#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fr0 n THR 655 N 0.00 -3.98 -0.91 4.28 -2.24 -1.26 -5.00 114.28 105.17 1fr0 n THR 655 Ca 0.00 0.57 0.00 0.00 -2.27 0.00 0.00 64.05 62.35 1fr0 n THR 655 Cb 0.00 -3.76 0.00 0.00 -2.10 0.00 0.00 70.33 64.47 1fr0 n THR 655 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1fr0 n GLU 656 N 0.80 3.78 0.00 -0.78 2.13 -1.26 -5.05 120.64 120.26 1fr0 n GLU 656 Ca -0.02 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.80 1fr0 n GLU 656 Cb 0.49 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.20 1fr0 n GLU 656 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 1fr0 n GLU 657 N 0.00 -0.20 -2.71 5.31 0.28 -1.26 -4.92 120.64 117.14 1fr0 n GLU 657 Ca 0.00 -0.57 -0.43 0.00 -0.16 0.00 0.00 57.16 56.00 1fr0 n GLU 657 Cb 0.00 -0.90 -0.02 0.00 1.43 0.00 0.00 31.44 31.95 1fr0 n GLU 657 CO 0.00 0.00 0.00 -0.80 -0.16 0.00 0.00 177.13 176.17 1fr0 s ASN 658 N -0.15 6.69 0.00 -1.84 0.01 -1.26 -4.70 114.94 113.69 1fr0 s ASN 658 Ca 0.00 -2.04 0.23 0.00 -0.71 0.00 0.00 52.86 50.33 1fr0 s ASN 658 Cb 0.00 -2.51 0.03 0.00 0.41 0.00 0.00 41.25 39.19 1fr0 s ASN 658 CO 0.00 -1.22 1.12 -1.20 -1.51 0.00 0.00 177.10 174.29 1fr0 n SER 659 N 7.76 2.03 -0.33 -1.22 7.64 -1.26 -4.11 113.62 124.13 1fr0 n SER 659 Ca 0.35 -1.51 -0.11 0.00 1.01 0.00 0.00 58.87 58.61 1fr0 n SER 659 Cb 0.48 0.45 -0.10 0.00 -1.01 0.00 0.00 64.21 64.03 1fr0 n SER 659 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1fr0 h LYS 660 N 2.47 -0.11 -0.14 1.43 1.57 -2.01 -2.25 116.57 117.53 1fr0 h LYS 660 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1fr0 h LYS 660 Cb 0.76 0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.09 1fr0 h LYS 660 CO 0.00 -0.07 0.00 -1.13 -0.57 0.00 0.00 179.45 177.68 1fr0 n SER 661 N -5.20 3.04 -0.04 0.86 3.41 -1.26 -4.52 113.62 109.90 1fr0 n SER 661 Ca 0.00 -2.89 0.05 0.00 -0.26 0.00 0.00 58.87 55.77 1fr0 n SER 661 Cb 0.27 -0.43 -0.05 0.00 -0.26 0.00 0.00 64.21 63.74 1fr0 n SER 661 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1fr0 n GLU 662 N -0.81 3.50 0.00 4.33 2.13 -0.92 -4.44 120.64 124.42 1fr0 n GLU 662 Ca 0.17 -0.09 0.13 0.00 0.66 0.00 0.00 57.16 58.02 1fr0 n GLU 662 Cb 0.70 -0.98 0.32 0.00 0.27 0.00 0.00 31.44 31.75 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1fr0 n ALA 663 N -1.08 3.01 0.60 4.31 0.00 -0.89 -3.89 120.51 122.56 1fr0 n ALA 663 Ca 0.02 -0.48 0.11 0.00 0.00 0.00 0.00 53.44 53.10 1fr0 n ALA 663 Cb 0.16 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.59 1fr0 n ALA 663 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fr0 n LEU 664 N -0.20 0.62 -3.77 0.00 4.77 -1.26 -4.04 117.00 113.12 1fr0 n LEU 664 Ca 0.13 -0.03 -0.08 0.00 -0.03 0.00 0.00 56.01 56.00 1fr0 n LEU 664 Cb 0.39 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.35 1fr0 n LEU 664 CO 0.23 0.05 0.41 -1.48 -1.33 0.00 0.00 177.39 175.28 1fr0 s LEU 665 N -3.86 -0.25 -0.41 2.23 2.34 -1.25 -3.13 118.68 114.35 1fr0 s LEU 665 Ca 0.04 -0.49 -0.22 0.00 0.06 0.00 0.00 54.13 53.52 1fr0 s LEU 665 Cb 0.15 2.57 0.02 0.00 -0.56 0.00 0.00 46.19 48.36 1fr0 s LEU 665 CO 0.80 -1.23 0.72 -0.62 -1.06 0.00 0.00 176.35 174.97 1fr0 s ASP 666 N -2.89 6.43 -0.06 1.48 -1.08 -0.89 -4.78 116.67 114.89 1fr0 s ASP 666 Ca 0.10 0.02 -0.26 0.00 -0.52 0.00 0.00 52.55 51.88 1fr0 s ASP 666 Cb -0.04 -2.36 -0.22 0.00 -1.46 0.00 0.00 42.92 38.83 1fr0 s ASP 666 CO 0.02 -0.77 1.07 0.40 0.52 0.00 0.00 175.17 176.41 1fr0 h ILE 667 N 5.84 1.54 -0.02 4.11 5.03 -1.92 -2.35 117.51 129.73 1fr0 h ILE 667 Ca -0.25 -1.73 -0.01 0.00 -0.12 0.00 0.00 64.86 62.74 1fr0 h ILE 667 Cb 1.10 2.66 0.00 0.00 -3.03 0.00 0.00 36.82 37.54 1fr0 h ILE 667 CO 0.91 0.46 -0.05 1.55 -0.68 0.00 0.00 178.15 180.34 1fr0 h PRO 668 N -0.58 0.06 -0.68 2.37 0.13 -1.99 -2.71 132.00 128.60 1fr0 h PRO 668 Ca -0.01 -0.04 0.02 0.00 -0.87 0.00 0.00 66.00 65.10 1fr0 h PRO 668 Cb 0.81 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.90 1fr0 h PRO 668 CO 0.02 0.67 0.44 1.98 -0.23 0.00 0.00 178.00 180.88 1fr0 h MET 669 N -0.54 0.85 -0.07 0.86 4.05 -1.98 -1.57 114.93 116.53 1fr0 h MET 669 Ca -0.00 -0.05 0.02 0.00 -0.28 0.00 0.00 59.70 59.39 1fr0 h MET 669 Cb 0.67 -0.19 -0.02 0.00 -0.80 0.00 0.00 31.60 31.26 1fr0 h MET 669 CO 0.01 0.56 -0.04 -0.07 0.23 0.00 0.00 176.91 177.60 1fr0 h LEU 670 N 0.87 -0.14 -1.05 3.39 3.38 -1.47 -0.05 115.31 120.24 1fr0 h LEU 670 Ca 0.26 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.35 1fr0 h LEU 670 Cb -0.03 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.72 1fr0 h LEU 670 CO -0.08 -0.06 0.63 -0.08 0.09 0.00 0.00 178.44 178.93 1fr0 h GLU 671 N -0.05 1.03 0.59 1.13 4.22 -1.12 -2.25 114.58 118.13 1fr0 h GLU 671 Ca 0.04 -0.06 -0.03 0.00 0.08 0.00 0.00 59.36 59.39 1fr0 h GLU 671 Cb 0.11 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.13 1fr0 h GLU 671 CO -0.09 0.68 -0.28 1.96 -2.18 0.00 0.00 179.01 179.09 1fr0 h GLN 672 N 1.06 -0.76 -1.25 1.92 1.08 -0.40 -2.21 115.11 114.54 1fr0 h GLN 672 Ca 0.45 0.05 0.36 0.00 -1.45 0.00 0.00 58.65 58.06 1fr0 h GLN 672 Cb 0.31 0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 27.84 1fr0 h GLN 672 CO -0.20 -0.45 0.87 1.88 -0.95 0.00 0.00 178.83 179.98 1fr0 h TYR 673 N -1.01 0.23 -0.08 2.96 -1.99 -0.70 1.20 116.97 117.59 1fr0 h TYR 673 Ca -0.08 0.01 -0.17 0.00 2.00 0.00 0.00 58.73 60.49 1fr0 h TYR 673 Cb 0.66 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 39.32 1fr0 h TYR 673 CO -0.00 -0.01 -0.67 -0.07 -0.00 0.00 0.00 178.16 177.40 1fr0 h LEU 674 N 0.11 0.38 -0.14 3.88 3.38 -1.03 -1.75 115.31 120.13 1fr0 h LEU 674 Ca 0.64 -0.24 -0.14 0.00 0.09 0.00 0.00 57.88 58.24 1fr0 h LEU 674 Cb 2.28 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 42.92 1fr0 h LEU 674 CO -0.13 0.94 -0.44 -0.08 0.09 0.00 0.00 178.44 178.82 1fr0 h GLU 675 N 0.23 0.56 -0.28 1.13 4.57 0.20 -1.36 114.58 119.63 1fr0 h GLU 675 Ca -0.02 -0.40 -0.04 0.00 -1.18 0.00 0.00 59.36 57.72 1fr0 h GLU 675 Cb 1.22 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.87 1fr0 h GLU 675 CO 0.11 1.03 0.02 -0.07 -1.18 0.00 0.00 179.01 178.91 1fr0 h LEU 676 N 0.19 0.46 0.00 1.64 3.38 -1.15 -3.43 115.31 116.40 1fr0 h LEU 676 Ca -0.01 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1fr0 h LEU 676 Cb 1.07 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1fr0 h LEU 676 CO 0.09 0.64 0.00 0.52 0.09 0.00 0.00 178.44 179.78 1fr0 n VAL 677 N -4.62 0.53 0.00 1.22 0.31 -0.71 -5.11 118.33 109.95 1fr0 n VAL 677 Ca -0.03 0.18 0.00 0.00 -0.01 0.00 0.00 64.34 64.48 1fr0 n VAL 677 Cb 0.23 -1.07 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 1fr0 n VAL 677 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fr0 n GLY 678 N 2.98 0.69 0.00 2.92 0.00 -0.51 -4.72 105.19 106.55 1fr0 n GLY 678 Ca 0.00 -2.05 0.02 0.00 0.00 0.00 0.00 46.02 43.99 1fr0 n GLY 678 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fr0 n PRO 679 N 0.00 0.87 0.03 1.61 -0.04 -1.26 -3.78 135.00 132.44 1fr0 n PRO 679 Ca 0.00 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.45 1fr0 n PRO 679 Cb 0.00 -1.07 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 1fr0 n PRO 679 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1fr0 h LYS 680 N 0.00 -0.09 0.00 0.54 1.57 -1.96 -2.09 116.57 114.53 1fr0 h LYS 680 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1fr0 h LYS 680 Cb 0.00 0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1fr0 h LYS 680 CO 0.00 -0.06 0.00 1.37 -0.57 0.00 0.00 179.45 180.19 1fr0 h LEU 681 N -0.21 0.00 0.11 2.94 8.10 -1.94 -2.60 115.31 121.72 1fr0 h LEU 681 Ca -0.01 0.00 -0.19 0.00 0.11 0.00 0.00 57.88 57.79 1fr0 h LEU 681 Cb 0.07 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.30 1fr0 h LEU 681 CO 0.02 0.00 -0.91 0.40 -4.11 0.00 0.00 178.44 173.83 1fr0 h ILE 682 N 0.00 1.38 -0.02 0.15 2.04 -1.70 -2.76 117.51 116.60 1fr0 h ILE 682 Ca 0.00 -2.47 -0.05 0.00 1.00 0.00 0.00 64.86 63.34 1fr0 h ILE 682 Cb 0.89 3.05 0.00 0.00 -0.74 0.00 0.00 36.82 40.02 1fr0 h ILE 682 CO 0.00 0.68 -0.20 0.74 0.00 0.00 0.00 178.15 179.37 1fr0 h THR 683 N -0.45 1.52 0.61 -0.27 2.02 -1.46 -2.39 112.91 112.49 1fr0 h THR 683 Ca -0.18 -1.82 -0.03 0.00 0.77 0.00 0.00 66.41 65.14 1fr0 h THR 683 Cb 1.59 2.65 0.01 0.00 -1.74 0.00 0.00 68.15 70.66 1fr0 h THR 683 CO 0.09 0.50 -0.29 0.44 0.37 0.00 0.00 175.52 176.63 1fr0 h ASP 684 N -0.48 -0.70 -0.80 4.18 3.32 -1.58 -2.01 116.42 118.36 1fr0 h ASP 684 Ca -0.02 0.02 0.19 0.00 0.02 0.00 0.00 57.03 57.24 1fr0 h ASP 684 Cb 0.92 0.18 -0.12 0.00 0.22 0.00 0.00 39.33 40.53 1fr0 h ASP 684 CO 0.04 -0.41 0.22 1.23 -1.72 0.00 0.00 179.24 178.60 1fr0 h GLY 685 N -1.00 1.18 0.40 2.75 0.00 -1.65 -0.55 103.07 104.20 