00 -1.00 0.00 0.00 179.01 176.18 1a0b n ALA 661 N -2.34 1.25 0.02 3.43 0.00 -1.24 -4.44 120.51 117.19 1a0b n ALA 661 Ca 0.06 -0.76 0.10 0.00 0.00 0.00 0.00 53.44 52.83 1a0b n ALA 661 Cb 0.55 -0.68 -0.11 0.00 0.00 0.00 0.00 19.45 19.21 1a0b n ALA 661 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1a0b n LEU 662 N -3.21 0.32 -4.47 0.00 4.77 -0.99 -4.24 117.00 109.18 1a0b n LEU 662 Ca -0.26 0.13 -0.27 0.00 -0.03 0.00 0.00 56.01 55.58 1a0b n LEU 662 Cb 1.06 0.01 -0.11 0.00 -2.33 0.00 0.00 43.42 42.04 1a0b n LEU 662 CO 0.43 -0.03 -0.49 -0.76 -1.33 0.00 0.00 177.39 175.20 1a0b s LEU 663 N -4.90 2.61 -1.17 2.23 1.43 -0.27 -1.49 118.68 117.11 1a0b s LEU 663 Ca -0.05 -0.76 -0.09 0.00 -1.03 0.00 0.00 54.13 52.19 1a0b s LEU 663 Cb 0.12 -1.33 0.23 0.00 0.03 0.00 0.00 46.19 45.24 1a0b s LEU 663 CO 0.86 0.12 1.44 -0.67 0.23 0.00 0.00 176.35 178.34 1a0b n ASP 664 N 0.23 5.54 -0.19 2.29 -0.08 -0.50 -4.59 116.55 119.25 1a0b n ASP 664 Ca -0.12 -3.11 -0.07 0.00 -1.51 0.00 0.00 54.79 49.98 1a0b n ASP 664 Cb 0.56 -1.43 -0.01 0.00 2.34 0.00 0.00 41.12 42.57 1a0b n ASP 664 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1a0b h ILE 665 N 3.91 0.14 -0.78 5.18 1.08 -1.87 -1.73 117.51 123.46 1a0b h ILE 665 Ca 0.27 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.83 1a0b h ILE 665 Cb 0.77 0.14 -0.07 0.00 -3.07 0.00 0.00 36.82 34.59 1a0b h ILE 665 CO 1.28 0.00 0.43 -0.65 -0.69 0.00 0.00 178.15 178.52 1a0b h PRO 666 N -0.20 0.72 -0.51 2.37 0.11 -1.99 0.10 132.00 132.59 1a0b h PRO 666 Ca 0.21 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.21 1a0b h PRO 666 Cb 0.56 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 31.49 1a0b h PRO 666 CO -0.67 0.47 0.07 1.98 -0.21 0.00 0.00 178.00 179.65 1a0b h MET 667 N 0.74 0.85 -0.38 1.05 1.85 -1.91 -2.16 114.93 114.97 1a0b h MET 667 Ca 0.37 -0.24 -0.03 0.00 -0.61 0.00 0.00 59.70 59.20 1a0b h MET 667 Cb 0.33 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.25 1a0b h MET 667 CO -0.24 0.85 0.13 -0.07 -0.40 0.00 0.00 176.91 177.18 1a0b h LEU 668 N 0.73 0.55 -1.07 3.39 3.38 -0.50 -1.49 115.31 120.31 1a0b h LEU 668 Ca 0.15 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1a0b h LEU 668 Cb 0.42 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1a0b h LEU 668 CO 0.01 0.60 0.08 -0.33 0.09 0.00 0.00 178.44 178.89 1a0b h GLU 669 N 0.47 0.74 -0.28 1.13 5.08 -0.79 -1.19 114.58 119.73 1a0b h GLU 669 Ca 0.12 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.30 1a0b h GLU 669 Cb 0.24 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1a0b h GLU 669 CO -0.01 0.70 0.08 0.37 -1.00 0.00 0.00 179.01 179.15 1a0b h GLN 670 N 0.71 0.44 -0.49 2.33 4.15 -1.20 -2.77 115.11 118.28 1a0b h GLN 670 Ca 0.15 -0.10 -0.04 0.00 0.77 0.00 0.00 58.65 59.44 1a0b h GLN 670 Cb 0.33 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 27.93 1a0b h GLN 670 CO 0.00 0.52 0.16 1.88 -1.93 0.00 0.00 178.83 179.46 1a0b h TYR 671 N 0.29 0.73 -0.83 3.99 -1.99 -0.81 0.95 116.97 119.30 1a0b h TYR 671 Ca 0.09 -0.05 0.02 0.00 2.00 0.00 0.00 58.73 60.79 1a0b h TYR 671 Cb 0.27 -0.22 -0.04 0.00 2.00 0.00 0.00 36.73 38.73 1a0b h TYR 671 CO 0.01 0.59 0.55 -0.07 -0.00 0.00 0.00 178.16 179.24 1a0b h LEU 672 N 0.71 0.93 -0.01 3.88 3.38 -1.02 0.30 115.31 123.48 1a0b h LEU 672 Ca 0.17 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.95 1a0b h LEU 672 Cb 0.20 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.74 1a0b h LEU 672 CO -0.01 0.66 -0.65 -0.33 0.09 0.00 0.00 178.44 178.20 1a0b h GLU 673 N 1.10 0.46 0.02 1.13 4.39 -1.14 -1.49 114.58 119.05 1a0b h GLU 673 Ca 0.32 -0.48 -0.21 0.00 0.34 0.00 0.00 59.36 59.32 1a0b h GLU 673 Cb -0.08 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1a0b h GLU 673 CO -0.08 1.13 -0.94 -0.07 -1.16 0.00 0.00 179.01 177.89 1a0b h LEU 674 N -0.02 0.33 0.00 1.33 3.38 -0.76 -3.41 115.31 116.16 1a0b h LEU 674 Ca -0.08 -0.28 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1a0b h LEU 674 Cb 1.35 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 