#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 0.39 0.13 12.58 5.66 -1.26 -4.89 114.28 126.89 1fr0 n THR 655 Ca 0.00 -0.41 -0.13 0.00 -3.05 0.00 0.00 64.05 60.46 1fr0 n THR 655 Cb 0.00 0.73 -0.08 0.00 -1.55 0.00 0.00 70.33 69.43 1fr0 n THR 655 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1fr0 h GLU 656 N 0.00 -0.62 -2.81 1.09 4.57 -2.10 -2.66 114.58 112.05 1fr0 h GLU 656 Ca 0.00 0.04 -0.67 0.00 -1.18 0.00 0.00 59.36 57.55 1fr0 h GLU 656 Cb 0.91 0.14 -0.03 0.00 -0.16 0.00 0.00 28.75 29.61 1fr0 h GLU 656 CO 0.00 -0.41 3.15 -1.91 -1.18 0.00 0.00 179.01 178.66 1fr0 n GLU 657 N -4.79 3.89 -2.92 1.92 4.07 -1.26 -4.58 120.64 116.97 1fr0 n GLU 657 Ca -0.07 -2.55 -0.10 0.00 -0.06 0.00 0.00 57.16 54.38 1fr0 n GLU 657 Cb 0.33 -2.70 -0.02 0.00 -0.06 0.00 0.00 31.44 29.00 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 1fr0 n ASN 658 N 2.89 -2.68 -3.69 4.31 5.03 -1.00 -5.06 115.26 115.05 1fr0 n ASN 658 Ca 0.72 -2.81 -0.27 0.00 0.87 0.00 0.00 54.58 53.09 1fr0 n ASN 658 Cb 0.27 1.18 -0.11 0.00 -1.02 0.00 0.00 39.78 40.10 1fr0 n ASN 658 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1fr0 n SER 659 N 2.83 2.37 -3.61 6.41 2.88 -1.26 -5.02 113.62 118.22 1fr0 n SER 659 Ca 0.20 -3.07 -0.29 0.00 -1.33 0.00 0.00 58.87 54.38 1fr0 n SER 659 Cb 0.54 -0.70 0.27 0.00 -0.75 0.00 0.00 64.21 63.57 1fr0 n SER 659 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1fr0 n LYS 660 N 1.90 -3.96 0.00 -1.46 4.76 -1.26 -2.04 118.16 116.10 1fr0 n LYS 660 Ca 0.23 -1.17 0.00 0.00 -2.87 0.00 0.00 58.31 54.51 1fr0 n LYS 660 Cb 0.39 -1.92 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 1fr0 n LYS 660 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1fr0 n SER 661 N -4.96 0.00 -0.18 4.39 7.64 -1.26 -3.86 113.62 115.40 1fr0 n SER 661 Ca 0.10 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.90 1fr0 n SER 661 Cb 0.56 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.73 1fr0 n SER 661 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 1fr0 h GLU 662 N 0.00 -0.23 0.00 1.43 4.22 -1.82 1.62 114.58 119.80 1fr0 h GLU 662 Ca 0.00 0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.46 1fr0 h GLU 662 Cb 0.00 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1fr0 h GLU 662 CO 0.00 -0.15 0.00 0.00 -2.18 0.00 0.00 179.01 176.68 1fr0 n ALA 663 N -3.12 1.32 -0.09 2.92 0.00 -0.86 -2.11 120.51 118.57 1fr0 n ALA 663 Ca 0.02 -0.02 -0.13 0.00 0.00 0.00 0.00 53.44 53.32 1fr0 n ALA 663 Cb 0.35 -1.13 -0.15 0.00 0.00 0.00 0.00 19.45 18.53 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 -1.54 1.08 -4.43 0.00 4.77 0.49 -4.39 117.00 112.97 1fr0 n LEU 664 Ca 0.02 0.04 -0.25 0.00 -0.03 0.00 0.00 56.01 55.79 1fr0 n LEU 664 Cb 0.08 -0.02 -0.11 0.00 -2.33 0.00 0.00 43.42 41.04 1fr0 n LEU 664 CO 0.07 0.62 -0.50 -0.76 -1.33 0.00 0.00 177.39 175.49 1fr0 s LEU 665 N -5.95 2.51 -0.49 2.23 1.43 0.24 -2.18 118.68 116.48 1fr0 s LEU 665 Ca -0.16 -0.95 -0.24 0.00 -1.03 0.00 0.00 54.13 51.74 1fr0 s LEU 665 Cb 0.07 -1.08 0.03 0.00 0.03 0.00 0.00 46.19 45.25 1fr0 s LEU 665 CO 0.77 0.05 0.89 -0.62 0.23 0.00 0.00 176.35 177.67 1fr0 s ASP 666 N -3.10 6.42 0.07 2.29 -1.08 -0.90 -4.63 116.67 115.74 1fr0 s ASP 666 Ca 0.25 -0.10 -0.16 0.00 -0.52 0.00 0.00 52.55 52.01 1fr0 s ASP 666 Cb -0.06 -2.43 -0.15 0.00 -1.46 0.00 0.00 42.92 38.83 1fr0 s ASP 666 CO 0.12 -1.07 1.30 0.40 0.52 0.00 0.00 175.17 176.44 1fr0 h ILE 667 N 6.04 1.33 -0.16 4.11 5.03 -1.93 -1.51 117.51 130.43 1fr0 h ILE 667 Ca -0.25 -1.71 -0.20 0.00 -0.12 0.00 0.00 64.86 62.58 1fr0 h ILE 667 Cb 1.08 1.97 0.01 0.00 -3.03 0.00 0.00 36.82 36.85 1fr0 h ILE 667 CO 1.03 0.53 -0.68 1.55 -0.68 0.00 0.00 178.15 179.89 1fr0 h PRO 668 N 0.27 0.74 -0.28 2.37 0.13 -1.99 -2.25 132.00 130.99 1fr0 h PRO 668 Ca -0.01 -0.59 -0.17 0.00 -0.87 0.00 0.00 66.00 64.36 1fr0 h PRO 668 Cb 1.08 0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1fr0 h PRO 668 CO 0.10 1.20 -0.51 1.98 -0.23 0.00 0.00 178.00 180.54 1fr0 h MET 669 N 0.45 0.84 -0.47 0.86 1.85 -1.98 -2.03 114.93 114.45 1fr0 h MET 669 Ca -0.04 -0.53 -0.03 0.00 -0.61 0.00 0.00 59.70 58.49 1fr0 h MET 669 Cb 1.31 0.06 -0.02 0.00 0.43 0.00 0.00 31.60 33.38 1fr0 h MET 669 CO 0.14 1.16 0.19 -0.07 -0.40 0.00 0.00 176.91 177.93 1fr0 h LEU 670 N 0.61 0.66 -1.26 3.39 