#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 0.00 -1.11 4.28 -1.04 -1.26 -4.84 114.28 110.30 1fr0 n THR 655 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1fr0 n THR 655 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1fr0 n THR 655 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1fr0 n GLU 656 N 0.00 -3.19 0.00 -2.82 2.13 -1.26 -4.96 120.64 110.55 1fr0 n GLU 656 Ca 0.00 2.36 0.00 0.00 0.66 0.00 0.00 57.16 60.18 1fr0 n GLU 656 Cb 0.00 -2.64 0.00 0.00 0.27 0.00 0.00 31.44 29.07 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 -0.71 0.45 -3.72 5.31 0.28 -1.26 -5.00 120.64 115.99 1fr0 n GLU 657 Ca 0.00 -0.56 -0.28 0.00 -0.16 0.00 0.00 57.16 56.16 1fr0 n GLU 657 Cb 0.00 -0.66 -0.16 0.00 1.43 0.00 0.00 31.44 32.05 1fr0 n GLU 657 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 177.13 178.18 1fr0 s ASN 658 N -0.19 3.21 -0.19 -1.84 3.04 -1.26 -4.98 114.94 112.72 1fr0 s ASN 658 Ca 0.00 -1.03 0.19 0.00 0.04 0.00 0.00 52.86 52.06 1fr0 s ASN 658 Cb 0.00 -0.64 0.47 0.00 -1.54 0.00 0.00 41.25 39.54 1fr0 s ASN 658 CO 0.00 -0.34 1.15 -1.20 -3.04 0.00 0.00 177.10 173.67 1fr0 n SER 659 N 5.02 2.08 0.12 -4.21 7.64 -1.26 -4.82 113.62 118.19 1fr0 n SER 659 Ca -0.07 -2.56 0.12 0.00 1.01 0.00 0.00 58.87 57.36 1fr0 n SER 659 Cb 0.46 -0.41 0.47 0.00 -1.01 0.00 0.00 64.21 63.71 1fr0 n SER 659 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fr0 n LYS 660 N -0.40 0.19 0.00 1.43 4.76 -1.26 -2.13 118.16 120.75 1fr0 n LYS 660 Ca 0.15 0.38 0.00 0.00 -2.87 0.00 0.00 58.31 55.97 1fr0 n LYS 660 Cb 0.91 -1.83 0.00 0.00 -1.84 0.00 0.00 35.03 32.27 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 -2.18 0.88 -0.00 4.39 7.64 -1.26 -4.75 113.62 118.34 1fr0 n SER 661 Ca 0.03 -1.35 0.01 0.00 1.01 0.00 0.00 58.87 58.57 1fr0 n SER 661 Cb 0.25 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 1fr0 n SER 661 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1fr0 n GLU 662 N -0.17 0.50 0.03 1.43 -0.58 -1.17 -4.48 120.64 116.19 1fr0 n GLU 662 Ca 0.00 -0.02 0.13 0.00 -0.42 0.00 0.00 57.16 56.85 1fr0 n GLU 662 Cb 0.28 -1.03 0.54 0.00 -0.57 0.00 0.00 31.44 30.66 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1fr0 n ALA 663 N -1.55 2.23 0.04 0.62 0.00 -0.91 -3.18 120.51 117.77 1fr0 n ALA 663 Ca -0.00 -0.07 0.11 0.00 0.00 0.00 0.00 53.44 53.47 1fr0 n ALA 663 Cb 0.07 -1.44 -0.16 0.00 0.00 0.00 0.00 19.45 17.91 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 -1.68 0.08 -4.26 0.00 4.77 -1.26 -4.65 117.00 110.00 1fr0 n LEU 664 Ca 0.06 -0.01 -0.17 0.00 -0.03 0.00 0.00 56.01 55.86 1fr0 n LEU 664 Cb 0.34 -0.00 -0.11 0.00 -2.33 0.00 0.00 43.42 41.32 1fr0 n LEU 664 CO 0.26 0.01 -0.44 -0.76 -1.33 0.00 0.00 177.39 175.13 1fr0 s LEU 665 N -4.48 2.46 -0.80 2.23 1.43 -1.19 -2.64 118.68 115.70 1fr0 s LEU 665 Ca -0.07 -0.89 -0.23 0.00 -1.03 0.00 0.00 54.13 51.91 1fr0 s LEU 665 Cb 0.14 -0.50 0.07 0.00 0.03 0.00 0.00 46.19 45.92 1fr0 s LEU 665 CO 0.90 -0.20 1.17 -0.62 0.23 0.00 0.00 176.35 177.83 1fr0 s ASP 666 N -2.76 6.31 0.21 2.29 -1.08 -0.78 -4.77 116.67 116.09 1fr0 s ASP 666 Ca 0.13 -1.13 -0.10 0.00 -0.52 0.00 0.00 52.55 50.93 1fr0 s ASP 666 Cb -0.02 -2.48 0.16 0.00 -1.46 0.00 0.00 42.92 39.12 1fr0 s ASP 666 CO 0.03 -1.49 1.87 0.40 0.52 0.00 0.00 175.17 176.50 1fr0 h ILE 667 N 6.12 1.21 -0.04 4.11 1.08 -1.91 0.15 117.51 128.22 1fr0 h ILE 667 Ca -0.11 -0.41 -0.06 0.00 -0.39 0.00 0.00 64.86 63.88 1fr0 h ILE 667 Cb 1.05 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.89 1fr0 h ILE 667 CO 1.24 0.21 -0.21 1.55 -0.69 0.00 0.00 178.15 180.25 1fr0 h PRO 668 N 1.05 0.22 -0.12 2.37 0.13 -1.98 -2.75 132.00 130.93 1fr0 h PRO 668 Ca 0.28 -0.18 -0.01 0.00 -0.87 0.00 0.00 66.00 65.22 1fr0 h PRO 668 Cb -0.09 0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.08 1fr0 h PRO 668 CO -0.06 0.83 0.02 1.98 -0.23 0.00 0.00 178.00 180.55 1fr0 h MET 669 N -0.35 0.19 -0.22 0.86 4.05 -1.95 -1.55 114.93 115.97 1fr0 h MET 669 Ca -0.01 -0.05 0.06 0.00 -0.28 0.00 0.00 59.70 59.41 1fr0 h MET 669 Cb 0.87 -0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 31.59 1fr0 h MET 669 CO 0.04 0.38 -0.21 -0.07 0.23 0.00 0.00 176.91 177.28 1fr0 h LEU 670 N -0.03 -0.68 0.14 3.39 3.38 -0.79 0.13 115.31 120.85 1fr0 h LEU 670 Ca 0.04 0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1fr0 h LEU 670 Cb 0.28 0.33 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1fr0 h LEU 670 CO 0.00 -0.25 -0.21 -0.08 0.09 0.00 0.00 178.44 177.99 1fr0 h GLU 671 N -0.22 -0.40 -0.55 1.13 4.22 -1.41 -2.36 114.58 114.98 1fr0 h GLU 671 Ca 0.13 0.03 0.11 0.00 0.08 0.00 0.00 59.36 59.71 1fr0 h GLU 671 Cb 0.42 0.09 -0.11 0.00 0.50 0.00 0.00 28.75 29.65 1fr0 h GLU 671 CO -0.35 -0.27 -0.24 0.37 -2.18 0.00 0.00 179.01 176.34 1fr0 h GLN 672 N -0.41 -0.10 -0.79 1.92 4.15 -0.62 0.18 115.11 119.42 1fr0 h GLN 672 Ca 0.02 0.01 0.19 0.00 0.77 0.00 0.00 58.65 59.63 1fr0 h GLN 672 Cb 0.42 0.02 -0.12 0.00 0.21 0.00 0.00 27.48 28.01 1fr0 h GLN 672 CO -0.10 -0.07 0.17 1.88 -1.93 0.00 0.00 178.83 178.79 1fr0 h TYR 673 N -0.11 0.26 0.00 3.99 -1.99 -0.48 1.30 116.97 119.94 1fr0 h TYR 673 Ca 0.25 0.05 0.00 0.00 2.00 0.00 0.00 58.73 61.03 1fr0 h TYR 673 Cb 0.50 0.01 0.00 0.00 2.00 0.00 0.00 36.73 39.24 1fr0 h TYR 673 CO -0.54 -0.15 0.00 -0.07 -0.00 0.00 0.00 178.16 177.40 1fr0 h LEU 674 N 0.23 0.00 -0.03 3.88 4.07 -0.32 0.17 115.31 123.31 1fr0 h LEU 674 Ca 0.46 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.42 1fr0 h LEU 674 Cb 0.85 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1fr0 h LEU 674 CO -0.58 0.00 0.00 1.21 -1.08 0.00 0.00 178.44 177.99 1fr0 n GLU 675 N -2.91 1.02 0.04 1.13 2.13 0.44 -3.25 120.64 119.24 1fr0 n GLU 675 Ca 0.00 -0.03 0.00 0.00 0.66 0.00 0.00 57.16 57.79 1fr0 n GLU 675 Cb 0.26 -1.21 0.00 0.00 0.27 0.00 0.00 31.44 30.76 1fr0 n GLU 675 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19 1fr0 n LEU 676 N -0.68 -0.34 -0.04 4.31 -0.00 -0.83 -4.93 117.00 114.49 1fr0 n LEU 676 Ca 0.10 0.13 -0.04 0.00 -0.00 0.00 0.00 56.01 56.20 1fr0 n LEU 676 Cb 0.05 0.49 -0.14 0.00 -0.00 0.00 0.00 43.42 43.82 1fr0 n LEU 676 CO 0.08 -0.48 -0.77 1.33 -0.00 0.00 0.00 177.39 177.54 1fr0 n VAL 677 N -2.70 1.15 0.00 1.47 0.24 0.53 -5.09 118.33 113.93 1fr0 n VAL 677 Ca 0.00 -0.75 0.00 0.00 -2.04 0.00 0.00 64.34 61.55 1fr0 n VAL 677 Cb 0.00 -0.55 0.00 