1fr0 h GLY 685 Ca -0.08 -0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.22 1fr0 h GLY 685 CO 0.14 -0.25 -0.30 -2.00 0.00 0.00 0.00 176.54 174.13 1fr0 h LEU 686 N 0.27 -0.88 -0.70 3.11 5.85 -1.34 -2.00 115.31 119.63 1fr0 h LEU 686 Ca 0.47 0.11 0.13 0.00 0.84 0.00 0.00 57.88 59.42 1fr0 h LEU 686 Cb 0.85 0.34 -0.13 0.00 0.37 0.00 0.00 40.66 42.10 1fr0 h LEU 686 CO -0.55 -0.38 -0.30 0.00 -0.34 0.00 0.00 178.44 176.87 1fr0 h ALA 687 N 0.24 0.14 -0.27 1.25 0.00 -0.33 0.12 119.26 120.41 1fr0 h ALA 687 Ca 0.05 0.22 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1fr0 h ALA 687 Cb 0.54 0.76 -0.05 0.00 0.00 0.00 0.00 17.79 19.04 1fr0 h ALA 687 CO -0.22 -0.59 -0.08 0.28 0.00 0.00 0.00 179.25 178.64 1fr0 h VAL 688 N -0.09 0.71 0.07 0.00 2.07 -1.14 -2.37 116.25 115.50 1fr0 h VAL 688 Ca 0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.81 1fr0 h VAL 688 Cb 0.56 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1fr0 h VAL 688 CO -0.75 0.00 -0.08 0.15 0.02 0.00 0.00 177.57 176.90 1fr0 h PHE 689 N -0.01 -0.21 -1.01 1.57 3.57 -0.23 -2.00 116.94 118.62 1fr0 h PHE 689 Ca 0.13 0.00 0.26 0.00 3.53 0.00 0.00 57.97 61.90 1fr0 h PHE 689 Cb 0.21 0.08 -0.07 0.00 2.79 0.00 0.00 35.95 38.97 1fr0 h PHE 689 CO -0.27 -0.13 0.68 0.93 -2.23 0.00 0.00 178.31 177.29 1fr0 h GLU 690 N -0.18 0.26 -0.04 1.11 5.08 -0.48 0.29 114.58 120.62 1fr0 h GLU 690 Ca 0.01 -0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 58.12 1fr0 h GLU 690 Cb 0.18 -0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.38 1fr0 h GLU 690 CO -0.03 0.17 -0.91 0.87 -1.00 0.00 0.00 179.01 178.11 1fr0 h LYS 691 N 0.27 0.55 -0.29 2.33 1.57 -0.87 -3.13 116.57 116.99 1fr0 h LYS 691 Ca 0.53 -0.54 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1fr0 h LYS 691 Cb 1.59 0.14 0.00 0.00 0.08 0.00 0.00 32.23 34.04 1fr0 h LYS 691 CO -0.17 1.17 0.00 -1.33 -0.57 0.00 0.00 179.45 178.54 1fr0 n MET 692 N -3.82 1.92 -0.02 3.15 2.81 0.18 -4.23 117.12 117.12 1fr0 n MET 692 Ca -0.08 -1.41 -0.13 0.00 -1.81 0.00 0.00 57.70 54.28 1fr0 n MET 692 Cb 0.81 -1.39 -0.10 0.00 -0.71 0.00 0.00 33.22 31.83 1fr0 n MET 692 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1fr0 h MET 693 N 2.61 -0.03 -0.38 0.03 4.05 -0.49 -1.96 114.93 118.76 1fr0 h MET 693 Ca 0.00 0.00 -0.16 0.00 -0.28 0.00 0.00 59.70 59.26 1fr0 h MET 693 Cb 0.58 0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.38 1fr0 h MET 693 CO 0.00 0.56 -0.38 -1.00 0.23 0.00 0.00 176.91 176.31 1fr0 h PRO 694 N -0.64 0.92 0.00 0.39 0.13 -1.74 -2.57 132.00 128.50 1fr0 h PRO 694 Ca -0.00 -0.49 -0.05 0.00 -0.87 0.00 0.00 66.00 64.59 1fr0 h PRO 694 Cb 0.60 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 1fr0 h PRO 694 CO 0.01 1.14 -0.22 0.78 -0.23 0.00 0.00 178.00 179.48 1fr0 h GLY 695 N 0.74 0.00 0.00 1.56 0.00 -1.74 -2.07 103.07 101.56 1fr0 h GLY 695 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 1fr0 h GLY 695 CO 0.09 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.91 1fr0 n TYR 696 N -4.18 0.00 -0.33 5.60 4.01 -0.74 -2.53 117.16 118.99 1fr0 n TYR 696 Ca -0.02 0.00 0.26 0.00 -0.16 0.00 0.00 57.90 57.98 1fr0 n TYR 696 Cb 0.29 -0.42 0.50 0.00 -0.31 0.00 0.00 39.34 39.40 1fr0 n TYR 696 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 1fr0 h VAL 697 N 0.00 0.23 0.02 -0.72 -1.51 -1.51 0.29 116.25 113.04 1fr0 h VAL 697 Ca 0.00 -0.08 0.03 0.00 -1.23 0.00 0.00 66.70 65.42 1fr0 h VAL 697 Cb 0.00 -0.04 -0.05 0.00 -2.13 0.00 0.00 31.29 29.07 1fr0 h VAL 697 CO 0.00 0.04 -0.34 0.77 -1.23 0.00 0.00 177.57 176.81 1fr0 h SER 698 N 0.25 -1.02 -0.31 4.19 4.64 -1.40 0.29 113.55 120.19 1fr0 h SER 698 Ca 0.76 0.13 0.09 0.00 -0.47 0.00 0.00 61.79 62.30 1fr0 h SER 698 Cb 1.82 0.40 -0.01 0.00 -0.31 0.00 0.00 62.40 64.30 1fr0 h SER 698 CO -0.65 -0.41 0.23 0.58 -0.87 0.00 0.00 176.83 175.72 1fr0 h VAL 699 N -0.51 0.78 0.60 0.95 2.07 -0.16 -2.30 116.25 117.67 1fr0 h VAL 699 Ca 0.05 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.54 1fr0 h VAL 699 Cb 0.59 0.84 0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1fr0 h VAL 699 CO -0.26 0.00 -0.29 0.25 0.02 0.00 0.00 177.57 177.29 1fr0 h LEU 700 N 0.00 -0.68 -0.75 2.57 5.85 0.32 -2.08 115.31 120.53 1fr0 h LEU 700 Ca 0.15 -0.03 0.16 0.00 0.84 0.00 0.00 57.88 59.00 1fr0 h LEU 700 Cb 0.61 0.18 -0.14 0.00 0.37 0.00 0.00 40.66 