3.38 -1.32 -2.32 115.31 118.44 1fr0 h LEU 670 Ca 0.02 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 1fr0 h LEU 670 Cb 1.11 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 1fr0 h LEU 670 CO 0.11 0.65 -0.06 -0.08 0.09 0.00 0.00 178.44 179.15 1fr0 h GLU 671 N 0.63 0.42 0.34 1.13 4.81 -1.38 -2.19 114.58 118.34 1fr0 h GLU 671 Ca 0.16 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1fr0 h GLU 671 Cb 0.20 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.52 1fr0 h GLU 671 CO -0.01 0.50 -0.21 1.96 -0.73 0.00 0.00 179.01 180.52 1fr0 h GLN 672 N 0.40 -0.51 -0.26 1.92 1.08 -0.82 -1.99 115.11 114.93 1fr0 h GLN 672 Ca 0.08 0.03 -0.00 0.00 -1.45 0.00 0.00 58.65 57.31 1fr0 h GLN 672 Cb 0.37 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 1fr0 h GLN 672 CO 0.02 -0.34 0.14 1.88 -0.95 0.00 0.00 178.83 179.58 1fr0 h TYR 673 N -0.53 0.34 -0.66 2.96 0.05 -1.30 -1.96 116.97 115.87 1fr0 h TYR 673 Ca -0.04 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.78 1fr0 h TYR 673 Cb 0.44 -0.11 -0.05 0.00 1.01 0.00 0.00 36.73 38.02 1fr0 h TYR 673 CO -0.09 0.24 0.40 -0.07 -1.05 0.00 0.00 178.16 177.59 1fr0 h LEU 674 N 0.36 0.63 -0.42 3.88 -0.00 -0.73 -1.18 115.31 117.86 1fr0 h LEU 674 Ca 0.09 0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 57.85 1fr0 h LEU 674 Cb 0.01 -0.12 -0.02 0.00 -0.00 0.00 0.00 40.66 40.53 1fr0 h LEU 674 CO -0.02 0.43 -0.65 -0.08 -0.00 0.00 0.00 178.44 178.13 1fr0 h GLU 675 N 0.77 0.00 0.00 1.13 4.81 -0.93 -2.54 114.58 117.82 1fr0 h GLU 675 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1fr0 h GLU 675 Cb 0.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1fr0 h GLU 675 CO -0.13 0.65 0.00 1.28 -0.73 0.00 0.00 179.01 180.08 1fr0 n LEU 676 N -3.48 0.56 -0.06 1.64 4.77 -0.75 -4.70 117.00 114.96 1fr0 n LEU 676 Ca 0.00 0.56 -0.08 0.00 -0.03 0.00 0.00 56.01 56.47 1fr0 n LEU 676 Cb 0.71 -0.31 -0.08 0.00 -2.33 0.00 0.00 43.42 41.41 1fr0 n LEU 676 CO 0.42 -0.31 -0.92 0.52 -1.33 0.00 0.00 177.39 175.76 1fr0 n VAL 677 N -1.43 0.81 0.00 4.08 0.31 -0.63 -5.10 118.33 116.37 1fr0 n VAL 677 Ca 0.00 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.92 1fr0 n VAL 677 Cb 0.00 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.08 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 2.54 0.08 0.00 2.92 0.00 -0.54 -4.54 105.19 105.65 1fr0 n GLY 678 Ca -0.22 -2.15 0.09 0.00 0.00 0.00 0.00 46.02 43.74 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 0.09 -0.09 1.61 -0.04 -1.26 -3.11 135.00 132.20 1fr0 n PRO 679 Ca 0.00 0.17 -0.14 0.00 -0.04 0.00 0.00 63.50 63.49 1fr0 n PRO 679 Cb 0.00 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 31.91 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 0.70 0.53 0.54 1.57 -1.95 -1.19 116.57 116.77 1fr0 h LYS 680 Ca 0.00 -0.39 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 1fr0 h LYS 680 Cb 0.26 0.02 0.01 0.00 0.08 0.00 0.00 32.23 32.60 1fr0 h LYS 680 CO 0.00 1.01 -0.25 1.25 -0.57 0.00 0.00 179.45 180.89 1fr0 h LEU 681 N 0.44 -0.60 -1.04 2.94 7.12 -1.84 0.23 115.31 122.56 1fr0 h LEU 681 Ca 0.04 0.02 0.17 0.00 0.13 0.00 0.00 57.88 58.24 1fr0 h LEU 681 Cb 0.91 0.16 -0.10 0.00 -0.53 0.00 0.00 40.66 41.10 1fr0 h LEU 681 CO 0.08 -0.31 0.62 0.40 -0.13 0.00 0.00 178.44 179.09 1fr0 h ILE 682 N -0.95 0.77 -0.09 4.05 5.03 -1.68 0.38 117.51 125.02 1fr0 h ILE 682 Ca -0.07 -0.28 -0.02 0.00 -0.12 0.00 0.00 64.86 64.36 1fr0 h ILE 682 Cb 0.55 -0.12 -0.00 0.00 -3.03 0.00 0.00 36.82 34.21 1fr0 h ILE 682 CO 0.12 0.15 -0.04 0.74 -0.68 0.00 0.00 178.15 178.44 1fr0 h THR 683 N 0.82 1.31 0.51 -0.27 2.02 -1.16 0.08 112.91 116.23 1fr0 h THR 683 Ca 0.55 -1.03 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 1fr0 h THR 683 Cb 0.79 1.81 0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1fr0 h THR 683 CO -0.33 0.29 -0.25 0.44 0.37 0.00 0.00 175.52 176.04 1fr0 h ASP 684 N -0.17 -0.58 -0.60 4.18 5.19 0.53 0.91 116.42 125.88 1fr0 h ASP 684 Ca 0.02 -0.06 0.08 0.00 -0.62 0.00 0.00 57.03 56.45 1fr0 h ASP 684 Cb 0.48 0.15 -0.04 0.00 0.18 0.00 0.00 39.33 40.10 1fr0 h ASP 684 CO 0.01 -0.23 0.40 1.23 -3.12 0.00 0.00 179.24 177.54 1fr0 h GLY 685 N -0.98 0.64 1.65 2.75 0.00 -0.38 -1.03 103.07 105.72 1fr0 h GLY 685 Ca -0.07 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 