0.00 -1.47 0.00 0.00 33.84 31.82 1fr0 n VAL 677 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fr0 n GLY 678 N 1.55 -1.01 0.00 7.63 0.00 -0.71 -4.24 105.19 108.41 1fr0 n GLY 678 Ca -0.20 -1.64 0.08 0.00 0.00 0.00 0.00 46.02 44.26 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 -0.97 0.07 -0.19 1.61 -0.04 -1.26 -3.06 135.00 131.16 1fr0 n PRO 679 Ca 0.00 0.19 -0.05 0.00 -0.04 0.00 0.00 63.50 63.59 1fr0 n PRO 679 Cb 0.00 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.07 1fr0 n PRO 679 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1fr0 h LYS 680 N 0.00 0.98 0.25 0.54 3.64 -1.99 0.64 116.57 120.63 1fr0 h LYS 680 Ca 0.00 -0.23 -0.33 0.00 -1.27 0.00 0.00 60.65 58.82 1fr0 h LYS 680 Cb 0.25 -0.13 0.04 0.00 -0.41 0.00 0.00 32.23 31.98 1fr0 h LYS 680 CO 0.00 0.89 -1.43 1.25 -2.27 0.00 0.00 179.45 177.89 1fr0 h LEU 681 N 0.93 0.82 0.49 5.20 5.85 -1.72 -2.78 115.31 124.09 1fr0 h LEU 681 Ca 0.19 -0.92 -0.02 0.00 0.84 0.00 0.00 57.88 57.96 1fr0 h LEU 681 Cb 0.38 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1fr0 h LEU 681 CO 0.01 1.69 -0.24 0.40 -0.34 0.00 0.00 178.44 179.96 1fr0 h ILE 682 N 0.10 0.40 -0.06 4.05 5.03 -1.62 0.14 117.51 125.56 1fr0 h ILE 682 Ca -0.25 -0.41 0.02 0.00 -0.12 0.00 0.00 64.86 64.10 1fr0 h ILE 682 Cb 2.13 0.55 -0.00 0.00 -3.03 0.00 0.00 36.82 36.47 1fr0 h ILE 682 CO 0.27 0.06 0.04 0.74 -0.68 0.00 0.00 178.15 178.58 1fr0 h THR 683 N -0.94 0.95 0.00 -0.27 2.02 -1.02 0.13 112.91 113.78 1fr0 h THR 683 Ca -0.07 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 1fr0 h THR 683 Cb 0.60 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 67.98 1fr0 h THR 683 CO 0.11 0.00 -0.00 -0.78 0.37 0.00 0.00 175.52 175.22 1fr0 h ASP 684 N 0.00 -0.00 -0.52 4.18 3.58 -1.33 -2.36 116.42 119.96 1fr0 h ASP 684 Ca 0.03 0.00 0.15 0.00 0.42 0.00 0.00 57.03 57.63 1fr0 h ASP 684 Cb 0.11 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 1fr0 h ASP 684 CO -0.00 0.03 0.54 1.23 -2.88 0.00 0.00 179.24 178.16 1fr0 h GLY 685 N -0.07 0.00 0.27 -0.78 0.00 -0.74 -2.14 103.07 99.60 1fr0 h GLY 685 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1fr0 h GLY 685 CO 0.00 0.00 -0.13 -2.00 0.00 0.00 0.00 176.54 174.41 1fr0 h LEU 686 N 0.00 -0.30 -0.65 3.11 5.85 -0.83 -2.31 115.31 120.17 1fr0 h LEU 686 Ca 0.25 0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.05 1fr0 h LEU 686 Cb 1.32 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 42.33 1fr0 h LEU 686 CO -0.00 0.07 -0.53 0.00 -0.34 0.00 0.00 178.44 177.63 1fr0 h ALA 687 N -1.27 -0.56 -0.69 1.25 0.00 -0.83 0.30 119.26 117.46 1fr0 h ALA 687 Ca -0.04 0.07 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1fr0 h ALA 687 Cb 0.27 1.15 -0.09 0.00 0.00 0.00 0.00 17.79 19.13 1fr0 h ALA 687 CO 0.06 -0.96 0.26 0.28 0.00 0.00 0.00 179.25 178.90 1fr0 h VAL 688 N -0.22 0.70 -0.83 0.00 2.07 -1.60 0.28 116.25 116.65 1fr0 h VAL 688 Ca 0.14 -0.14 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1fr0 h VAL 688 Cb 0.54 0.24 -0.05 0.00 -1.52 0.00 0.00 31.29 30.50 1fr0 h VAL 688 CO -0.74 0.08 0.55 0.15 0.02 0.00 0.00 177.57 177.63 1fr0 h PHE 689 N 0.42 1.00 -0.40 1.57 3.57 0.06 -1.29 116.94 