42.00 1a0b h LEU 674 CO 0.13 1.10 -0.90 0.52 0.09 0.00 0.00 178.44 179.39 1a0b n VAL 675 N -3.65 0.00 0.00 1.22 0.31 0.96 -5.06 118.33 112.10 1a0b n VAL 675 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.28 1a0b n VAL 675 Cb 0.84 -0.65 0.00 0.00 -0.91 0.00 0.00 33.84 33.12 1a0b n VAL 675 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1a0b n GLY 676 N 3.04 1.96 0.18 2.92 0.00 -0.56 -4.84 105.19 107.89 1a0b n GLY 676 Ca 0.00 -1.99 0.05 0.00 0.00 0.00 0.00 46.02 44.08 1a0b n GLY 676 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1a0b h PRO 677 N 0.00 0.00 -0.07 1.61 0.13 -1.86 -3.36 132.00 128.46 1a0b h PRO 677 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 1a0b h PRO 677 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 1a0b h PRO 677 CO 0.00 0.40 -0.09 -0.22 -0.23 0.00 0.00 178.00 177.87 1a0b h LYS 678 N 0.00 -0.11 0.00 0.86 3.11 -1.98 0.20 116.57 118.64 1a0b h LYS 678 Ca -0.00 0.01 -0.02 0.00 -2.81 0.00 0.00 60.65 57.82 1a0b h LYS 678 Cb 0.97 0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 32.22 1a0b h LYS 678 CO 0.05 -0.08 -0.12 1.25 -2.81 0.00 0.00 179.45 177.75 1a0b h LEU 679 N -0.12 0.00 0.07 5.20 5.85 -1.89 0.40 115.31 124.82 1a0b h LEU 679 Ca 0.06 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1a0b h LEU 679 Cb 0.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.23 1a0b h LEU 679 CO -0.14 0.12 -0.03 0.40 -0.34 0.00 0.00 178.44 178.45 1a0b h ILE 680 N 0.00 1.24 0.00 4.05 2.04 -1.43 -1.37 117.51 122.03 1a0b h ILE 680 Ca -0.00 -1.38 -0.02 0.00 1.00 0.00 0.00 64.86 64.46 1a0b h ILE 680 Cb 0.31 2.09 -0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1a0b h ILE 680 CO 0.02 0.33 -0.08 0.71 0.00 0.00 0.00 178.15 179.12 1a0b h THR 681 N -0.75 1.05 -0.22 -0.27 1.35 -0.10 0.79 112.91 114.76 1a0b h THR 681 Ca -0.01 -0.27 -0.07 0.00 -0.55 0.00 0.00 66.41 65.51 1a0b h THR 681 Cb 0.60 1.15 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1a0b h THR 681 CO 0.01 0.08 -0.13 0.44 -0.25 0.00 0.00 175.52 175.67 1a0b h ASP 682 N 0.00 0.50 -0.01 5.36 5.19 -0.18 -1.60 116.42 125.66 1a0b h ASP 682 Ca -0.00 -0.43 -0.00 0.00 -0.62 0.00 0.00 57.03 55.98 1a0b h ASP 682 Cb 0.14 -0.14 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1a0b h ASP 682 CO 0.01 0.82 0.01 1.23 -3.12 0.00 0.00 179.24 178.18 1a0b h GLY 683 N 0.18 0.02 -0.19 2.75 0.00 -0.22 -2.47 103.07 103.14 1a0b h GLY 683 Ca 0.05 -0.01 0.11 0.00 0.00 0.00 0.00 47.33 47.47 1a0b h GLY 683 CO 0.04 0.01 -0.20 -2.00 0.00 0.00 0.00 176.54 174.39 1a0b h LEU 684 N -0.11 -0.71 -1.35 3.11 5.85 -0.85 0.48 115.31 121.74 1a0b h LEU 684 Ca 0.00 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.94 1a0b h LEU 684 Cb 0.13 0.41 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1a0b h LEU 684 CO -0.00 -0.23 0.47 0.00 -0.34 0.00 0.00 178.44 178.33 1a0b h ALA 685 N 1.35 1.60 -0.03 1.25 0.00 -1.17 0.37 119.26 122.64 1a0b h ALA 685 Ca 0.25 -0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.93 1a0b h ALA 685 Cb 0.46 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1a0b h ALA 685 CO -0.59 0.32 -0.84 0.28 0.00 0.00 0.00 179.25 178.42 1a0b h VAL 686 N 0.85 1.42 -0.14 0.00 2.07 0.12 -2.87 116.25 117.70 1a0b h VAL 686 Ca 0.28 -2.38 -0.01 0.00 0.82 0.00 0.00 66.70 65.41 1a0b h VAL 686 Cb 0.07 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.16 1a0b h VAL 686 CO -0.08 0.71 0.03 0.15 0.02 0.00 0.00 177.57 178.39 1a0b h PHE 687 N 0.21 0.23 -0.60 1.57 3.57 0.12 -2.54 116.94 119.50 1a0b h PHE 687 Ca -0.05 -0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.47 1a0b h PHE 687 Cb 1.45 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 40.09 1a0b h PHE 687 CO 0.04 0.39 0.40 1.49 -2.23 0.00 0.00 178.31 178.40 1a0b h GLU 688 N 0.01 0.61 0.00 1.11 4.81 -0.31 -1.38 114.58 119.43 1a0b h GLU 688 Ca 0.04 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1a0b h GLU 688 Cb 0.28 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1a0b h GLU 688 CO 0.00 0.40 -0.38 1.57 -0.73 0.00 0.00 