1fr0 h GLY 685 CO 0.12 0.13 -0.81 -2.00 0.00 0.00 0.00 176.54 173.97 1fr0 h LEU 686 N 0.48 0.41 0.49 3.11 5.85 -0.83 -2.59 115.31 122.23 1fr0 h LEU 686 Ca 0.27 -0.30 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1fr0 h LEU 686 Cb 0.44 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.35 1fr0 h LEU 686 CO -0.08 1.06 -0.24 0.00 -0.34 0.00 0.00 178.44 178.85 1fr0 h ALA 687 N 0.92 -0.66 0.44 1.25 0.00 0.54 0.15 119.26 121.90 1fr0 h ALA 687 Ca -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1fr0 h ALA 687 Cb 1.41 0.25 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1fr0 h ALA 687 CO 0.13 -0.87 -0.21 0.28 0.00 0.00 0.00 179.25 178.58 1fr0 h VAL 688 N -0.66 0.56 -0.04 0.00 2.07 -1.56 -1.91 116.25 114.72 1fr0 h VAL 688 Ca -0.07 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.35 1fr0 h VAL 688 Cb 0.51 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1fr0 h VAL 688 CO 0.11 0.02 0.13 0.15 0.02 0.00 0.00 177.57 178.00 1fr0 h PHE 689 N -0.66 0.00 -0.03 1.57 3.57 -1.44 -1.94 116.94 118.02 1fr0 h PHE 689 Ca -0.06 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 1fr0 h PHE 689 Cb 0.49 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.23 1fr0 h PHE 689 CO -0.03 0.00 -0.07 0.93 -2.23 0.00 0.00 178.31 176.91 1fr0 h GLU 690 N 0.00 0.09 0.00 1.11 4.39 0.11 0.13 114.58 120.41 1fr0 h GLU 690 Ca 0.02 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.62 1fr0 h GLU 690 Cb 0.28 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1fr0 h GLU 690 CO -0.00 0.67 -0.18 0.87 -1.16 0.00 0.00 179.01 179.21 1fr0 h LYS 691 N -0.47 0.00 0.00 2.33 1.57 -1.04 -2.68 116.57 116.29 1fr0 h LYS 691 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fr0 h LYS 691 Cb 0.67 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.98 1fr0 h LYS 691 CO 0.01 0.18 -1.06 -0.12 -0.57 0.00 0.00 179.45 177.90 1fr0 n MET 692 N -3.48 0.34 -0.26 3.15 1.56 -0.91 -4.10 117.12 113.41 1fr0 n MET 692 Ca -0.01 0.00 -0.01 0.00 -0.27 0.00 0.00 57.70 57.41 1fr0 n MET 692 Cb 0.35 -1.62 0.11 0.00 2.15 0.00 0.00 33.22 34.21 1fr0 n MET 692 CO 0.00 0.00 0.00 1.98 -0.73 0.00 0.00 175.97 177.22 1fr0 h MET 693 N 0.00 0.80 -0.02 2.12 -1.53 -0.37 0.02 114.93 115.96 1fr0 h MET 693 Ca 0.00 -0.05 -0.10 0.00 -3.44 0.00 0.00 59.70 56.12 1fr0 h MET 693 Cb 0.77 -0.18 0.01 0.00 -0.55 0.00 0.00 31.60 31.65 1fr0 h MET 693 CO 0.00 0.53 -0.36 -1.00 0.14 0.00 0.00 176.91 176.22 1fr0 h PRO 694 N 0.83 0.27 -0.14 0.39 0.13 -1.73 -2.81 132.00 128.93 1fr0 h PRO 694 Ca 0.32 -0.27 0.04 0.00 -0.87 0.00 0.00 66.00 65.22 1fr0 h PRO 694 Cb 0.14 0.07 -0.01 0.00 0.13 0.00 0.00 31.00 31.34 1fr0 h PRO 694 CO -0.16 0.96 0.12 0.78 -0.23 0.00 0.00 178.00 179.47 1fr0 h GLY 695 N -0.31 0.00 0.43 1.56 0.00 -1.66 -1.03 103.07 102.05 1fr0 h GLY 695 Ca -0.04 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 1fr0 h GLY 695 CO 0.07 0.00 -0.15 -0.97 0.00 0.00 0.00 176.54 175.49 1fr0 h TYR 696 N 0.00 -0.38 -0.65 5.60 0.05 -0.93 -2.81 116.97 117.84 1fr0 h TYR 696 Ca 0.07 -0.01 0.12 0.00 0.05 0.00 0.00 58.73 58.96 1fr0 h TYR 696 Cb 0.30 0.13 -0.04 0.00 1.01 0.00 0.00 36.73 38.13 1fr0 h TYR 696 CO 0.00 -0.07 0.44 -0.39 -1.05 0.00 0.00 178.16 177.08 1fr0 h VAL 697 N -0.99 0.86 0.86 -2.88 -1.51 -1.20 0.14 116.25 111.52 1fr0 h VAL 697 Ca -0.04 -0.14 -0.04 0.00 -1.23 0.00 0.00 66.70 65.25 1fr0 h VAL 697 Cb 0.48 0.43 0.01 0.00 -2.13 0.00 0.00 31.29 30.07 1fr0 h VAL 697 CO 0.07 0.07 -0.43 0.28 -1.23 0.00 0.00 177.57 176.34 1fr0 h SER 698 N 0.40 -1.02 0.00 4.19 0.02 -1.18 -1.40 113.55 114.56 1fr0 h SER 698 Ca 0.31 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 61.30 1fr0 h SER 698 Cb 0.66 0.27 -0.00 0.00 0.14 0.00 0.00 62.40 63.47 1fr0 h SER 698 CO -0.09 -0.71 -0.00 1.62 -1.14 0.00 0.00 176.83 176.51 1fr0 h VAL 699 N -1.17 0.14 0.39 2.27 3.04 -1.18 -2.31 116.25 117.45 1fr0 h VAL 699 Ca -0.12 -0.00 -0.02 0.00 -1.01 0.00 0.00 66.70 65.55 1fr0 h VAL 699 Cb 0.90 1.00 0.00 0.00 -2.01 0.00 0.00 31.29 31.19 1fr0 h VAL 699 CO 0.18 0.00 -0.19 -0.07 -1.01 0.00 0.00 177.57 176.48 1fr0 h LEU 700 N 0.00 -0.45 -1.45 3.16 -0.00 0.08 -2.66 115.31 113.99 1fr0 h LEU 700 Ca -0.00 -0.05 -0.05 0.00 -0.00 0.00 0.00 57.88 57.78 1fr0 h LEU 700 Cb 0.00 0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.77 1fr0 