121.87 1fr0 h PHE 689 Ca 0.37 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.85 1fr0 h PHE 689 Cb 0.52 -0.33 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1fr0 h PHE 689 CO -0.17 0.59 0.09 0.93 -2.23 0.00 0.00 178.31 177.51 1fr0 h GLU 690 N 1.04 0.59 -0.18 1.11 5.08 0.13 0.20 114.58 122.56 1fr0 h GLU 690 Ca 0.33 -0.10 -0.13 0.00 -1.00 0.00 0.00 59.36 58.45 1fr0 h GLU 690 Cb 0.01 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1fr0 h GLU 690 CO -0.09 0.55 -0.45 0.87 -1.00 0.00 0.00 179.01 178.89 1fr0 h LYS 691 N 0.58 0.43 -0.01 2.33 1.57 -0.77 -2.92 116.57 117.78 1fr0 h LYS 691 Ca 0.13 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 1fr0 h LYS 691 Cb 0.23 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.55 1fr0 h LYS 691 CO -0.00 0.80 -0.28 -0.12 -0.57 0.00 0.00 179.45 179.28 1fr0 n MET 692 N -4.00 1.08 -0.07 3.15 1.56 -0.90 -4.21 117.12 113.72 1fr0 n MET 692 Ca -0.02 -0.73 -0.12 0.00 -0.27 0.00 0.00 57.70 56.56 1fr0 n MET 692 Cb 0.53 -1.48 -0.05 0.00 2.15 0.00 0.00 33.22 34.36 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 1.77 0.44 -0.06 2.12 -1.53 -0.40 -0.06 114.93 117.21 1fr0 h MET 693 Ca 0.00 -0.19 -0.12 0.00 -3.44 0.00 0.00 59.70 55.95 1fr0 h MET 693 Cb 0.59 -0.02 -0.01 0.00 -0.55 0.00 0.00 31.60 31.61 1fr0 h MET 693 CO 0.00 0.71 -0.53 -1.00 0.14 0.00 0.00 176.91 176.23 1fr0 h PRO 694 N 0.15 0.16 0.00 0.39 0.13 -1.73 -1.73 132.00 129.37 1fr0 h PRO 694 Ca 0.05 -0.10 -0.12 0.00 -0.87 0.00 0.00 66.00 64.97 1fr0 h PRO 694 Cb 0.57 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.69 1fr0 h PRO 694 CO 0.03 0.65 -0.56 0.78 -0.23 0.00 0.00 178.00 178.67 1fr0 h GLY 695 N 1.45 0.00 0.23 1.56 0.00 -1.71 -2.39 103.07 102.21 1fr0 h GLY 695 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1fr0 h GLY 695 CO 0.08 0.00 -0.11 -0.97 0.00 0.00 0.00 176.54 175.54 1fr0 h TYR 696 N 0.00 -0.29 -0.89 5.60 0.05 -0.63 -2.63 116.97 118.18 1fr0 h TYR 696 Ca -0.01 -0.01 0.19 0.00 0.05 0.00 0.00 58.73 58.96 1fr0 h TYR 696 Cb 1.17 0.10 -0.07 0.00 1.01 0.00 0.00 36.73 38.94 1fr0 h TYR 696 CO 0.00 -0.18 0.59 -0.39 -1.05 0.00 0.00 178.16 177.13 1fr0 h VAL 697 N -0.93 0.70 -0.23 -2.88 -1.51 -1.43 0.14 116.25 110.11 1fr0 h VAL 697 Ca -0.03 -0.15 -0.00 0.00 -1.23 0.00 0.00 66.70 65.28 1fr0 h VAL 697 Cb 0.24 0.22 -0.01 0.00 -2.13 0.00 0.00 31.29 29.61 1fr0 h VAL 697 CO 0.05 0.08 0.14 0.28 -1.23 0.00 0.00 177.57 176.89 1fr0 h SER 698 N 0.44 0.29 -0.20 4.19 0.02 -1.47 -1.82 113.55 115.00 1fr0 h SER 698 Ca 0.47 -0.07 -0.06 0.00 -0.84 0.00 0.00 61.79 61.29 1fr0 h SER 698 Cb 1.10 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.55 1fr0 h SER 698 CO -0.18 0.27 -0.04 0.58 -1.14 0.00 0.00 176.83 176.31 1fr0 h VAL 699 N 0.28 1.21 -0.41 2.27 2.07 -0.44 -2.58 116.25 118.64 1fr0 h VAL 699 Ca 0.08 -0.86 0.06 0.00 0.82 0.00 0.00 66.70 66.81 1fr0 h VAL 699 Cb 0.04 1.01 -0.06 0.00 -1.52 0.00 0.00 31.29 30.76 1fr0 h VAL 699 CO -0.01 0.29 0.08 -0.07 0.02 0.00 0.00 177.57 177.88 1fr0 h LEU 700 N 0.49 0.01 -0.25 2.57 -0.00 -0.14 -1.07 115.31 116.93 1fr0 h LEU 700 Ca 0.10 0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 58.05 1fr0 h LEU 700 