179.01 179.87 1a0b h LYS 689 N 0.63 0.00 0.00 1.92 2.10 -1.35 -3.34 116.57 116.53 1a0b h LYS 689 Ca 0.25 0.00 -0.26 0.00 -2.00 0.00 0.00 60.65 58.65 1a0b h LYS 689 Cb 0.20 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.49 1a0b h LYS 689 CO -0.07 0.02 -1.64 -1.33 -2.00 0.00 0.00 179.45 174.44 1a0b n MET 690 N -2.96 0.63 -0.26 0.07 2.81 -0.88 -4.47 117.12 112.07 1a0b n MET 690 Ca 0.02 0.27 0.05 0.00 -1.81 0.00 0.00 57.70 56.23 1a0b n MET 690 Cb 0.55 -1.79 0.18 0.00 -0.71 0.00 0.00 33.22 31.45 1a0b n MET 690 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1a0b h MET 691 N 0.00 0.43 -0.59 0.03 2.86 -1.39 -2.63 114.93 113.63 1a0b h MET 691 Ca -0.25 -0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.46 1a0b h MET 691 Cb 1.89 -0.10 -0.08 0.00 0.06 0.00 0.00 31.60 33.37 1a0b h MET 691 CO 0.07 0.28 0.17 -1.35 1.06 0.00 0.00 176.91 177.14 1a0b h PRO 692 N 0.44 0.32 0.00 -0.22 0.11 -1.78 -0.30 132.00 130.57 1a0b h PRO 692 Ca 0.41 -0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.44 1a0b h PRO 692 Cb 0.62 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.65 1a0b h PRO 692 CO -0.40 0.21 -0.27 0.78 -0.21 0.00 0.00 178.00 178.11 1a0b h GLY 693 N 0.33 0.00 0.54 -0.55 0.00 -1.76 -2.42 103.07 99.21 1a0b h GLY 693 Ca 0.30 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.55 1a0b h GLY 693 CO -0.35 0.00 -0.31 -0.97 0.00 0.00 0.00 176.54 174.91 1a0b h TYR 694 N 0.00 0.33 -0.54 5.60 0.05 -1.03 -2.72 116.97 118.66 1a0b h TYR 694 Ca -0.00 -0.17 0.00 0.00 0.05 0.00 0.00 58.73 58.61 1a0b h TYR 694 Cb 0.79 -0.04 -0.03 0.00 1.01 0.00 0.00 36.73 38.46 1a0b h TYR 694 CO 0.00 0.96 0.35 0.28 -1.05 0.00 0.00 178.16 178.70 1a0b h VAL 695 N -0.39 1.15 -0.32 -2.88 2.07 -1.08 -1.71 116.25 113.08 1a0b h VAL 695 Ca -0.04 -0.29 0.07 0.00 0.82 0.00 0.00 66.70 67.26 1a0b h VAL 695 Cb 1.04 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 1a0b h VAL 695 CO 0.06 0.15 -0.12 0.28 0.02 0.00 0.00 177.57 177.96 1a0b h SER 696 N 0.73 -0.42 -0.80 0.57 0.02 -1.50 0.16 113.55 112.31 1a0b h SER 696 Ca 0.20 0.11 0.04 0.00 -0.84 0.00 0.00 61.79 61.30 1a0b h SER 696 Cb -0.06 0.25 -0.05 0.00 0.14 0.00 0.00 62.40 62.68 1a0b h SER 696 CO -0.04 -0.15 0.50 0.58 -1.14 0.00 0.00 176.83 176.57 1a0b h VAL 697 N -0.06 1.08 -0.16 2.27 2.07 -1.12 0.14 116.25 120.47 1a0b h VAL 697 Ca 0.16 -0.32 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 1a0b h VAL 697 Cb 0.30 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 1a0b h VAL 697 CO -0.37 0.17 0.07 -0.07 0.02 0.00 0.00 177.57 177.40 1a0b h LEU 698 N 0.94 0.22 -0.76 2.57 3.38 -0.37 0.94 115.31 122.23 1a0b h LEU 698 Ca 0.33 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 58.25 1a0b h LEU 698 Cb 0.08 -0.06 -0.07 0.00 0.09 0.00 0.00 40.66 40.70 1a0b h LEU 698 CO -0.14 0.31 0.41 -0.33 0.09 0.00 0.00 178.44 178.78 1a0b h GLU 699 N 0.12 0.67 -0.10 1.13 4.39 -0.11 0.07 114.58 120.75 1a0b h GLU 699 Ca 0.05 -0.04 -0.20 0.00 0.34 0.00 0.00 59.36 59.52 1a0b h GLU 699 Cb 0.15 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1a0b h GLU 699 CO -0.01 0.44 -0.76 1.03 -1.16 0.00 0.00 179.01 178.56 1a0b h SER 700 N 0.69 0.63 0.38 1.42 0.87 -0.48 -2.60 113.55 114.46 1a0b h SER 700 Ca 0.37 -0.42 -0.11 0.00 -1.23 0.00 0.00 61.79 60.41 1a0b h SER 700 Cb 0.37 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1a0b h SER 700 CO -0.26 1.18 -0.46 0.78 -0.53 0.00 0.00 176.83 177.53 1a0b h ASN 701 N 0.36 0.12 0.41 6.23 2.35 -0.29 -2.73 115.58 122.01 1a0b h ASN 701 Ca -0.04 -0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.64 1a0b h ASN 701 Cb 1.35 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.69 1a0b h ASN 701 CO 0.14 0.57 -0.20 0.25 -1.65 0.00 0.00 177.43 176.54 1a0b h LEU 702 N 0.09 -0.46 -2.04 1.61 6.46 -0.92 0.14 115.31 120.19 1a0b h LEU 702 Ca 0.00 -0.12 0.00 0.00 -0.12 0.00 0.00 57.88 57.65 1a0b h LEU 702 Cb 0.86 0.12 -0.00 0.00 -0.73 0.00 0.00 40.66 40.91 1a0b h LEU 702 CO 0.07 -0.07 0.01 0.71 -0.62 0.00 0.00 178.44 178.54 1a0b h THR 703 N -0.94 