41.68 1fr0 h LEU 700 CO -0.00 -0.33 -0.09 -0.08 -0.34 0.00 0.00 178.44 177.59 1fr0 h GLU 701 N -1.06 0.04 -0.77 1.25 4.81 -0.55 0.93 114.58 119.24 1fr0 h GLU 701 Ca -0.08 -0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.21 1fr0 h GLU 701 Cb 0.67 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.99 1fr0 h GLU 701 CO 0.14 0.03 0.50 0.77 -0.73 0.00 0.00 179.01 179.72 1fr0 h SER 702 N 0.04 0.71 -0.17 1.04 0.02 -1.41 -1.49 113.55 112.30 1fr0 h SER 702 Ca 0.39 0.01 -0.19 0.00 -0.84 0.00 0.00 61.79 61.15 1fr0 h SER 702 Cb 0.65 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 63.05 1fr0 h SER 702 CO -0.72 0.45 -0.61 0.78 -1.14 0.00 0.00 176.83 175.58 1fr0 h ASN 703 N 0.80 0.88 -0.47 3.07 4.21 0.15 -2.92 115.58 121.30 1fr0 h ASN 703 Ca 0.33 -0.50 0.08 0.00 1.21 0.00 0.00 56.30 57.42 1fr0 h ASN 703 Cb 0.28 -0.26 -0.07 0.00 -1.12 0.00 0.00 38.32 37.16 1fr0 h ASN 703 CO -0.12 1.29 0.08 0.25 -1.29 0.00 0.00 177.43 177.64 1fr0 h LEU 704 N 0.58 -0.03 0.00 1.61 7.12 0.38 0.38 115.31 125.35 1fr0 h LEU 704 Ca -0.00 0.09 0.00 0.00 0.13 0.00 0.00 57.88 58.09 1fr0 h LEU 704 Cb 1.21 0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.47 1fr0 h LEU 704 CO 0.13 0.02 0.00 0.35 -0.13 0.00 0.00 178.44 178.81 1fr0 n THR 705 N -5.13 0.28 0.19 1.05 -2.24 -1.03 -2.45 114.28 104.94 1fr0 n THR 705 Ca 0.05 0.07 0.10 0.00 -2.27 0.00 0.00 64.05 62.00 1fr0 n THR 705 Cb 0.23 -0.70 0.19 0.00 -2.10 0.00 0.00 70.33 67.95 1fr0 n THR 705 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fr0 n ALA 706 N -1.26 2.38 -2.09 6.98 0.00 0.13 -4.94 120.51 121.71 1fr0 n ALA 706 Ca 0.11 -1.00 -0.21 0.00 0.00 0.00 0.00 53.44 52.35 1fr0 n ALA 706 Cb 0.17 -0.74 -0.04 0.00 0.00 0.00 0.00 19.45 18.84 1fr0 n ALA 706 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fr0 n GLN 707 N 1.24 -1.61 -1.61 0.00 1.13 -0.79 -4.85 117.38 110.89 1fr0 n GLN 707 Ca 0.17 1.08 -0.32 0.00 -1.94 0.00 0.00 57.00 55.99 1fr0 n GLN 707 Cb 0.54 -5.64 -0.05 0.00 0.11 0.00 0.00 30.24 25.21 1fr0 n GLN 707 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1fr0 n ASP 708 N -1.75 7.22 -0.11 1.08 9.92 -1.03 -4.71 116.55 127.17 1fr0 n ASP 708 Ca -0.23 -3.02 -0.05 0.00 -0.53 0.00 0.00 54.79 50.95 1fr0 n ASP 708 Cb 0.68 -1.34 0.01 0.00 -0.64 0.00 0.00 41.12 39.83 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1fr0 h LYS 709 N 3.87 -0.07 -0.26 -1.24 1.57 -1.89 -0.64 116.57 117.92 1fr0 h LYS 709 Ca 0.55 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.37 1fr0 h LYS 709 Cb 0.60 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.85 1fr0 h LYS 709 CO 1.14 -0.04 -0.55 -0.22 -0.57 0.00 0.00 179.45 179.21 1fr0 h LYS 710 N -0.07 -0.49 -0.22 3.15 3.64 -1.99 0.23 116.57 120.82 1fr0 h LYS 710 Ca 0.19 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 1fr0 h LYS 710 Cb 0.35 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1fr0 h LYS 710 CO -0.43 -0.32 -0.00 0.78 -2.27 0.00 0.00 179.45 177.21 1fr0 h GLY 711 N -0.50 0.21 0.40 5.01 0.00 -1.86 -1.22 103.07 105.11 1fr0 h GLY 711 Ca 0.05 0.03 0.16 0.00 0.00 0.00 0.00 47.33 47.57 1fr0 h GLY 711 CO -0.51 -0.04 0.59 -2.22 0.00 0.00 0.00 176.54 174.36 1fr0 h ILE 712 N 0.07 0.78 0.61 2.60 2.04 -0.16 0.44 117.51 123.89 1fr0 h ILE 712 Ca 0.10 -0.22 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 1fr0 h ILE 712 Cb 0.13 0.07 0.01 0.00 -0.74 0.00 0.00 36.82 36.29 1fr0 h ILE 712 CO -0.18 0.12 -0.29 0.58 0.00 0.00 0.00 178.15 178.38 1fr0 h VAL 713 N 0.65 0.00 -0.53 1.67 2.07 0.58 0.12 116.25 120.81 1fr0 h VAL 713 Ca 0.48 -0.37 0.08 0.00 0.82 0.00 0.00 66.70 67.71 1fr0 h VAL 713 Cb 0.85 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.55 1fr0 h VAL 713 CO -0.23 0.00 0.16 -0.33 0.02 0.00 0.00 177.57 177.19 1fr0 h GLU 714 N -1.19 0.31 0.00 1.57 4.39 -1.04 0.45 114.58 119.08 1fr0 h GLU 714 Ca -0.08 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.60 1fr0 h GLU 714 Cb 0.63 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1fr0 h GLU 714 CO 0.14 0.21 0.00 0.39 -1.16 0.00 0.00 179.01 178.59 1fr0 n GLU 715 N -5.04 0.21 0.13 2.33 1.02 0.12 -1.53 120.64 117.86 1fr0 n GLU 715 Ca 0.06 0.43 -0.05 0.00 -0.02 0.00 0.00 57.16 57.58 1fr0 n GLU 715 Cb 0.24 -1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.74 1fr0 n GLU 715 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1fr0 h GLY 716 N 2.26 -0.36 2.00 0.62 0.00 0.27 -1.42 103.07 106.44 1fr0 h GLY 716 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1fr0 h GLY 716 CO 0.00 -0.13 0.00 1.12 0.00 0.00 0.00 176.54 177.53 1fr0 h HIS 717 N -0.53 0.00 0.04 5.60 2.07 -1.53 -1.48 115.15 119.31 1fr0 h HIS 717 Ca -0.03 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.48 1fr0 h HIS 717 Cb 0.