Cb 0.38 0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 41.12 1fr0 h LEU 700 CO 0.02 0.04 0.15 -0.33 -0.00 0.00 0.00 178.44 178.31 1fr0 h GLU 701 N 0.21 0.34 -0.98 1.13 5.08 -1.03 -1.83 114.58 117.50 1fr0 h GLU 701 Ca 0.20 -0.03 0.15 0.00 -1.00 0.00 0.00 59.36 58.67 1fr0 h GLU 701 Cb 0.24 -0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.33 1fr0 h GLU 701 CO -0.26 0.28 0.59 1.03 -1.00 0.00 0.00 179.01 179.65 1fr0 h SER 702 N 0.30 0.82 0.13 1.42 0.87 -1.09 0.13 113.55 116.13 1fr0 h SER 702 Ca 0.09 0.07 -0.10 0.00 -1.23 0.00 0.00 61.79 60.62 1fr0 h SER 702 Cb 0.03 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1fr0 h SER 702 CO -0.02 0.38 -0.33 0.78 -0.53 0.00 0.00 176.83 177.11 1fr0 h ASN 703 N 0.87 0.31 -0.28 6.23 4.21 -0.65 -2.76 115.58 123.50 1fr0 h ASN 703 Ca 0.52 -0.12 0.01 0.00 1.21 0.00 0.00 56.30 57.92 1fr0 h ASN 703 Cb 0.64 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 37.73 1fr0 h ASN 703 CO -0.32 0.64 0.17 0.25 -1.29 0.00 0.00 177.43 176.88 1fr0 h LEU 704 N 0.27 0.28 -1.10 1.61 7.12 0.06 -0.64 115.31 122.91 1fr0 h LEU 704 Ca 0.03 -0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.04 1fr0 h LEU 704 Cb 0.72 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.79 1fr0 h LEU 704 CO 0.06 0.21 0.00 0.71 -0.13 0.00 0.00 178.44 179.28 1fr0 h THR 705 N 0.35 0.00 -0.74 1.05 1.35 -1.35 -2.32 112.91 111.25 1fr0 h THR 705 Ca 0.11 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1fr0 h THR 705 Cb -0.01 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1fr0 h THR 705 CO -0.04 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.23 1fr0 n ALA 706 N -1.93 2.38 -3.77 6.62 0.00 -0.40 -4.95 120.51 118.45 1fr0 n ALA 706 Ca 0.01 -1.31 -0.24 0.00 0.00 0.00 0.00 53.44 51.91 1fr0 n ALA 706 Cb 0.26 -0.93 0.03 0.00 0.00 0.00 0.00 19.45 18.81 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 1.67 -4.94 -3.05 0.00 3.00 -0.43 -4.89 117.38 108.74 1fr0 n GLN 707 Ca 0.25 0.60 -0.45 0.00 -0.01 0.00 0.00 57.00 57.39 1fr0 n GLN 707 Cb 0.63 -5.20 -0.02 0.00 0.00 0.00 0.00 30.24 25.64 1fr0 n GLN 707 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 1fr0 s ASP 708 N -4.12 6.67 -0.02 1.08 2.15 -0.39 -4.88 116.67 117.16 1fr0 s ASP 708 Ca 0.16 -2.24 -0.02 0.00 0.43 0.00 0.00 52.55 50.88 1fr0 s ASP 708 Cb -0.08 -2.34 -0.01 0.00 -0.30 0.00 0.00 42.92 40.19 1fr0 s ASP 708 CO 0.82 -0.91 0.19 0.50 -0.17 0.00 0.00 175.17 175.60 1fr0 h LYS 709 N 8.51 -0.06 -0.81 4.34 3.64 -1.90 -2.62 116.57 127.67 1fr0 h LYS 709 Ca 0.14 0.00 0.13 0.00 -1.27 0.00 0.00 60.65 59.65 1fr0 h LYS 709 Cb 1.03 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.81 1fr0 h LYS 709 CO 1.00 -0.04 0.53 1.57 -2.27 0.00 0.00 179.45 180.24 1fr0 h LYS 710 N -0.29 0.60 0.72 1.90 2.10 -1.99 -0.49 116.57 119.12 1fr0 h LYS 710 Ca -0.01 -0.04 -0.04 0.00 -2.00 0.00 0.00 60.65 58.57 1fr0 h LYS 710 Cb 0.05 -0.13 0.01 0.00 -0.90 0.00 0.00 32.23 31.25 1fr0 h LYS 710 CO 0.01 0.40 -0.35 0.78 -2.00 0.00 0.00 179.45 178.29 1fr0 h GLY 711 N 0.62 -1.01 1.75 0.07 0.00 -1.96 -1.71 103.07 100.83 1fr0 h GLY 711 Ca 0.39 0.37 0.03 0.00 0.00 0.00 0.00 47.33 48.13 1fr0 h GLY 711 CO -0.16 -0.37 