0.95 -0.07 1.05 1.35 -1.51 0.66 112.91 114.39 1a0b h THR 703 Ca -0.06 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.80 1a0b h THR 703 Cb 0.55 0.99 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 1a0b h THR 703 CO 0.09 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.36 1a0b n ALA 704 N -2.52 2.57 -3.79 6.62 0.00 -1.03 -4.93 120.51 117.42 1a0b n ALA 704 Ca -0.03 -0.43 -0.27 0.00 0.00 0.00 0.00 53.44 52.71 1a0b n ALA 704 Cb 0.11 -1.18 0.04 0.00 0.00 0.00 0.00 19.45 18.42 1a0b n ALA 704 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1a0b n GLN 705 N 0.06 -6.14 -3.32 0.00 6.02 0.22 -4.92 117.38 109.30 1a0b n GLN 705 Ca 0.18 0.67 -0.46 0.00 -0.01 0.00 0.00 57.00 57.38 1a0b n GLN 705 Cb 0.30 -5.57 -0.01 0.00 1.02 0.00 0.00 30.24 25.98 1a0b n GLN 705 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1a0b s ASP 706 N -3.48 6.97 0.09 1.08 -1.08 0.47 -4.93 116.67 115.78 1a0b s ASP 706 Ca 0.54 -3.01 -0.27 0.00 -0.52 0.00 0.00 52.55 49.29 1a0b s ASP 706 Cb -0.26 -2.22 -0.11 0.00 -1.46 0.00 0.00 42.92 38.87 1a0b s ASP 706 CO 0.80 -0.48 1.43 0.50 0.52 0.00 0.00 175.17 177.94 1a0b h LYS 707 N 7.39 -0.52 -0.97 4.34 3.64 -1.92 0.19 116.57 128.72 1a0b h LYS 707 Ca 0.14 0.04 0.23 0.00 -1.27 0.00 0.00 60.65 59.78 1a0b h LYS 707 Cb 0.98 0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 32.83 1a0b h LYS 707 CO 0.86 -0.35 0.63 0.87 -2.27 0.00 0.00 179.45 179.20 1a0b h LYS 708 N -0.54 0.42 -0.32 1.90 1.57 -1.97 0.13 116.57 117.75 1a0b h LYS 708 Ca 0.01 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.64 1a0b h LYS 708 Cb 0.57 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1a0b h LYS 708 CO -0.27 0.28 -0.28 0.78 -0.57 0.00 0.00 179.45 179.38 1a0b h GLY 709 N 0.43 0.83 0.95 3.86 0.00 -1.59 -1.18 103.07 106.37 1a0b h GLY 709 Ca 0.53 -0.83 -0.01 0.00 0.00 0.00 0.00 47.33 47.02 1a0b h GLY 709 CO -0.24 0.75 0.16 -2.22 0.00 0.00 0.00 176.54 175.00 1a0b h ILE 710 N 0.53 1.14 -0.24 2.60 2.04 0.18 -2.54 117.51 121.22 1a0b h ILE 710 Ca 0.06 -0.39 -0.07 0.00 1.00 0.00 0.00 64.86 65.46 1a0b h ILE 710 Cb 0.85 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 1a0b h ILE 710 CO 0.07 0.15 -0.15 0.58 0.00 0.00 0.00 178.15 178.80 1a0b h VAL 711 N 0.38 1.22 -0.12 1.67 2.07 -0.86 -1.67 116.25 118.94 1a0b h VAL 711 Ca 0.11 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 1a0b h VAL 711 Cb 0.09 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.07 1a0b h VAL 711 CO -0.02 0.32 0.00 -0.33 0.02 0.00 0.00 177.57 177.57 1a0b h GLU 712 N 0.37 0.21 -0.09 1.57 5.08 -1.04 -2.50 114.58 118.18 1a0b h GLU 712 Ca 0.07 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1a0b h GLU 712 Cb 0.49 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 1a0b h GLU 712 CO 0.03 0.45 -0.49 1.49 -1.00 0.00 0.00 179.01 179.50 1a0b h GLU 713 N -0.05 0.23 -0.36 2.33 4.57 -1.34 -2.17 114.58 117.79 1a0b h GLU 713 Ca 0.03 -0.13 -0.09 0.00 -1.18 0.00 0.00 59.36 58.00 1a0b h GLU 713 Cb 0.36 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 1a0b h GLU 713 CO 0.01 0.67 -0.13 0.78 -1.18 0.00 0.00 179.01 179.16 1a0b h GLY 714 N 1.33 0.69 0.95 1.92 0.00 -1.30 -1.04 103.07 105.62 1a0b h GLY 714 Ca 0.01 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 46.73 1a0b h GLY 714 CO 0.08 0.47 -0.21 0.84 0.00 0.00 0.00 176.54 177.71 1a0b h HIS 715 N 0.58 0.80 -0.56 5.60 -0.00 -1.24 0.10 115.15 120.44 1a0b h HIS 715 Ca 0.10 -0.22 -0.02 0.00 -0.00 0.00 0.00 60.37 60.23 1a0b h HIS 715 Cb 0.56 -0.18 -0.03 0.00 -0.00 0.00 0.00 27.41 27.77 1a0b h HIS 715 CO 0.02 0.94 0.27 -0.22 -0.00 0.00 0.00 177.93 178.94 1a0b h LYS 716 N 0.43 0.79 -0.27 5.26 3.64 -1.15 -0.09 116.57 125.19 1a0b h LYS 716 Ca 0.06 -0.11 -0.15 0.00 -1.27 0.00 0.00 60.65 59.18 1a0b h LYS 716 Cb 0.76 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1a0b h LYS 716 CO 0.06 0.64 -0.43 0.82 -2.27 0.00 0.00 179.45 178.27 1a0b h ILE 717 N 0.75 1.30 -0.08 2.00 2.04 -1.16 -1.62 117.51 120.73 1a0b h ILE 717 Ca 0.19 -1.61 0.03 0.00 1.00 0.00 0.00 