h LEU 700 CO 0.00 -0.23 -0.23 -0.08 -0.00 0.00 0.00 178.44 177.89 1fr0 h GLU 701 N -0.64 0.06 0.07 1.13 4.57 -0.84 -2.38 114.58 116.55 1fr0 h GLU 701 Ca -0.05 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1fr0 h GLU 701 Cb 0.47 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.03 1fr0 h GLU 701 CO 0.09 0.30 -0.15 0.77 -1.18 0.00 0.00 179.01 178.84 1fr0 h SER 702 N 0.06 -0.41 0.56 1.04 0.02 -1.18 -2.23 113.55 111.40 1fr0 h SER 702 Ca 0.01 0.05 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 1fr0 h SER 702 Cb 0.45 0.16 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 1fr0 h SER 702 CO 0.03 -0.21 -0.50 -0.55 -1.14 0.00 0.00 176.83 174.46 1fr0 h ASN 703 N -0.28 0.00 -0.63 3.07 7.08 -1.35 -3.07 115.58 120.40 1fr0 h ASN 703 Ca 0.03 0.00 0.07 0.00 -3.08 0.00 0.00 56.30 53.32 1fr0 h ASN 703 Cb 0.31 0.00 -0.06 0.00 -2.08 0.00 0.00 38.32 36.49 1fr0 h ASN 703 CO -0.10 0.50 0.31 0.25 -2.08 0.00 0.00 177.43 176.31 1fr0 h LEU 704 N 0.00 0.41 -1.98 6.14 5.85 -0.88 0.16 115.31 125.02 1fr0 h LEU 704 Ca -0.00 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1fr0 h LEU 704 Cb 0.91 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.92 1fr0 h LEU 704 CO 0.06 0.26 -0.11 0.71 -0.34 0.00 0.00 178.44 179.03 1fr0 h THR 705 N 0.56 0.67 -0.52 1.05 1.35 -1.37 -0.40 112.91 114.24 1fr0 h THR 705 Ca 0.30 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1fr0 h THR 705 Cb 0.27 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1fr0 h THR 705 CO -0.23 0.10 0.00 0.00 -0.25 0.00 0.00 175.52 175.15 1fr0 n ALA 706 N -2.33 2.42 -3.73 6.62 0.00 0.45 -4.92 120.51 119.01 1fr0 n ALA 706 Ca -0.02 -0.92 -0.26 0.00 0.00 0.00 0.00 53.44 52.23 1fr0 n ALA 706 Cb 0.21 -0.96 0.05 0.00 0.00 0.00 0.00 19.45 18.75 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 1.05 -6.71 -1.34 0.00 1.13 -0.16 -4.84 117.38 106.51 1fr0 n GLN 707 Ca 0.18 0.72 -0.32 0.00 -1.94 0.00 0.00 57.00 55.63 1fr0 n GLN 707 Cb 0.45 -5.68 -0.06 0.00 0.11 0.00 0.00 30.24 25.06 1fr0 n GLN 707 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1fr0 n ASP 708 N -2.95 7.77 -0.16 1.08 2.03 -0.56 -4.75 116.55 119.01 1fr0 n ASP 708 Ca -0.01 -2.66 -0.06 0.00 0.52 0.00 0.00 54.79 52.58 1fr0 n ASP 708 Cb 0.56 -1.48 -0.05 0.00 -0.72 0.00 0.00 41.12 39.43 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 1fr0 h LYS 709 N 4.39 -0.05 -1.22 -0.67 1.79 -1.88 0.59 116.57 119.52 1fr0 h LYS 709 Ca 0.68 0.00 0.38 0.00 -2.18 0.00 0.00 60.65 59.53 1fr0 h LYS 709 Cb 0.58 0.01 -0.12 0.00 -1.58 0.00 0.00 32.23 31.13 1fr0 h LYS 709 CO 1.35 -0.04 0.78 1.57 -1.08 0.00 0.00 179.45 182.03 1fr0 h LYS 710 N -0.05 0.18 0.16 3.15 2.10 -2.00 0.54 116.57 120.64 1fr0 h LYS 710 Ca 0.06 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.70 1fr0 h LYS 710 Cb 0.22 -0.04 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 1fr0 h LYS 710 CO -0.40 0.12 -0.07 0.78 -2.00 0.00 0.00 179.45 177.87 1fr0 h GLY 711 N 0.18 -0.22 0.30 0.07 0.00 -0.28 -2.74 103.07 100.39 1fr0 h GLY 711 Ca 0.74 0.08 0.07 0.00 0.00 0.00 0.00 47.33 48.22 1fr0 h GLY 711 CO -0.39 -0.08 -0.10 -2.22 0.00 0.00 0.00 176.54 173.75 1fr0 h ILE 712 N -0.73 0.63 0.12 2.60 2.04 0.77 -1.34 117.51 121.60 1fr0 h ILE 712 Ca -0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.86 1fr0 h ILE 712 Cb 0.51 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1fr0 h ILE 712 CO 0.04 0.00 -0.28 0.58 0.00 0.00 0.00 178.15 178.48 1fr0 h VAL 713 N -0.03 0.39 -0.21 1.67 2.07 -1.35 0.78 116.25 119.57 1fr0 h VAL 713 Ca 0.16 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.74 1fr0 h VAL 713 Cb 0.27 0.39 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 1fr0 h VAL 713 CO -0.35 0.00 -0.21 -0.33 0.02 0.00 0.00 177.57 176.70 1fr0 h GLU 714 N -0.50 -0.22 0.00 1.57 4.39 -1.14 0.65 114.58 119.33 1fr0 h GLU 714 Ca 0.03 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1fr0 h GLU 714 Cb 0.52 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 1fr0 h GLU 714 CO -0.16 -0.14 0.00 0.39 -1.16 0.00 0.00 179.01 177.94 1fr0 n GLU 715 N -5.35 0.01 0.02 2.33 1.02 -0.54 -1.92 120.64 116.20 1fr0 n GLU 715 Ca -0.01 0.39 -0.01 0.00 -0.02 0.00 0.00 57.16 57.50 1fr0 n GLU 715 Cb 0.27 -1.53 -0.00 0.00 -0.02 0.00 0.00 31.44 30.15 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 