0.10 -2.22 0.00 0.00 0.00 176.54 173.90 1fr0 h ILE 712 N -1.10 0.96 -0.17 2.60 2.04 -1.05 -0.98 117.51 119.81 1fr0 h ILE 712 Ca -0.10 -0.02 -0.12 0.00 1.00 0.00 0.00 64.86 65.62 1fr0 h ILE 712 Cb 0.77 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.72 1fr0 h ILE 712 CO 0.16 0.01 -0.39 0.58 0.00 0.00 0.00 178.15 178.51 1fr0 h VAL 713 N 0.07 1.30 0.01 1.67 2.07 -0.82 0.11 116.25 120.66 1fr0 h VAL 713 Ca 0.07 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.07 1fr0 h VAL 713 Cb 0.18 1.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1fr0 h VAL 713 CO -0.01 0.47 -0.01 -0.33 0.02 0.00 0.00 177.57 177.71 1fr0 h GLU 714 N 0.32 -0.01 0.00 1.57 5.08 -0.29 -3.18 114.58 118.07 1fr0 h GLU 714 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1fr0 h GLU 714 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1fr0 h GLU 714 CO 0.07 0.69 0.00 0.39 -1.00 0.00 0.00 179.01 179.15 1fr0 n GLU 715 N -4.68 0.12 0.02 2.33 1.02 -0.58 -2.31 120.64 116.57 1fr0 n GLU 715 Ca -0.07 0.20 -0.01 0.00 -0.02 0.00 0.00 57.16 57.25 1fr0 n GLU 715 Cb 0.34 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.25 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 2.27 -0.09 2.00 0.62 0.00 -0.75 -2.50 103.07 104.62 1fr0 h GLY 716 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 1fr0 h GLY 716 CO 0.00 -0.03 -0.19 1.12 0.00 0.00 0.00 176.54 177.44 1fr0 h HIS 717 N -0.34 0.00 -0.19 5.60 2.07 -1.58 0.14 115.15 120.86 1fr0 h HIS 717 Ca -0.01 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.47 1fr0 h HIS 717 Cb 0.07 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.04 1fr0 h HIS 717 CO 0.03 0.19 -0.05 -0.22 -3.07 0.00 0.00 177.93 174.81 1fr0 h LYS 718 N 0.00 0.37 -0.01 5.12 3.11 -1.58 1.24 116.57 124.83 1fr0 h LYS 718 Ca -0.00 -0.14 -0.20 0.00 -2.81 0.00 0.00 60.65 57.49 1fr0 h LYS 718 Cb 0.43 -0.02 0.02 0.00 -1.00 0.00 0.00 32.23 31.66 1fr0 h LYS 718 CO 0.02 0.63 -0.78 0.82 -2.81 0.00 0.00 179.45 177.34 1fr0 h ILE 719 N 0.08 1.36 -0.13 2.00 5.03 -1.15 -2.66 117.51 122.05 1fr0 h ILE 719 Ca 0.05 -2.14 -0.18 0.00 -0.12 0.00 0.00 64.86 62.47 1fr0 h ILE 719 Cb 0.50 2.49 0.01 0.00 -3.03 0.00 0.00 36.82 36.79 1fr0 h ILE 719 CO 0.02 0.64 -0.64 0.11 -0.68 0.00 0.00 178.15 177.60 1fr0 h LYS 720 N 0.11 0.65 -0.44 2.37 6.56 -0.75 -2.51 116.57 122.56 1fr0 h LYS 720 Ca -0.10 -0.53 0.02 0.00 -1.06 0.00 0.00 60.65 58.98 1fr0 h LYS 720 Cb 1.46 0.11 -0.03 0.00 -0.57 0.00 0.00 32.23 33.21 1fr0 h LYS 720 CO 0.15 1.15 0.27 0.78 -2.06 0.00 0.00 179.45 179.74 1fr0 h GLY 721 N 0.32 0.62 0.97 3.86 0.00 0.15 0.13 103.07 109.12 1fr0 h GLY 721 Ca -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 1fr0 h GLY 721 CO 0.13 0.18 0.25 0.00 0.00 0.00 0.00 176.54 177.10 1fr0 h ALA 722 N 1.19 0.61 -0.45 3.60 0.00 -1.49 -2.15 119.26 120.57 1fr0 h ALA 722 Ca 0.17 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1fr0 h ALA 722 Cb 0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1fr0 h ALA 722 CO -0.07 0.14 0.13 0.00 0.00 0.00 0.00 179.25 179.45 1fr0 h ALA 723 N 1.09 0.59 0.00 0.00 0.00 -0.98 -2.06 119.26 117.90 1fr0 h ALA 723 Ca 0.16 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fr0 