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.24 1fr0 h HIS 717 CO 0.07 0.00 -0.02 -0.22 -3.07 0.00 0.00 177.93 174.70 1fr0 h LYS 718 N 0.00 -0.05 0.16 5.12 3.64 -1.30 0.39 116.57 124.53 1fr0 h LYS 718 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1fr0 h LYS 718 Cb 0.53 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1fr0 h LYS 718 CO 0.00 0.60 -0.08 0.82 -2.27 0.00 0.00 179.45 178.52 1fr0 h ILE 719 N -0.77 0.48 0.00 2.00 2.04 -1.24 -2.71 117.51 117.31 1fr0 h ILE 719 Ca -0.01 -1.08 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 1fr0 h ILE 719 Cb 0.67 0.84 -0.00 0.00 -0.74 0.00 0.00 36.82 37.59 1fr0 h ILE 719 CO 0.01 0.14 -0.06 0.11 0.00 0.00 0.00 178.15 178.34 1fr0 h LYS 720 N -0.99 0.00 -0.08 2.37 1.57 -1.44 -2.55 116.57 115.44 1fr0 h LYS 720 Ca -0.02 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.70 1fr0 h LYS 720 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.71 1fr0 h LYS 720 CO 0.04 0.06 -0.17 0.78 -0.57 0.00 0.00 179.45 179.59 1fr0 h GLY 721 N 0.65 0.27 1.01 3.86 0.00 -0.95 -2.45 103.07 105.47 1fr0 h GLY 721 Ca -0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 46.99 1fr0 h GLY 721 CO 0.01 0.30 0.45 0.00 0.00 0.00 0.00 176.54 177.30 1fr0 h ALA 722 N 0.49 0.97 -0.66 3.60 0.00 -1.12 -2.56 119.26 119.98 1fr0 h ALA 722 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1fr0 h ALA 722 Cb 0.76 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.21 1fr0 h ALA 722 CO 0.04 0.45 0.41 0.00 0.00 0.00 0.00 179.25 180.15 1fr0 h ALA 723 N 1.24 0.84 -0.95 0.00 0.00 -1.48 -1.82 119.26 117.09 1fr0 h ALA 723 Ca 0.27 -0.07 0.27 0.00 0.00 0.00 0.00 54.91 55.38 1fr0 h ALA 723 Cb -0.03 -0.27 -0.05 0.00 0.00 0.00 0.00 17.79 17.45 1fr0 h ALA 723 CO -0.05 0.30 0.67 0.78 0.00 0.00 0.00 179.25 180.95 1fr0 h GLY 724 N 0.90 0.19 1.59 0.00 0.00 -1.00 0.31 103.07 105.06 1fr0 h GLY 724 Ca 0.24 -0.04 -0.05 0.00 0.00 0.00 0.00 47.33 47.48 1fr0 h GLY 724 CO -0.05 -0.01 -0.01 1.48 0.00 0.00 0.00 176.54 177.95 1fr0 h SER 725 N 0.08 0.48 0.00 0.19 4.64 -1.31 -0.73 113.55 116.89 1fr0 h SER 725 Ca 0.46 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1fr0 h SER 725 Cb 1.71 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.68 1fr0 h SER 725 CO -0.05 0.56 0.00 0.52 -0.87 0.00 0.00 176.83 177.00 1fr0 n VAL 726 N -4.27 0.00 0.00 0.95 0.31 0.10 -4.78 118.33 110.64 1fr0 n VAL 726 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1fr0 n VAL 726 Cb 0.25 -0.34 0.00 0.00 -0.91 0.00 0.00 33.84 32.85 1fr0 n VAL 726 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fr0 n GLY 727 N 0.78 1.19 3.13 2.92 0.00 -0.29 -4.96 105.19 107.96 1fr0 n GLY 727 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 1fr0 n GLY 727 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fr0 n LEU 728 N 0.00 6.03 0.16 0.99 0.00 -0.53 -2.09 117.00 121.56 1fr0 n LEU 728 Ca 0.00 -4.62 0.01 0.00 0.00 0.00 0.00 56.01 51.41 1fr0 n LEU 728 Cb 0.00 -1.52 0.26 0.00 0.00 0.00 0.00 43.42 42.16 1fr0 n LEU 728 CO 0.00 1.13 0.60 0.08 0.00 0.00 0.00 177.39 179.21 1fr0 h ARG 729 N 6.31 0.00 0.36 1.96 0.11 -1.71 -2.81 114.38 118.60 1fr0 h ARG 729 Ca 0.35 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.41 1fr0 h ARG 729 Cb 0.73 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.80 1fr0 h ARG 729 CO 1.44 0.50 -0.31 1.25 0.10 0.00 0.00 179.97 182.94 1fr0 h HIS 730 N 0.00 -0.85 -0.82 4.08 2.76 -1.68 -2.09 115.15 116.55 1fr0 h HIS 730 Ca -0.00 0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.23 1fr0 h HIS 730 Cb 0.92 0.33 -0.06 0.00 1.55 0.00 0.00 27.41 30.15 1fr0 h HIS 730 CO 0.00 -0.43 0.50 -0.07 -1.30 0.00 0.00 177.93 176.64 1fr0 h LEU 731 N -0.65 0.79 -0.67 0.26 3.38 -1.82 -2.34 115.31 114.26 1fr0 h LEU 731 Ca -0.05 0.02 0.13 0.00 0.09 0.00 0.00 57.88 58.07 1fr0 h LEU 731 Cb 0.56 -0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.03 1fr0 h LEU 731 CO -0.01 0.51 -0.21 -0.61 0.09 0.00 0.00 178.44 178.20 1fr0 