64.86 64.47 1a0b h ILE 717 Cb 0.10 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.70 1a0b h ILE 717 CO -0.03 0.52 -0.10 0.50 0.00 0.00 0.00 178.15 179.04 1a0b h LYS 718 N 0.54 -0.13 -0.06 2.37 3.64 -0.16 -0.13 116.57 122.63 1a0b h LYS 718 Ca 0.04 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.44 1a0b h LYS 718 Cb 0.97 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1a0b h LYS 718 CO 0.09 -0.09 -0.02 0.78 -2.27 0.00 0.00 179.45 177.94 1a0b h GLY 719 N -0.14 0.04 0.91 5.01 0.00 -0.92 -1.98 103.07 106.00 1a0b h GLY 719 Ca 0.07 0.03 0.02 0.00 0.00 0.00 0.00 47.33 47.45 1a0b h GLY 719 CO -0.16 -0.03 0.39 0.00 0.00 0.00 0.00 176.54 176.73 1a0b h ALA 720 N 1.05 0.79 -0.24 3.60 0.00 -1.00 -2.54 119.26 120.92 1a0b h ALA 720 Ca 0.03 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1a0b h ALA 720 Cb 0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1a0b h ALA 720 CO -0.07 0.15 0.02 0.00 0.00 0.00 0.00 179.25 179.34 1a0b h ALA 721 N 1.25 0.31 -0.17 0.00 0.00 -0.95 -3.02 119.26 116.69 1a0b h ALA 721 Ca 0.24 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1a0b h ALA 721 Cb -0.02 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1a0b h ALA 721 CO -0.08 0.02 0.07 0.78 0.00 0.00 0.00 179.25 180.04 1a0b h GLY 722 N 0.19 0.25 2.00 0.00 0.00 -1.22 -1.49 103.07 102.81 1a0b h GLY 722 Ca 0.07 -0.10 -0.05 0.00 0.00 0.00 0.00 47.33 47.24 1a0b h GLY 722 CO 0.01 0.10 -0.26 1.48 0.00 0.00 0.00 176.54 177.87 1a0b h SER 723 N 0.24 0.00 -0.60 0.19 4.64 -1.32 -2.60 113.55 114.11 1a0b h SER 723 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1a0b h SER 723 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1a0b h SER 723 CO -0.01 0.26 0.00 1.33 -0.87 0.00 0.00 176.83 177.54 1a0b n VAL 724 N -3.91 1.26 -1.43 0.95 0.24 -0.99 -4.98 118.33 109.48 1a0b n VAL 724 Ca -0.02 -1.09 -0.09 0.00 -2.04 0.00 0.00 64.34 61.10 1a0b n VAL 724 Cb 0.34 0.38 -0.03 0.00 -1.47 0.00 0.00 33.84 33.05 1a0b n VAL 724 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1a0b n GLY 725 N 1.14 0.88 3.46 7.63 0.00 -0.98 -4.94 105.19 112.38 1a0b n GLY 725 Ca 0.21 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.19 1a0b n GLY 725 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a0b s LEU 726 N -2.17 5.08 0.27 0.99 1.43 -0.60 -1.40 118.68 122.28 1a0b s LEU 726 Ca 0.00 -2.83 0.00 0.00 -1.03 0.00 0.00 54.13 50.27 1a0b s LEU 726 Cb 0.00 -2.40 0.56 0.00 0.03 0.00 0.00 46.19 44.38 1a0b s LEU 726 CO 0.00 -0.80 1.78 -0.09 0.23 0.00 0.00 176.35 177.48 1a0b h ARG 727 N 7.46 0.71 -0.38 1.70 2.43 -1.53 -2.12 114.38 122.64 1a0b h ARG 727 Ca 0.28 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.27 1a0b h ARG 727 Cb 0.90 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 30.28 1a0b h ARG 727 CO 1.21 0.47 -0.32 1.25 -1.51 0.00 0.00 179.97 181.07 1a0b h HIS 728 N 0.73 1.06 -0.00 2.20 2.76 -1.59 -1.60 115.15 118.71 1a0b h HIS 728 Ca 0.48 -0.30 -0.13 0.00 -2.20 0.00 0.00 60.37 58.22 1a0b h HIS 728 Cb 0.63 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.35 1a0b h HIS 728 CO -0.06 1.11 -0.60 -0.07 -1.30 0.00 0.00 177.93 177.01 1a0b h LEU 729 N 0.70 0.00 -0.58 0.26 3.38 -1.77 -2.13 115.31 115.18 1a0b h LEU 729 Ca 0.07 -0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 1a0b h LEU 729 Cb 0.90 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.64 1a0b h LEU 729 CO 0.08 0.60 -0.12 -0.61 0.09 0.00 0.00 178.44 178.49 1a0b h GLN 730 N 0.00 1.01 -0.30 1.13 4.15 -1.29 -1.78 115.11 118.03 1a0b h GLN 730 Ca -0.01 -0.38 -0.07 0.00 0.77 0.00 0.00 58.65 58.97 1a0b h GLN 730 Cb 1.06 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.67 1a0b h GLN 730 CO 0.08 1.06 -0.12 0.37 -1.93 0.00 0.00 178.83 178.29 1a0b h GLN 731 N 0.90 0.51 -0.15 1.69 4.15 -0.90 -1.45 115.11 119.85 1a0b h GLN 731 Ca 0.14 -0.14 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 1a0b h GLN 731 Cb 0.68 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1a0b h GLN 731 CO 0.05 0.62 -0.36 1.25 -1.93 0.00 0.00 178.83 178.46 1a0b