h ALA 723 Cb 0.07 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.69 1fr0 h ALA 723 CO -0.02 0.24 -0.02 0.78 0.00 0.00 0.00 179.25 180.23 1fr0 h GLY 724 N 0.59 0.00 2.00 0.00 0.00 -0.53 -0.65 103.07 104.48 1fr0 h GLY 724 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 1fr0 h GLY 724 CO -0.00 0.00 -0.27 1.76 0.00 0.00 0.00 176.54 178.03 1fr0 h SER 725 N 0.00 0.00 -0.04 0.19 0.02 -0.70 -2.58 113.55 110.44 1fr0 h SER 725 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1fr0 h SER 725 Cb 0.11 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.65 1fr0 h SER 725 CO 0.00 0.27 0.00 0.52 -1.14 0.00 0.00 176.83 176.48 1fr0 n VAL 726 N -3.35 0.04 0.00 2.27 0.31 -0.29 -4.83 118.33 112.47 1fr0 n VAL 726 Ca 0.01 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 1fr0 n VAL 726 Cb 0.49 0.25 0.00 0.00 -0.91 0.00 0.00 33.84 33.66 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 1.11 1.20 3.06 2.92 0.00 -0.98 -4.93 105.19 107.58 1fr0 n GLY 727 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 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 6.19 0.17 0.99 4.77 -0.36 -1.86 117.00 126.90 1fr0 n LEU 728 Ca 0.00 -4.70 0.11 0.00 -0.03 0.00 0.00 56.01 51.39 1fr0 n LEU 728 Cb 0.00 -1.49 0.64 0.00 -2.33 0.00 0.00 43.42 40.24 1fr0 n LEU 728 CO 0.00 1.25 1.11 0.08 -1.33 0.00 0.00 177.39 178.50 1fr0 h ARG 729 N 6.11 0.04 -0.04 3.23 0.11 -1.69 -0.25 114.38 121.89 1fr0 h ARG 729 Ca 0.34 -0.00 -0.11 0.00 0.10 0.00 0.00 59.98 60.31 1fr0 h ARG 729 Cb 0.70 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.76 1fr0 h ARG 729 CO 1.46 0.02 -0.48 1.25 0.10 0.00 0.00 179.97 182.32 1fr0 h HIS 730 N 0.04 0.10 0.18 4.08 2.76 -1.78 -2.05 115.15 118.49 1fr0 h HIS 730 Ca 0.08 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 1fr0 h HIS 730 Cb 0.27 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.21 1fr0 h HIS 730 CO -0.00 0.55 -0.09 -0.07 -1.30 0.00 0.00 177.93 177.03 1fr0 h LEU 731 N 0.07 -0.21 -1.59 0.26 -0.00 -1.25 -2.74 115.31 109.86 1fr0 h LEU 731 Ca 0.00 -0.33 -0.02 0.00 -0.00 0.00 0.00 57.88 57.53 1fr0 h LEU 731 Cb 0.88 0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 41.58 1fr0 h LEU 731 CO 0.07 0.30 0.01 0.06 -0.00 0.00 0.00 178.44 178.88 1fr0 h GLN 732 N -0.80 0.27 0.56 1.13 3.07 -1.33 -2.66 115.11 115.35 1fr0 h GLN 732 Ca -0.02 -0.04 -0.03 0.00 0.09 0.00 0.00 58.65 58.65 1fr0 h GLN 732 Cb 0.52 -0.05 0.01 0.00 0.08 0.00 0.00 27.48 28.04 1fr0 h GLN 732 CO 0.04 0.29 -0.27 1.96 0.09 0.00 0.00 178.83 180.94 1fr0 h GLN 733 N 0.27 -0.73 -0.63 0.06 1.08 -1.38 -1.41 115.11 112.37 1fr0 h GLN 733 Ca 0.07 0.05 0.12 0.00 -1.45 0.00 0.00 58.65 57.44 1fr0 h GLN 733 Cb 0.16 0.17 -0.12 0.00 -0.05 0.00 0.00 27.48 27.64 1fr0 h GLN 733 CO 0.00 -0.49 -0.21 -0.07 -0.95 0.00 0.00 178.83 177.11 1fr0 h LEU 734 N -0.94 -0.76 -0.21 1.46 4.07 -1.44 0.12 115.31 117.62 1fr0 h LEU 734 Ca -0.08 0.20 0.05 0.00 0.08 0.00 0.00 57.88 58.14 1fr0 h LEU 734 Cb 0.58 0.45 -0.06 0.00 1.08 0.00 0.00 40.66 42.71 1fr0 h LEU 734 CO 0.13 -0.24 -0.16 1.23 -1.08 0.00 0.00 178.44 178.32 1fr0 h GLY 735 N -0.05 -0.02 -0.72 0.83 0.00 -1.47 -0.80 103.07 100.84 1fr0 h