1.23 -0.07 2.00 0.62 0.00 0.28 -2.53 103.07 104.60 1fr0 h GLY 716 Ca 0.00 0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1fr0 h GLY 716 CO 0.00 -0.02 -0.25 1.12 0.00 0.00 0.00 176.54 177.38 1fr0 h HIS 717 N -0.19 0.00 0.15 5.60 2.07 -1.48 -1.41 115.15 119.88 1fr0 h HIS 717 Ca -0.01 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 1fr0 h HIS 717 Cb 0.05 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.03 1fr0 h HIS 717 CO 0.05 0.25 -0.07 -0.22 -3.07 0.00 0.00 177.93 174.87 1fr0 h LYS 718 N 0.00 -0.19 0.45 5.12 3.64 -1.52 0.33 116.57 124.40 1fr0 h LYS 718 Ca -0.00 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.37 1fr0 h LYS 718 Cb 0.58 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1fr0 h LYS 718 CO 0.03 0.24 -0.22 0.82 -2.27 0.00 0.00 179.45 178.05 1fr0 h ILE 719 N -0.73 0.00 -0.33 2.00 2.04 -1.42 -2.24 117.51 116.83 1fr0 h ILE 719 Ca -0.02 -0.51 0.08 0.00 1.00 0.00 0.00 64.86 65.41 1fr0 h ILE 719 Cb 0.52 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1fr0 h ILE 719 CO 0.03 0.00 0.23 0.11 0.00 0.00 0.00 178.15 178.53 1fr0 h LYS 720 N -1.11 0.10 0.08 2.37 6.56 -1.42 0.17 116.57 123.32 1fr0 h LYS 720 Ca -0.06 -0.01 -0.00 0.00 -1.06 0.00 0.00 60.65 59.52 1fr0 h LYS 720 Cb 0.46 -0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.10 1fr0 h LYS 720 CO 0.10 0.06 -0.04 0.78 -2.06 0.00 0.00 179.45 178.29 1fr0 h GLY 721 N 0.10 -0.12 1.23 3.86 0.00 -0.91 0.68 103.07 107.91 1fr0 h GLY 721 Ca 0.15 0.04 -0.14 0.00 0.00 0.00 0.00 47.33 47.38 1fr0 h GLY 721 CO -0.02 -0.04 -0.34 0.00 0.00 0.00 0.00 176.54 176.14 1fr0 h ALA 722 N 0.56 0.69 -0.79 3.60 0.00 -0.71 -3.00 119.26 119.60 1fr0 h ALA 722 Ca -0.01 -0.43 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 1fr0 h ALA 722 Cb 0.28 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 1fr0 h ALA 722 CO 0.02 0.67 0.33 0.00 0.00 0.00 0.00 179.25 180.26 1fr0 h ALA 723 N 0.90 1.08 0.00 0.00 0.00 -0.61 -1.22 119.26 119.41 1fr0 h ALA 723 Ca 0.07 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fr0 h ALA 723 Cb 0.90 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1fr0 h ALA 723 CO 0.08 0.66 0.00 0.78 0.00 0.00 0.00 179.25 180.77 1fr0 h GLY 724 N 1.16 0.00 2.00 0.00 0.00 -0.74 -1.69 103.07 103.80 1fr0 h GLY 724 Ca 0.27 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.47 1fr0 h GLY 724 CO -0.02 0.00 -0.61 0.23 0.00 0.00 0.00 176.54 176.14 1fr0 h SER 725 N 0.00 0.00 0.41 0.19 0.87 -1.09 -2.48 113.55 111.46 1fr0 h SER 725 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1fr0 h SER 725 Cb 0.28 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.24 1fr0 h SER 725 CO 0.00 0.61 -0.02 0.52 -0.53 0.00 0.00 176.83 177.41 1fr0 n VAL 726 N -3.80 0.00 0.00 2.23 0.31 -0.69 -4.81 118.33 111.58 1fr0 n VAL 726 Ca -0.01 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1fr0 n VAL 726 Cb 0.61 -0.43 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 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 1.22 1.34 3.08 2.92 0.00 -0.94 -4.95 105.19 107.86 1fr0 n GLY 727 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 1fr0 n GLY 727 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fr0 n LEU 728 N 0.00 6.16 0.21 0.99 4.77 0.11 -2.12 117.00 127.12 1fr0 n LEU 728 Ca 0.00 -4.65 0.05 0.00 -0.03 0.00 0.00 56.01 51.37 1fr0 n LEU 728 Cb 0.00 -1.50 0.44 0.00 -2.33 0.00 0.00 43.42 40.03 1fr0 n LEU 728 CO 0.00 1.21 0.81 0.08 -1.33 0.00 0.00 177.39 178.16 1fr0 h ARG 729 N 6.17 0.00 0.00 3.23 -0.00 -1.66 -1.89 114.38 120.23 1fr0 h ARG 729 Ca 0.35 0.00 -0.08 0.00 -0.00 0.00 0.00 59.98 60.25 1fr0 h ARG 729 Cb 0.71 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.67 1fr0 h ARG 729 CO 1.47 0.28 -0.37 1.25 -0.00 0.00 0.00 179.97 182.60 1fr0 h HIS 730 N 0.00 0.00 0.10 4.08 2.76 -1.64 -2.76 115.15 117.68 1fr0 h HIS 730 Ca -0.00 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1fr0 h HIS 730 Cb 0.51 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.47 1fr0 h HIS 730 CO 0.00 0.37 -0.05 -0.07 -1.30 0.00 0.00 177.93 176.88 1fr0 h LEU 731 N 0.00 -0.11 -0.73 0.26 -0.00 -1.58 -2.55 115.31 110.59 1fr0 h LEU 731 Ca -0.00 -0.47 0.13 0.00 -0.00 0.00 0.00 57.88 57.54 1fr0 h LEU 731 Cb 0.75 0.03 -0.09 0.00 -0.00 0.00 0.00 40.66 41.35 1fr0 h LEU 