h LEU 732 N 0.47 0.58 -1.35 -2.39 5.85 -1.20 -2.68 115.31 114.60 1a0b h LEU 732 Ca 0.09 -0.57 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1a0b h LEU 732 Cb 0.49 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1a0b h LEU 732 CO 0.03 1.05 0.23 1.23 -0.34 0.00 0.00 178.44 180.63 1a0b h GLY 733 N 0.14 0.72 0.94 3.75 0.00 -1.13 -0.57 103.07 106.92 1a0b h GLY 733 Ca -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 1a0b h GLY 733 CO 0.08 0.31 0.16 -1.61 0.00 0.00 0.00 176.54 175.48 1a0b h GLN 734 N 0.68 0.50 -0.19 4.80 5.75 -1.17 -1.23 115.11 124.25 1a0b h GLN 734 Ca 0.17 -0.08 -0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1a0b h GLN 734 Cb 0.08 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 1a0b h GLN 734 CO -0.02 0.47 0.06 1.96 -2.65 0.00 0.00 178.83 178.65 1a0b h GLN 735 N 0.42 0.29 -0.70 1.69 4.20 -1.09 -2.27 115.11 117.65 1a0b h GLN 735 Ca 0.12 -0.06 0.09 0.00 0.06 0.00 0.00 58.65 58.86 1a0b h GLN 735 Cb 0.14 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 1a0b h GLN 735 CO -0.01 0.39 0.46 0.82 -0.67 0.00 0.00 178.83 179.82 1a0b h ILE 736 N 0.14 0.94 -0.17 2.54 2.04 -1.04 -1.19 117.51 120.77 1a0b h ILE 736 Ca 0.06 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.72 1a0b h ILE 736 Cb 0.22 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 36.59 1a0b h ILE 736 CO -0.00 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.26 1a0b n GLN 737 N -4.49 1.63 -3.64 2.37 10.64 -0.47 -4.50 117.38 118.92 1a0b n GLN 737 Ca 0.11 -0.96 -0.36 0.00 -1.83 0.00 0.00 57.00 53.97 1a0b n GLN 737 Cb 0.32 -1.35 -0.07 0.00 -0.86 0.00 0.00 30.24 28.29 1a0b n GLN 737 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 1a0b n SER 738 N 0.20 4.18 0.00 2.61 7.64 -0.45 -4.90 113.62 122.89 1a0b n SER 738 Ca 0.15 -3.14 0.10 0.00 1.01 0.00 0.00 58.87 56.98 1a0b n SER 738 Cb 0.28 -1.04 0.56 0.00 -1.01 0.00 0.00 64.21 63.00 1a0b n SER 738 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1a0b n PRO 739 N 2.25 0.50 0.08 1.43 -0.04 -1.26 -2.18 135.00 135.78 1a0b n PRO 739 Ca 0.22 0.04 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1a0b n PRO 739 Cb 0.37 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 32.72 1a0b n PRO 739 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1a0b n ASP 740 N -1.10 0.66 -4.73 3.54 5.75 -1.26 -4.80 116.55 114.61 1a0b n ASP 740 Ca 0.13 0.47 -0.42 0.00 -0.01 0.00 0.00 54.79 54.96 1a0b n ASP 740 Cb 0.10 -0.57 -0.03 0.00 -1.03 0.00 0.00 41.12 39.59 1a0b n ASP 740 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1a0b s LEU 741 N -4.20 4.38 0.39 -2.12 1.02 -0.93 -4.92 118.68 112.31 1a0b s LEU 741 Ca 0.10 2.54 0.07 0.00 0.02 0.00 0.00 54.13 56.87 1a0b s LEU 741 Cb 0.14 -3.60 0.82 0.00 0.02 0.00 0.00 46.19 43.57 1a0b s LEU 741 CO 0.61 -0.72 2.01 1.55 0.02 0.00 0.00 176.35 179.82 1a0b h PRO 742 N 6.13 0.61 -0.54 1.29 0.13 -1.90 -2.54 132.00 135.18 1a0b h PRO 742 Ca -0.44 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1a0b h PRO 742 Cb 1.21 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1a0b h PRO 742 CO 0.85 0.40 0.00 0.00 -0.23 0.00 0.00 178.00 179.02 1a0b n ALA 743 N -2.47 2.64 0.07 -0.56 0.00 -1.26 -4.43 120.51 114.51 1a0b n ALA 743 Ca 0.07 -0.92 -0.12 0.00 0.00 0.00 0.00 53.44 52.46 1a0b n ALA 743 Cb 0.15 -0.99 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 1a0b n ALA 743 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1a0b h TRP 744 N 2.73 -0.26 -0.53 0.00 7.01 -1.77 0.85 115.95 123.98 1a0b h TRP 744 Ca 0.00 0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.10 1a0b h TRP 744 Cb 0.82 0.11 -0.08 0.00 -2.10 0.00 0.00 29.16 27.91 1a0b h TRP 744 CO 0.41 -0.16 0.09 0.93 -2.79 0.00 0.00 178.44 176.92 1a0b h GLU 745 N -0.20 0.22 -0.11 2.65 4.39 -1.81 0.19 114.58 119.90 1a0b h GLU 745 Ca 0.02 -0.01 -0.24 0.00 0.34 0.00 0.00 59.36 59.47 1a0b h GLU 745 Cb 0.22 -0.05 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1a0b h GLU 745 CO -0.07 0.14 -0.85 -0.44 -1.16 0.00 0.00 179.01 176.63 1a0b h ASP 