h GLN 732 N 0.92 -0.04 0.31 1.13 4.15 -1.21 -1.69 115.11 118.68 1fr0 h GLN 732 Ca 0.36 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.76 1fr0 h GLN 732 Cb 0.16 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1fr0 h GLN 732 CO -0.17 -0.03 -0.15 0.37 -1.93 0.00 0.00 178.83 176.92 1fr0 h GLN 733 N -0.04 -0.40 -0.99 1.69 4.15 -0.85 -2.60 115.11 116.06 1fr0 h GLN 733 Ca 0.31 0.03 0.33 0.00 0.77 0.00 0.00 58.65 60.08 1fr0 h GLN 733 Cb 0.52 0.09 -0.18 0.00 0.21 0.00 0.00 27.48 28.12 1fr0 h GLN 733 CO -0.71 -0.17 0.23 -0.07 -1.93 0.00 0.00 178.83 176.18 1fr0 h LEU 734 N -0.57 -0.17 -0.17 -2.39 4.07 -1.05 0.57 115.31 115.60 1fr0 h LEU 734 Ca -0.04 0.27 -0.06 0.00 0.08 0.00 0.00 57.88 58.12 1fr0 h LEU 734 Cb 0.42 0.40 -0.00 0.00 1.08 0.00 0.00 40.66 42.56 1fr0 h LEU 734 CO 0.07 -0.38 -0.14 1.23 -1.08 0.00 0.00 178.44 178.14 1fr0 h GLY 735 N 0.01 0.44 1.30 0.83 0.00 -1.28 -1.46 103.07 102.92 1fr0 h GLY 735 Ca 0.69 -0.43 0.01 0.00 0.00 0.00 0.00 47.33 47.60 1fr0 h GLY 735 CO -0.86 0.39 0.34 -1.61 0.00 0.00 0.00 176.54 174.80 1fr0 h GLN 736 N 0.06 0.00 0.01 4.80 4.15 0.51 -0.19 115.11 124.44 1fr0 h GLN 736 Ca 0.03 0.00 -0.36 0.00 0.77 0.00 0.00 58.65 59.09 1fr0 h GLN 736 Cb 0.67 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.30 1fr0 h GLN 736 CO 0.04 0.00 -2.24 1.04 -1.93 0.00 0.00 178.83 175.74 1fr0 n GLN 737 N -2.99 0.68 0.30 1.69 6.02 -0.68 -4.15 117.38 118.24 1fr0 n GLN 737 Ca -0.01 0.11 0.18 0.00 -0.01 0.00 0.00 57.00 57.28 1fr0 n GLN 737 Cb 0.40 -1.59 0.89 0.00 1.02 0.00 0.00 30.24 30.96 1fr0 n GLN 737 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1fr0 h ILE 738 N 0.01 0.13 0.00 5.09 2.04 0.03 -2.00 117.51 122.82 1fr0 h ILE 738 Ca -0.49 -0.34 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1fr0 h ILE 738 Cb 2.10 1.29 0.00 0.00 -0.74 0.00 0.00 36.82 39.47 1fr0 h ILE 738 CO 0.02 0.03 0.00 0.00 0.00 0.00 0.00 178.15 178.20 1fr0 n GLN 739 N -3.21 0.57 -2.71 2.37 -0.00 -0.89 -3.44 117.38 110.08 1fr0 n GLN 739 Ca -0.01 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.71 1fr0 n GLN 739 Cb 0.21 -1.43 -0.02 0.00 -0.00 0.00 0.00 30.24 29.00 1fr0 n GLN 739 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1fr0 n SER 740 N -0.93 4.69 -2.21 2.61 3.41 -0.75 -4.91 113.62 115.53 1fr0 n SER 740 Ca 0.12 -3.71 -0.04 0.00 -0.26 0.00 0.00 58.87 54.98 1fr0 n SER 740 Cb 0.05 -0.53 -0.05 0.00 -0.26 0.00 0.00 64.21 63.42 1fr0 n SER 740 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1fr0 n PRO 741 N -0.36 0.72 0.00 4.33 -0.04 -1.22 -2.81 135.00 135.62 1fr0 n PRO 741 Ca 0.35 -0.32 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1fr0 n PRO 741 Cb 0.51 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 1fr0 n PRO 741 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fr0 n ASP 742 N 2.61 1.74 -4.76 3.54 5.75 -1.26 -4.96 116.55 119.21 1fr0 n ASP 742 Ca 0.14 -0.07 -0.41 0.00 -0.01 0.00 0.00 54.79 54.44 1fr0 n ASP 742 Cb 0.33 0.49 -0.02 0.00 -1.03 0.00 0.00 41.12 40.89 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1fr0 s LEU 743 N -1.32 4.43 0.47 -2.12 1.02 -1.12 -4.88 118.68 115.16 1fr0 s LEU 743 Ca 0.00 2.64 0.32 0.00 0.02 0.00 0.00 54.13 57.11 1fr0 s LEU 743 Cb 0.00 -3.64 1.37 0.00 0.02 0.00 0.00 46.19 43.94 1fr0 s LEU 743 CO 0.00 -0.52 1.94 1.55 0.02 0.00 0.00 176.35 179.34 1fr0 h PRO 744 N 3.68 0.00 0.00 1.29 0.13 -1.96 -2.41 132.00 132.73 1fr0 h PRO 744 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1fr0 h PRO 744 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1fr0 h PRO 744 CO 0.67 0.00 -1.21 0.00 -0.23 0.00 0.00 178.00 177.23 1fr0 n ALA 745 N -1.99 4.18 0.10 -0.56 0.00 -1.26 -4.28 120.51 116.70 1fr0 n ALA 745 Ca 0.01 -0.56 -0.23 0.00 0.00 0.00 0.00 53.44 52.66 1fr0 n ALA 745 Cb 0.25 -0.73 -0.15 0.00 0.00 0.00 0.00 19.45 18.81 1fr0 n ALA 745 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1fr0 h TRP 746 N 0.00 0.78 0.00 0.00 7.01 -1.79 -2.30 115.95 119.65 1fr0 h TRP 746 Ca 0.00 -0.57 0.00 0.00 2.11 0.00 0.00 58.89 60.43 1fr0 h TRP 746 Cb 0.60 -0.03 0.00 0.00 -2.10 0.00 0.00 29.16 27.63 1fr0 h TRP 746 CO 0.00 1.46 0.00 -1.91 -2.79 0.00 0.00 178.44 175.20 1fr0 n GLU 747 N -3.90 0.04 -0.09 2.65 4.07 -1.16 -0.38 120.64 121.87 1fr0 n GLU 747 Ca -0.16 0.30 -0.10 0.00 -0.06 0.00 0.00 57.16 57.14 1fr0 n GLU 747 Cb 0.98 -1.58 -0.16 0.00 -0.06 0.00 0.00 31.44 30.62 1fr0 n GLU 747 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1fr0 n ASP 748 N -1.66 0.17 -1.00 4.31 9.92 -1.21 -4.30 116.55 122.78 1fr0 n ASP 748 Ca 0.03 0.03 0.10 0.00 -0.53 0.00 0.00 54.79 54.42 1fr0 n ASP 748 Cb 0.17 0.84 0.20 0.00 -0.64 0.00 0.00 41.12 41.69 1fr0 n ASP 748 CO 0.00 0.00 0.00 -0.46 0.13 0.00 0.00 177.20 176.87 1fr0 n ASN 749 N -2.80 3.27 -0.08 -2.24 0.23 -0.87 -4.49 115.26 108.28 1fr0 n ASN 749 Ca -0.32 -1.93 -0.10 0.00 -0.53 0.00 0.00 54.58 51.70 1fr0 n ASN 749 Cb 1.14 -0.26 -0.02 0.00 -2.08 0.00 0.00 39.78 38.56 1fr0 n ASN 749 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 1fr0 h VAL 750 N 3.69 1.12 -0.49 3.53 3.04 -0.90 -1.70 116.25 124.55 1fr0 h VAL 750 Ca 0.00 -0.32 0.09 0.00 -1.01 0.00 0.00 66.70 65.46 1fr0 h VAL 750 Cb 0.88 0.81 -0.08 0.00 -2.01 0.00 0.00 31.29 30.89 1fr0 h VAL 750 CO 0.00 0.12 -0.01 1.23 -1.01 0.00 0.00 177.57 177.90 1fr0 h GLY 751 N 0.35 0.48 2.00 3.17 0.00 -1.85 0.27 103.07 107.49 1fr0 h GLY 751 Ca 0.10 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 1fr0 h GLY 751 CO -0.02 -0.14 -0.15 -2.09 0.00 0.00 0.00 176.54 174.14 1fr0 h GLU 752 N 0.10 0.00 0.46 4.80 4.57 -1.78 -2.03 114.58 120.70 1fr0 h GLU 752 Ca 0.24 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.40 1fr0 h GLU 752 Cb 0.37 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1fr0 h GLU 752 CO -0.41 0.15 -0.22 2.35 -1.18 0.00 0.00 179.01 179.70 1fr0 h TRP 753 N 0.00 -0.57 -0.54 0.92 2.91 0.45 0.84 115.95 119.96 1fr0 h TRP 753 Ca -0.00 -0.01 -0.05 0.00 1.13 0.00 0.00 58.89 59.96 1fr0 h TRP 753 Cb 0.33 0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.15 1fr0 h TRP 753 CO 0.00 -0.26 0.14 0.82 -1.03 0.00 0.00 178.44 178.11 1fr0 h ILE 754 N -0.83 1.24 0.78 2.65 2.04 -1.31 -1.40 117.51 120.68 1fr0 h ILE 754 Ca -0.06 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 64.92 1fr0 h ILE 754 Cb 0.56 0.77 0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1fr0 h ILE 754 CO 0.10 0.31 -0.37 -0.08 0.00 0.00 0.00 178.15 178.11 1fr0 h GLU 755 N 0.75 -1.01 -0.43 2.37 4.81 -1.36 -0.98 114.58 118.73 1fr0 h GLU 755 Ca 0.17 0.07 0.12 0.00 -0.13 0.00 0.00 59.36 59.59 1fr0 h GLU 755 Cb 0.32 0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 1fr0 h GLU 755 CO -0.00 -0.66 0.37 1.49 -0.73 0.00 0.00 179.01 179.48 1fr0 h GLU 756 N -1.14 0.00 -0.23 1.92 4.57 -0.83 0.53 114.58 119.39 1fr0 h GLU 756 Ca -0.11 0.00 -0.19 0.00 -1.18 0.00 0.00 59.36 57.88 1fr0 h GLU 756 Cb 0.82 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.41 1fr0 h GLU 756 CO 0.18 0.00 -0.61 1.98 -1.18 0.00 0.00 179.01 179.38 1fr0 h MET 757 N 0.00 0.83 0.85 1.92 4.05 -0.68 -3.27 114.93 118.62 1fr0 h MET 757 Ca 0.20 -0.58 -0.04 0.00 -0.28 0.00 0.00 59.70 59.01 1fr0 h MET 757 Cb 0.93 0.09 0.01 0.00 -0.80 0.00 0.00 31.60 31.83 1fr0 h MET 757 CO -0.00 1.20 -0.41 0.87 0.23 0.00 0.00 176.91 178.80 1fr0 h LYS 758 N 0.59 -1.09 -2.37 0.39 1.79 0.44 0.14 116.57 116.46 1fr0 h LYS 758 Ca -0.01 0.07 -0.38 0.00 -2.18 0.00 0.00 60.65 58.16 1fr0 h LYS 758 Cb 1.23 0.25 -0.04 0.00 -1.58 0.00 0.00 32.23 32.09 1fr0 h LYS 758 CO 0.13 -0.72 1.20 0.39 -1.08 0.00 0.00 179.45 179.37 1fr0 n GLU 759 N -5.56 2.66 0.00 3.15 1.02 -1.01 -3.77 120.64 117.13 1fr0 n GLU 759 Ca -0.15 -1.49 0.00 0.00 -0.02 0.00 0.00 57.16 55.50 1fr0 n GLU 759 Cb 0.45 -2.30 0.00 0.00 -0.02 0.00 0.00 31.44 29.57 1fr0 n GLU 759 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1fr0 n GLU 760 N 2.85 0.00 -0.14 3.49 2.13 -1.14 -4.96 120.64 122.88 1fr0 n GLU 760 Ca 0.56 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 58.35 1fr0 n GLU 760 Cb 0.65 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.41 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 -0.41 0.00 0.00 177.13 176.83 1fr0 h TRP 761 N 0.00 0.04 -0.89 4.31 5.08 -0.81 -0.59 115.95 123.09 1fr0 h TRP 761 Ca 0.00 0.03 0.24 0.00 1.08 0.00 0.00 58.89 60.25 1fr0 h TRP 761 Cb 0.00 0.05 -0.15 0.00 -3.00 0.00 0.00 29.16 26.06 1fr0 h TRP 761 CO 0.00 -0.06 0.23 -0.09 -1.28 0.00 0.00 178.44 177.24 1fr0 h ARG 762 N 0.15 0.18 -0.36 0.12 2.43 -1.80 0.42 114.38 115.54 1fr0 h ARG 762 Ca 0.23 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1fr0 h ARG 762 Cb 0.32 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.81 1fr0 h ARG 762 CO -0.34 0.12 0.22 1.25 -1.51 0.00 0.00 179.97 179.70 1fr0 h HIS 763 N 0.18 0.47 -0.60 2.20 2.76 -1.47 0.14 115.15 118.83 1fr0 h HIS 763 Ca 0.57 -0.00 0.12 0.00 -2.20 0.00 0.00 60.37 58.86 1fr0 h HIS 763 Cb 1.17 -0.15 -0.11 0.00 1.55 0.00 0.00 27.41 29.86 1fr0 h HIS 763 CO -0.28 0.34 -0.11 -0.44 -1.30 0.00 0.00 177.93 176.14 1fr0 h ASP 764 N 0.46 -0.48 0.89 3.26 3.32 0.14 0.21 116.42 124.23 1fr0 h ASP 764 Ca 0.13 0.17 -0.12 0.00 0.02 0.00 0.00 57.03 57.23 1fr0 h ASP 764 Cb 0.00 0.34 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 1fr0 h ASP 764 CO -0.02 -0.18 -0.57 1.62 -1.72 0.00 0.00 179.24 178.37 1fr0 h VAL 765 N 0.03 1.18 0.49 -1.35 3.04 -1.11 -2.51 116.25 116.03 1fr0 h VAL 765 Ca 0.30 -2.10 -0.02 0.00 -1.01 0.00 0.00 66.70 63.86 1fr0 h VAL 765 Cb 0.47 2.21 0.00 0.00 -2.01 0.00 0.00 31.29 31.96 1fr0 h VAL 765 CO -0.59 0.55 -0.24 -0.08 -1.01 0.00 0.00 177.57 176.21 1fr0 h GLU 766 N 0.00 -0.64 -0.83 4.17 4.81 0.22 0.98 114.58 123.30 1fr0 h GLU 766 Ca -0.01 0.04 0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1fr0 h GLU 766 Cb 1.16 0.15 -0.05 0.00 0.63 0.00 0.00 28.75 30.64 1fr0 h GLU 766 CO 0.07 -0.43 0.54 0.28 -0.73 0.00 0.00 179.01 178.75 1fr0 h VAL 767 N -0.68 1.09 0.26 0.32 2.07 -1.33 -2.31 116.25 115.65 1fr0 h VAL 767 Ca -0.07 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1fr0 h VAL 767 Cb 0.51 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.29 1fr0 h VAL 767 CO 0.11 0.18 -0.29 0.25 0.02 0.00 0.00 177.57 177.84 1fr0 h LEU 768 N 0.97 -0.78 -0.29 2.57 5.85 -1.28 0.14 115.31 122.48 1fr0 h LEU 768 Ca 0.35 0.07 0.07 0.00 0.84 0.00 0.00 57.88 59.21 1fr0 h LEU 768 Cb 0.14 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.36 1fr0 h LEU 768 CO -0.11 -0.41 -0.27 0.50 -0.34 0.00 0.00 178.44 177.81 1fr0 h LYS 769 N -0.59 -0.24 0.00 1.25 3.11 -0.27 0.65 116.57 120.47 1fr0 h LYS 769 Ca -0.00 0.02 -0.00 0.00 -2.81 0.00 0.00 60.65 57.85 1fr0 h LYS 769 Cb 0.55 0.05 -0.00 0.00 -1.00 0.00 0.00 32.23 31.84 1fr0 h LYS 769 CO -0.08 -0.16 -0.00 0.00 -2.81 0.00 0.00 179.45 176.40 1fr0 h ALA 770 N 0.80 1.15 0.68 5.00 0.00 -1.08 -1.21 119.26 124.59 1fr0 h ALA 770 Ca 0.15 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1fr0 h ALA 770 Cb 0.49 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1fr0 h ALA 770 CO -0.44 0.01 -0.33 2.35 0.00 0.00 0.00 179.25 180.84 1fr0 h TRP 771 N 0.00 -0.84 0.00 0.00 7.01 0.32 -2.52 115.95 119.91 1fr0 h TRP 771 Ca -0.00 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.98 1fr0 h TRP 771 Cb 0.03 0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.37 1fr0 h TRP 771 CO 0.00 -0.52 0.00 0.28 -2.79 0.00 0.00 178.44 175.41 1fr0 n VAL 772 N -5.21 0.82 0.13 2.65 0.31 -0.98 0.12 118.33 116.16 1fr0 n VAL 772 Ca -0.11 0.18 -0.00 0.00 -0.01 0.00 0.00 64.34 64.40 1fr0 n VAL 772 Cb 0.36 -1.00 0.08 0.00 -0.91 0.00 0.00 33.84 32.37 1fr0 n VAL 772 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1fr0 h ALA 773 N 2.44 0.70 0.00 3.52 0.00 -1.05 -3.34 119.26 121.54 1fr0 h ALA 773 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1fr0 h ALA 773 Cb 0.36 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1fr0 h ALA 773 CO 0.00 0.79 -0.79 1.17 0.00 0.00 0.00 179.25 180.42 1fr0 n LYS 774 N -3.42 2.17 0.00 0.00 4.81 -0.96 -4.65 118.16 116.11 1fr0 n LYS 774 Ca 0.00 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.50 1fr0 n LYS 774 Cb 0.72 -0.90 0.27 0.00 0.02 0.00 0.00 35.03 35.14 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fr0 n ALA 775 N -1.43 1.59 0.33 3.14 0.00 0.32 -2.14 120.51 122.33 1fr0 n ALA 775 Ca 0.00 -0.05 0.15 0.00 0.00 0.00 0.00 53.44 53.54 1fr0 n ALA 775 Cb 0.19 -1.20 0.54 0.00 0.00 0.00 0.00 19.45 18.98 1fr0 n ALA 775 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fr0 h THR 776 N 0.00 0.00 -4.97 0.00 1.03 -1.74 -3.49 112.91 103.74 1fr0 h THR 776 Ca 0.00 -0.52 0.00 0.00 -0.01 0.00 0.00 66.41 65.89 1fr0 h THR 776 Cb 0.19 1.46 -0.06 0.00 -1.07 0.00 0.00 68.15 68.67 1fr0 h THR 776 CO 0.00 0.00 -0.99 0.29 -0.01 0.00 0.00 175.52 174.81 1fr0 n LYS 777 N -2.83 -3.81 0.00 0.00 4.76 -0.91 -5.17 118.16 110.20 1fr0 n LYS 777 Ca 0.02 2.86 0.00 0.00 -2.87 0.00 0.00 58.31 58.32 1fr0 n LYS 777 Cb 0.33 -3.82 0.00 0.00 -1.84 0.00 0.00 35.03 29.70 1fr0 n LYS 777 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39