731 CO 0.05 0.49 0.28 -0.61 -0.00 0.00 0.00 178.44 178.65 1fr0 h GLN 732 N -0.80 0.42 0.53 1.13 4.15 -1.34 -2.15 115.11 117.06 1fr0 h GLN 732 Ca -0.01 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.36 1fr0 h GLN 732 Cb 0.58 -0.09 0.01 0.00 0.21 0.00 0.00 27.48 28.18 1fr0 h GLN 732 CO 0.02 0.27 -0.26 1.96 -1.93 0.00 0.00 178.83 178.90 1fr0 h GLN 733 N 0.43 -0.69 -0.90 1.69 1.08 -1.54 -1.49 115.11 113.69 1fr0 h GLN 733 Ca 0.40 0.05 0.24 0.00 -1.45 0.00 0.00 58.65 57.88 1fr0 h GLN 733 Cb 0.59 0.16 -0.16 0.00 -0.05 0.00 0.00 27.48 28.02 1fr0 h GLN 733 CO -0.39 -0.44 0.12 -0.07 -0.95 0.00 0.00 178.83 177.10 1fr0 h LEU 734 N -0.78 -0.23 -0.24 1.46 3.38 -0.96 0.34 115.31 118.28 1fr0 h LEU 734 Ca -0.07 0.23 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 1fr0 h LEU 734 Cb 0.58 0.36 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1fr0 h LEU 734 CO 0.12 -0.24 0.03 1.23 0.09 0.00 0.00 178.44 179.67 1fr0 h GLY 735 N 0.11 0.44 -0.65 0.83 0.00 -1.16 -2.24 103.07 100.41 1fr0 h GLY 735 Ca 0.55 -0.30 0.36 0.00 0.00 0.00 0.00 47.33 47.94 1fr0 h GLY 735 CO -0.76 0.28 0.80 -1.61 0.00 0.00 0.00 176.54 175.25 1fr0 h GLN 736 N 0.21 0.19 0.19 4.80 4.15 0.74 0.40 115.11 125.78 1fr0 h GLN 736 Ca 0.07 -0.01 -0.31 0.00 0.77 0.00 0.00 58.65 59.17 1fr0 h GLN 736 Cb 0.34 -0.04 0.02 0.00 0.21 0.00 0.00 27.48 28.00 1fr0 h GLN 736 CO 0.01 0.12 -1.45 1.96 -1.93 0.00 0.00 178.83 177.54 1fr0 h GLN 737 N 0.19 0.39 0.00 1.69 1.08 -1.03 -3.22 115.11 114.21 1fr0 h GLN 737 Ca 0.70 -0.67 0.00 0.00 -1.45 0.00 0.00 58.65 57.23 1fr0 h GLN 737 Cb 2.15 0.25 0.00 0.00 -0.05 0.00 0.00 27.48 29.83 1fr0 h GLN 737 CO -0.29 1.30 0.00 0.82 -0.95 0.00 0.00 178.83 179.72 1fr0 h ILE 738 N 0.11 0.00 -0.17 2.54 2.04 0.34 -1.02 117.51 121.35 1fr0 h ILE 738 Ca -0.23 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.59 1fr0 h ILE 738 Cb 2.08 0.76 0.00 0.00 -0.74 0.00 0.00 36.82 38.91 1fr0 h ILE 738 CO 0.22 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.37 1fr0 n GLN 739 N -2.59 1.93 -2.69 2.37 3.00 -0.72 -4.02 117.38 114.67 1fr0 n GLN 739 Ca -0.02 -0.83 -0.16 0.00 -0.01 0.00 0.00 57.00 55.98 1fr0 n GLN 739 Cb 0.08 -1.58 0.01 0.00 0.00 0.00 0.00 30.24 28.74 1fr0 n GLN 739 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1fr0 n SER 740 N 0.15 2.45 -2.67 1.08 7.64 -0.39 -4.96 113.62 116.92 1fr0 n SER 740 Ca 0.07 -3.08 -0.08 0.00 1.01 0.00 0.00 58.87 56.80 1fr0 n SER 740 Cb 0.43 -0.52 -0.03 0.00 -1.01 0.00 0.00 64.21 63.07 1fr0 n SER 740 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1fr0 n PRO 741 N -0.15 0.89 0.00 1.43 -0.04 -1.26 -2.76 135.00 133.11 1fr0 n PRO 741 Ca 0.20 -0.64 0.00 0.00 -0.04 0.00 0.00 63.50 63.02 1fr0 n PRO 741 Cb 0.73 -1.92 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 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 3.59 0.72 -4.76 3.54 5.75 -1.26 -4.98 116.55 119.15 1fr0 n ASP 742 Ca 0.19 0.00 -0.41 0.00 -0.01 0.00 0.00 54.79 54.56 1fr0 n ASP 742 Cb 0.20 0.13 -0.02 0.00 -1.03 0.00 0.00 41.12 40.40 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 -0.60 4.40 0.16 -2.12 1.02 -1.11 -4.86 118.68 115.57 1fr0 s LEU 743 Ca 0.00 2.67 0.17 0.00 0.02 0.00 0.00 54.13 56.99 1fr0 s LEU 743 Cb 0.00 -3.63 0.77 0.00 0.02 0.00 0.00 46.19 43.35 1fr0 s LEU 743 CO 0.00 -0.63 1.53 -0.81 0.02 0.00 0.00 176.35 176.46 1fr0 n PRO 744 N 1.67 0.10 -0.06 1.29 -0.04 -1.26 -1.78 135.00 134.92 1fr0 n PRO 744 Ca 0.04 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 1fr0 n PRO 744 Cb 0.41 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 31.98 1fr0 n PRO 744 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fr0 n ALA 745 N -1.66 2.15 -0.07 0.55 0.00 -1.26 -4.31 120.51 115.91 1fr0 n ALA 745 Ca 0.02 -0.93 -0.14 0.00 0.00 0.00 0.00 53.44 52.39 1fr0 n ALA 745 Cb 0.14 -0.46 -0.06 0.00 0.00 0.00 0.00 19.45 19.08 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 0.70 0.00 0.00 7.01 -1.70 0.80 115.95 122.75 1fr0 h TRP 746 Ca -0.28 -0.22 0.00 0.00 2.11 0.00 0.00 58.89 60.50 1fr0 h TRP 746 Cb 1.62 -0.14 0.00 0.00 -2.10 0.00 0.00 29.16 28.54 1fr0 h TRP 746 CO 0.00 0.94 0.11 1.05 -2.79 0.00 0.00 178.44 177.75 1fr0 h GLU 747 N 0.25 0.00 -0.01 2.65 4.11 -1.69 0.22 114.58 120.12 1fr0 h GLU 747 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.46 