746 N 0.22 0.93 0.54 1.42 3.32 -1.81 -3.37 116.42 117.66 1a0b h ASP 746 Ca 0.27 -0.64 0.00 0.00 0.02 0.00 0.00 57.03 56.68 1a0b h ASP 746 Cb 0.39 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.66 1a0b h ASP 746 CO -0.37 1.45 -1.08 0.59 -1.72 0.00 0.00 179.24 178.10 1a0b n ASN 747 N -3.91 0.60 -0.13 6.45 3.02 0.27 -4.43 115.26 117.14 1a0b n ASN 747 Ca -0.08 -0.06 0.16 0.00 -0.03 0.00 0.00 54.58 54.57 1a0b n ASN 747 Cb 0.79 0.79 0.54 0.00 -0.61 0.00 0.00 39.78 41.29 1a0b n ASN 747 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 1a0b h VAL 748 N 0.00 0.79 -0.40 2.41 3.04 -0.79 -1.62 116.25 119.68 1a0b h VAL 748 Ca 0.00 -0.11 -0.06 0.00 -1.01 0.00 0.00 66.70 65.51 1a0b h VAL 748 Cb 0.81 0.43 -0.01 0.00 -2.01 0.00 0.00 31.29 30.51 1a0b h VAL 748 CO 0.00 0.06 0.00 1.23 -1.01 0.00 0.00 177.57 177.85 1a0b h GLY 749 N 0.33 0.76 1.16 3.17 0.00 -1.83 -2.40 103.07 104.26 1a0b h GLY 749 Ca 0.34 -0.56 -0.09 0.00 0.00 0.00 0.00 47.33 47.02 1a0b h GLY 749 CO -0.09 0.52 0.02 0.83 0.00 0.00 0.00 176.54 177.81 1a0b h GLU 750 N 0.53 1.02 -0.63 4.80 5.08 -1.60 -1.73 114.58 122.05 1a0b h GLU 750 Ca 0.11 -0.30 -0.05 0.00 -1.00 0.00 0.00 59.36 58.12 1a0b h GLU 750 Cb 0.48 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1a0b h GLU 750 CO 0.02 0.99 0.19 -1.49 -1.00 0.00 0.00 179.01 177.72 1a0b h TRP 751 N 0.93 1.02 -0.29 4.33 6.55 -1.25 0.12 115.95 127.36 1a0b h TRP 751 Ca 0.17 -0.11 -0.06 0.00 0.95 0.00 0.00 58.89 59.84 1a0b h TRP 751 Cb 0.52 -0.29 -0.01 0.00 -0.86 0.00 0.00 29.16 28.52 1a0b h TRP 751 CO 0.03 0.84 -0.06 0.82 -1.05 0.00 0.00 178.44 179.02 1a0b h ILE 752 N 0.91 1.28 -0.33 1.49 2.04 -1.36 -1.06 117.51 120.47 1a0b h ILE 752 Ca 0.20 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.95 1a0b h ILE 752 Cb 0.30 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 1a0b h ILE 752 CO -0.01 0.34 0.07 -0.08 0.00 0.00 0.00 178.15 178.48 1a0b h GLU 753 N 0.31 0.54 -0.72 2.37 4.57 -1.19 -1.11 114.58 119.35 1a0b h GLU 753 Ca 0.07 -0.13 0.11 0.00 -1.18 0.00 0.00 59.36 58.22 1a0b h GLU 753 Cb 0.53 -0.07 -0.08 0.00 -0.16 0.00 0.00 28.75 28.98 1a0b h GLU 753 CO 0.03 0.61 0.34 1.49 -1.18 0.00 0.00 179.01 180.29 1a0b h GLU 754 N 0.38 0.54 -0.68 1.92 4.81 -0.71 -0.34 114.58 120.50 1a0b h GLU 754 Ca 0.10 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1a0b h GLU 754 Cb 0.32 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 1a0b h GLU 754 CO 0.00 0.36 0.34 1.98 -0.73 0.00 0.00 179.01 180.95 1a0b h MET 755 N 0.55 0.97 -0.47 1.92 4.05 -0.74 -1.80 114.93 119.41 1a0b h MET 755 Ca 0.36 -0.14 0.04 0.00 -0.28 0.00 0.00 59.70 59.69 1a0b h MET 755 Cb 0.43 -0.18 -0.04 0.00 -0.80 0.00 0.00 31.60 31.02 1a0b h MET 755 CO -0.30 0.76 0.24 -0.22 0.23 0.00 0.00 176.91 177.61 1a0b h LYS 756 N 0.94 0.45 0.00 0.39 3.64 0.08 -1.84 116.57 120.23 1a0b h LYS 756 Ca 0.23 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.49 1a0b h LYS 756 Cb 0.10 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1a0b h LYS 756 CO -0.03 0.30 -0.46 0.93 -2.27 0.00 0.00 179.45 177.92 1a0b h GLU 757 N 0.47 0.00 0.00 1.90 5.08 -0.92 -3.39 114.58 117.72 1a0b h GLU 757 Ca 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1a0b h GLU 757 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 1a0b h GLU 757 CO -0.14 0.46 -0.94 -0.85 -1.00 0.00 0.00 179.01 176.54 1a0b n GLU 758 N -3.26 2.11 -0.24 2.33 0.28 -0.69 -4.72 120.64 116.45 1a0b n GLU 758 Ca 0.02 -0.04 0.04 0.00 -0.16 0.00 0.00 57.16 57.01 1a0b n GLU 758 Cb 0.69 -1.11 0.16 0.00 1.43 0.00 0.00 31.44 32.61 1a0b n GLU 758 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 177.13 177.08 1a0b h TRP 759 N 0.00 0.46 -0.71 -1.84 5.08 -1.54 -0.91 115.95 116.48 1a0b h TRP 759 Ca 0.00 0.03 -0.06 0.00 1.08 0.00 0.00 58.89 59.95 1a0b h TRP 759 Cb 0.36 -0.10 -0.03 0.00 -3.00 0.00 0.00 29.16 26.39 1a0b h TRP 759 CO 0.00 0.07 0.22 0.00 -1.28 0.00 0.00 178.44 177.45 1a0b h ARG 760 N 0.43 1.11 -0.51 0.12 3.08 -1.86 -1.59 114.38 115.16 1a0b h ARG 760 Ca 0.38 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.20 1a0b h ARG 760 Cb 0.55 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1a0b h ARG 760 CO -0.38 0.95 0.34 1.25 -1.07 0.00 0.00 179.97 181.06 1a0b h HIS 761 N 1.05 0.64 -0.73 3.04 2.76 -1.56 -0.97 115.15 119.39 1a0b h HIS 761 Ca 0.23 0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.42 1a0b h HIS 761 Cb 0.30 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.01 1a0b h HIS 761 CO 0.02 0.40 0.48 -0.44 -1.30 0.00 0.00 177.93 177.10 1a0b h ASP 762 N 0.69 0.83 -0.49 3.26 5.19 -0.81 -1.95 116.42 123.15 1a0b h ASP 762 Ca 0.19 -0.02 -0.11 0.00 -0.62 0.00 0.00 57.03 56.46 1a0b h ASP 762 Cb -0.08 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.21 1a0b h ASP 762 CO -0.04 0.60 -0.13 0.58 -3.12 0.00 0.00 179.24 177.14 1a0b h VAL 763 N 0.99 1.27 -0.13 -1.35 2.07 -0.55 -2.22 116.25 116.32 1a0b h VAL 763 Ca 0.27 -1.27 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 1a0b h VAL 763 Cb -0.11 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1a0b h VAL 763 CO -0.06 0.45 -0.20 -0.33 0.02 0.00 0.00 177.57 177.45 1a0b h GLU 764 N 0.87 0.22 -0.29 1.57 5.08 -0.49 -1.62 114.58 119.92 1a0b h GLU 764 Ca 0.13 -0.06 -0.15 0.00 -1.00 0.00 0.00 59.36 58.28 1a0b h GLU 764 Cb 0.68 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 1a0b h GLU 764 CO 0.05 0.42 -0.40 0.28 -1.00 0.00 0.00 179.01 178.36 1a0b h VAL 765 N 0.20 1.29 -0.00 3.13 2.07 -1.08 -2.13 116.25 119.74 1a0b h VAL 765 Ca 0.04 -1.58 -0.00 0.00 0.82 0.00 0.00 66.70 65.97 1a0b h VAL 765 Cb 0.48 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1a0b h VAL 765 CO 0.03 0.51 0.00 0.25 0.02 0.00 0.00 177.57 178.38 1a0b h LEU 766 N 0.54 0.00 -0.47 2.57 6.46 -1.07 -2.10 115.31 121.25 1a0b h LEU 766 Ca 0.03 -0.09 0.09 0.00 -0.12 0.00 0.00 57.88 57.79 1a0b h LEU 766 Cb 0.99 -0.00 -0.08 0.00 -0.73 0.00 0.00 40.66 40.84 1a0b h LEU 766 CO 0.09 0.09 0.01 0.11 -0.62 0.00 0.00 178.44 178.12 1a0b h LYS 767 N -0.09 0.12 -0.76 1.25 1.57 -1.26 -0.04 116.57 117.36 1a0b h LYS 767 Ca 0.00 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1a0b h LYS 767 Cb 0.09 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.34 1a0b h LYS 767 CO -0.00 0.08 0.44 0.00 -0.57 0.00 0.00 179.45 179.40 1a0b h ALA 768 N 1.41 0.97 -0.02 3.86 0.00 -1.29 -2.05 119.26 122.14 1a0b h ALA 768 Ca 0.24 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1a0b h ALA 768 Cb 0.35 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1a0b h ALA 768 CO -0.38 0.45 0.01 2.35 0.00 0.00 0.00 179.25 181.68 1a0b h TRP 769 N 1.04 0.03 -0.89 0.00 7.01 -0.61 -0.27 115.95 122.26 1a0b h TRP 769 Ca 0.27 -0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.27 1a0b h TRP 769 Cb -0.01 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 26.99 1a0b h TRP 769 CO -0.01 0.16 0.55 0.28 -2.79 0.00 0.00 178.44 176.64 1a0b h VAL 770 N -0.10 1.24 -0.49 2.65 2.07 -0.96 0.43 116.25 121.08 1a0b h VAL 770 Ca 0.01 -0.50 -0.04 0.00 0.82 0.00 0.00 66.70 66.99 1a0b h VAL 770 Cb 0.14 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 1a0b h VAL 770 CO -0.00 0.25 0.15 0.00 0.02 0.00 0.00 177.57 177.98 1a0b h ALA 771 N 1.30 1.33 0.20 1.67 0.00 -1.11 -1.69 119.26 120.97 1a0b h ALA 771 Ca 0.32 -0.17 -0.32 0.00 0.00 0.00 0.00 54.91 54.74 1a0b h ALA 771 Cb -0.08 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 17.53 1a0b h ALA 771 CO -0.06 0.48 -1.45 -0.22 0.00 0.00 0.00 179.25 178.00 1a0b h LYS 772 N 0.71 0.43 0.00 0.00 1.63 -0.57 -3.31 116.57 115.46 1a0b h LYS 772 Ca 0.16 -0.73 0.00 0.00 -0.85 0.00 0.00 60.65 59.23 1a0b h LYS 772 Cb 0.22 0.27 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 1a0b h LYS 772 CO -0.01 1.34 0.00 0.00 -3.45 0.00 0.00 179.45 177.34 1a0b h ALA 773 N 0.30 1.00 -0.01 5.00 0.00 0.22 -3.51 119.26 122.26 1a0b h ALA 773 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1a0b h ALA 773 Cb 2.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.89 1a0b h ALA 773 CO 0.24 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.74