1fr0 h GLU 747 Cb 0.85 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.10 1fr0 h GLU 747 CO 0.07 0.00 -0.22 -3.47 0.07 0.00 0.00 179.01 175.45 1fr0 n ASP 748 N -2.81 1.30 -0.01 3.06 -0.08 -0.94 -4.49 116.55 112.57 1fr0 n ASP 748 Ca -0.02 -1.15 0.06 0.00 -1.51 0.00 0.00 54.79 52.17 1fr0 n ASP 748 Cb 0.16 0.46 -0.11 0.00 2.34 0.00 0.00 41.12 43.97 1fr0 n ASP 748 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1fr0 n ASN 749 N -0.21 1.72 -0.18 1.67 3.02 0.25 -4.57 115.26 116.96 1fr0 n ASN 749 Ca 0.05 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.55 1fr0 n ASN 749 Cb 0.23 1.58 0.02 0.00 -0.61 0.00 0.00 39.78 41.00 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1fr0 h VAL 750 N 0.00 0.24 -0.86 2.41 2.07 -0.92 -0.42 116.25 118.78 1fr0 h VAL 750 Ca -0.03 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.65 1fr0 h VAL 750 Cb 0.76 0.24 -0.16 0.00 -1.52 0.00 0.00 31.29 30.62 1fr0 h VAL 750 CO 0.00 0.00 -0.28 1.23 0.02 0.00 0.00 177.57 178.54 1fr0 h GLY 751 N -0.14 0.37 1.38 2.17 0.00 -1.85 0.39 103.07 105.40 1fr0 h GLY 751 Ca 0.24 0.37 -0.11 0.00 0.00 0.00 0.00 47.33 47.83 1fr0 h GLY 751 CO -0.64 -0.28 -0.21 -2.09 0.00 0.00 0.00 176.54 173.32 1fr0 h GLU 752 N -0.03 0.72 0.12 4.80 4.81 -1.42 -2.76 114.58 120.82 1fr0 h GLU 752 Ca 0.37 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.34 1fr0 h GLU 752 Cb 0.62 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.91 1fr0 h GLU 752 CO -0.89 0.87 -0.50 -1.49 -0.73 0.00 0.00 179.01 176.27 1fr0 h TRP 753 N 0.63 -1.46 -0.38 0.92 6.55 0.95 0.14 115.95 123.30 1fr0 h TRP 753 Ca 0.09 0.04 0.01 0.00 0.95 0.00 0.00 58.89 59.98 1fr0 h TRP 753 Cb 0.70 0.62 -0.02 0.00 -0.86 0.00 0.00 29.16 29.60 1fr0 h TRP 753 CO 0.03 -0.57 0.23 0.82 -1.05 0.00 0.00 178.44 177.90 1fr0 h ILE 754 N -0.73 1.06 0.16 1.49 5.03 -1.48 0.14 117.51 123.18 1fr0 h ILE 754 Ca -0.01 -0.16 0.02 0.00 -0.12 0.00 0.00 64.86 64.59 1fr0 h ILE 754 Cb 0.73 0.55 -0.04 0.00 -3.03 0.00 0.00 36.82 35.02 1fr0 h ILE 754 CO -0.27 0.09 -0.40 -0.33 -0.68 0.00 0.00 178.15 176.56 1fr0 h GLU 755 N 0.47 -0.64 0.21 2.37 5.08 -1.14 -1.27 114.58 119.67 1fr0 h GLU 755 Ca 0.15 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 1fr0 h GLU 755 Cb -0.02 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1fr0 h GLU 755 CO -0.06 -0.42 -0.10 1.49 -1.00 0.00 0.00 179.01 178.92 1fr0 h GLU 756 N -0.66 -0.27 -0.89 2.33 4.57 -0.59 -2.58 114.58 116.49 1fr0 h GLU 756 Ca 0.02 0.02 0.23 0.00 -1.18 0.00 0.00 59.36 58.44 1fr0 h GLU 756 Cb 0.67 0.06 -0.16 0.00 -0.16 0.00 0.00 28.75 29.17 1fr0 h GLU 756 CO -0.21 -0.06 0.06 1.98 -1.18 0.00 0.00 179.01 179.60 1fr0 h MET 757 N -0.45 0.08 0.80 1.92 4.05 -0.55 -0.70 114.93 120.08 1fr0 h MET 757 Ca -0.03 -0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.35 1fr0 h MET 757 Cb 0.34 -0.02 0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1fr0 h MET 757 CO 0.05 0.05 -0.39 -0.22 0.23 0.00 0.00 176.91 176.63 1fr0 h LYS 758 N 0.08 -1.04 -2.63 0.39 3.64 -1.05 -0.02 116.57 115.95 1fr0 h LYS 758 Ca 0.52 0.07 -0.52 0.00 -1.27 0.00 0.00 60.65 59.45 1fr0 h LYS 758 Cb 1.02 0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 1fr0 h LYS 758 CO -0.78 -0.68 2.32 0.39 -2.27 0.00 0.00 179.45 178.43 1fr0 n GLU 759 N -5.52 3.20 0.00 1.90 1.02 -0.30 -3.81 120.64 117.13 1fr0 n GLU 759 Ca -0.14 -1.93 0.00 0.00 -0.02 0.00 0.00 57.16 55.07 1fr0 n GLU 759 Cb 0.43 -2.52 0.00 0.00 -0.02 0.00 0.00 31.44 29.34 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 3.01 0.00 -0.23 3.49 2.13 -1.02 -4.90 120.64 123.12 1fr0 n GLU 760 Ca 0.66 0.00 0.03 0.00 0.66 0.00 0.00 57.16 58.51 1fr0 n GLU 760 Cb 0.46 0.00 0.13 0.00 0.27 0.00 0.00 31.44 32.30 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 -0.03 -0.13 4.31 5.08 -1.09 -0.31 115.95 123.78 1fr0 h TRP 761 Ca 0.00 0.05 0.04 0.00 1.08 0.00 0.00 58.89 60.06 1fr0 h TRP 761 Cb 0.00 0.12 -0.05 0.00 -3.00 0.00 0.00 29.16 26.23 1fr0 h TRP 761 CO 0.00 -0.20 -0.18 -0.09 -1.28 0.00 0.00 178.44 176.70 1fr0 h ARG 762 N 0.12 -0.22 -0.72 0.12 2.43 -1.81 -2.13 114.38 112.17 1fr0 h ARG 762 Ca 0.37 0.01 0.11 0.00 -0.81 0.00 0.00 59.98 59.67 1fr0 h ARG 762 Cb 0.63 0.05 -0.12 0.00 -0.42 0.00 0.00 29.97 30.11 1fr0 h ARG 762 CO -0.59 -0.14 -0.40 1.25 -1.51 0.00 0.00 179.97 178.57 1fr0 h HIS 763 N -0.22 -1.17 -0.47 2.20 2.76 -1.42 0.14 115.15 116.97 1fr0 h HIS 763 Ca 0.10 0.09 0.08 0.00 -2.20 0.00 0.00 60.37 58.44 1fr0 h HIS 763 Cb 0.36 0.62 -0.10 0.00 1.55 0.00 0.00 27.41 29.84 1fr0 h HIS 763 CO -0.29 -0.40 -0.37 -0.44 -1.30 0.00 0.00 177.93 175.13 1fr0 h ASP 764 N -0.13 -1.25 -0.86 3.26 5.19 -1.07 0.23 116.42 121.78 1fr0 h ASP 764 Ca 0.24 0.21 0.13 0.00 -0.62 0.00 0.00 57.03 56.99 1fr0 h ASP 764 Cb 0.56 0.58 -0.09 0.00 0.18 0.00 0.00 39.33 40.56 1fr0 h ASP 764 CO -0.78 -0.33 0.48 0.58 -3.12 0.00 0.00 179.24 176.06 1fr0 h VAL 765 N -0.25 0.81 0.47 -1.35 2.07 -0.52 0.19 116.25 117.67 1fr0 h VAL 765 Ca 0.18 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1fr0 h VAL 765 Cb 0.56 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.35 1fr0 h VAL 765 CO -0.60 0.13 -0.25 -0.08 0.02 0.00 0.00 177.57 176.79 1fr0 h GLU 766 N 0.73 -0.64 -0.85 1.57 4.81 0.11 -2.10 114.58 118.21 1fr0 h GLU 766 Ca 0.45 0.04 0.16 0.00 -0.13 0.00 0.00 59.36 59.89 1fr0 h GLU 766 Cb 0.55 0.15 -0.06 0.00 0.63 0.00 0.00 28.75 30.01 1fr0 h GLU 766 CO -0.31 -0.43 0.56 0.28 -0.73 0.00 0.00 179.01 178.38 1fr0 h VAL 767 N -0.66 0.77 0.40 0.32 2.07 -0.90 -2.09 116.25 116.16 1fr0 h VAL 767 Ca -0.06 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1fr0 h VAL 767 Cb 0.52 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 30.47 1fr0 h VAL 767 CO 0.09 0.09 -0.52 0.25 0.02 0.00 0.00 177.57 177.50 1fr0 h LEU 768 N 0.52 -1.47 -0.67 2.57 5.85 -0.26 0.19 115.31 122.04 1fr0 h LEU 768 Ca 0.43 0.13 0.14 0.00 0.84 0.00 0.00 57.88 59.42 1fr0 h LEU 768 Cb 0.90 0.50 -0.11 0.00 0.37 0.00 0.00 40.66 42.32 1fr0 h LEU 768 CO -0.17 -0.65 0.07 0.11 -0.34 0.00 0.00 178.44 177.46 1fr0 h LYS 769 N -0.95 0.17 -0.45 1.25 1.57 -0.70 0.57 116.57 118.03 1fr0 h LYS 769 Ca -0.05 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.75 1fr0 h LYS 769 Cb 0.85 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.09 1fr0 h LYS 769 CO -0.13 0.11 0.25 0.00 -0.57 0.00 0.00 179.45 179.12 1fr0 h ALA 770 N 1.59 0.57 -1.00 3.86 0.00 -1.10 -1.41 119.26 121.76 1fr0 h ALA 770 Ca 0.36 -0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.49 1fr0 h ALA 770 Cb 0.60 -0.11 -0.12 0.00 0.00 0.00 0.00 17.79 18.17 1fr0 h ALA 770 CO -0.53 -0.07 0.60 2.35 0.00 0.00 0.00 179.25 181.60 1fr0 h TRP 771 N 0.51 1.04 -0.36 0.00 7.01 0.17 0.50 115.95 124.82 1fr0 h TRP 771 Ca 0.19 0.04 -0.12 0.00 2.11 0.00 0.00 58.89 61.10 1fr0 h TRP 771 Cb 0.04 -0.31 -0.01 0.00 -2.10 0.00 0.00 29.16 26.79 1fr0 h TRP 771 CO -0.08 0.14 -0.25 0.28 -2.79 0.00 0.00 178.44 175.74 1fr0 h VAL 772 N 0.67 1.28 -0.00 2.65 2.07 -0.75 0.26 116.25 122.44 1fr0 h VAL 772 Ca 0.62 -1.40 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1fr0 h VAL 772 Cb 1.08 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.24 1fr0 h VAL 772 CO -0.43 0.46 -0.00 0.00 0.02 0.00 0.00 177.57 177.62 1fr0 n ALA 773 N -2.50 2.63 -0.07 1.67 0.00 0.39 -3.55 120.51 119.09 1fr0 n ALA 773 Ca -0.02 -0.19 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 1fr0 n ALA 773 Cb 0.46 -1.51 -0.05 0.00 0.00 0.00 0.00 19.45 18.35 1fr0 n ALA 773 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1fr0 n LYS 774 N -1.07 0.30 0.15 0.00 4.01 0.15 -4.49 118.16 117.21 1fr0 n LYS 774 Ca 0.21 0.12 0.10 0.00 -0.51 0.00 0.00 58.31 58.23 1fr0 n LYS 774 Cb 0.15 -1.05 0.54 0.00 -0.51 0.00 0.00 35.03 34.16 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1fr0 n ALA 775 N -3.47 1.05 -1.38 7.82 0.00 0.89 -3.17 120.51 122.24 1fr0 n ALA 775 Ca -0.27 0.18 -0.28 0.00 0.00 0.00 0.00 53.44 53.07 1fr0 n ALA 775 Cb 0.71 -1.29 -0.07 0.00 0.00 0.00 0.00 19.45 18.79 1fr0 n ALA 775 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1fr0 n THR 776 N -2.20 3.89 -3.66 0.00 -1.04 -1.23 -4.69 114.28 105.35 1fr0 n THR 776 Ca -0.01 -2.67 -0.27 0.00 -2.04 0.00 0.00 64.05 59.05 1fr0 n THR 776 Cb 0.03 -2.11 -0.10 0.00 -1.82 0.00 0.00 70.33 66.33 1fr0 n THR 776 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1fr0 n LYS 777 N 2.33 2.09 -0.56 -2.82 4.81 -1.19 -5.07 118.16 117.75 1fr0 n LYS 777 Ca 0.58 -4.52 0.00 0.00 -0.87 0.00 0.00 58.31 53.50 1fr0 n LYS 777 Cb 0.51 -2.24 0.00 0.00 0.02 0.00 0.00 35.03 33.32 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20