GLY 735 Ca 0.29 0.20 0.24 0.00 0.00 0.00 0.00 47.33 48.06 1fr0 h GLY 735 CO -0.67 -0.16 0.07 -1.61 0.00 0.00 0.00 176.54 174.17 1fr0 h GLN 736 N -0.16 0.07 0.00 4.80 5.75 0.18 1.51 115.11 127.26 1fr0 h GLN 736 Ca 0.12 -0.00 -0.08 0.00 -0.15 0.00 0.00 58.65 58.54 1fr0 h GLN 736 Cb 0.34 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.87 1fr0 h GLN 736 CO -0.30 0.05 -0.38 1.96 -2.65 0.00 0.00 178.83 177.51 1fr0 h GLN 737 N 0.07 0.00 0.00 1.69 7.50 -0.88 -2.72 115.11 120.77 1fr0 h GLN 737 Ca 0.55 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.70 1fr0 h GLN 737 Cb 1.10 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.63 1fr0 h GLN 737 CO -0.81 0.38 0.00 0.82 -1.50 0.00 0.00 178.83 177.72 1fr0 h ILE 738 N 0.00 0.00 -0.19 2.54 1.08 0.34 -2.05 117.51 119.23 1fr0 h ILE 738 Ca -0.00 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 64.06 1fr0 h ILE 738 Cb 0.92 1.38 0.00 0.00 -3.07 0.00 0.00 36.82 36.05 1fr0 h ILE 738 CO 0.05 0.00 0.00 0.00 -0.69 0.00 0.00 178.15 177.51 1fr0 n GLN 739 N -3.00 1.60 -2.65 2.37 3.00 -0.71 -4.14 117.38 113.85 1fr0 n GLN 739 Ca 0.00 -0.91 -0.27 0.00 -0.01 0.00 0.00 57.00 55.81 1fr0 n GLN 739 Cb 0.26 -1.30 -0.01 0.00 0.00 0.00 0.00 30.24 29.19 1fr0 n GLN 739 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 1fr0 n SER 740 N 0.17 4.71 -2.43 1.08 2.88 -0.77 -4.91 113.62 114.35 1fr0 n SER 740 Ca 0.13 -3.71 -0.07 0.00 -1.33 0.00 0.00 58.87 53.89 1fr0 n SER 740 Cb 0.25 -0.52 -0.06 0.00 -0.75 0.00 0.00 64.21 63.13 1fr0 n SER 740 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1fr0 n PRO 741 N -0.39 0.94 0.00 -1.46 -0.04 -1.26 -2.80 135.00 130.00 1fr0 n PRO 741 Ca 0.36 -0.54 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1fr0 n PRO 741 Cb 0.54 -1.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 1fr0 n PRO 741 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1fr0 n ASP 742 N 3.06 1.97 -4.74 3.54 9.92 -1.26 -4.98 116.55 124.06 1fr0 n ASP 742 Ca 0.20 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 54.05 1fr0 n ASP 742 Cb 0.33 0.34 -0.02 0.00 -0.64 0.00 0.00 41.12 41.13 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1fr0 s LEU 743 N -1.43 4.38 0.24 0.64 1.02 -1.12 -4.85 118.68 117.56 1fr0 s LEU 743 Ca 0.00 2.62 0.21 0.00 0.02 0.00 0.00 54.13 56.98 1fr0 s LEU 743 Cb 0.00 -3.62 0.95 0.00 0.02 0.00 0.00 46.19 43.54 1fr0 s LEU 743 CO 0.00 -0.71 1.63 -0.81 0.02 0.00 0.00 176.35 176.48 1fr0 n PRO 744 N 2.73 0.15 -0.04 1.29 -0.04 -1.26 -1.74 135.00 136.08 1fr0 n PRO 744 Ca 0.08 0.48 0.04 0.00 -0.04 0.00 0.00 63.50 64.06 1fr0 n PRO 744 Cb 0.40 -1.84 -0.16 0.00 -0.04 0.00 0.00 33.50 31.86 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 -1.73 2.34 -0.10 0.55 0.00 -1.26 -4.38 120.51 115.93 1fr0 n ALA 745 Ca 0.01 -0.78 -0.13 0.00 0.00 0.00 0.00 53.44 52.54 1fr0 n ALA 745 Cb 0.15 -0.53 -0.04 0.00 0.00 0.00 0.00 19.45 19.03 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 0.83 0.00 0.00 7.01 -1.69 -0.17 115.95 121.93 1fr0 h TRP 746 Ca -0.19 -0.24 0.00 0.00 2.11 0.00 0.00 58.89 60.58 1fr0 h TRP 746 Cb 1.40 -0.18 0.00 0.00 -2.10 0.00 0.00 29.16 28.28 1fr0 h TRP 746 CO 0.00 0.97 0.00 1.49 -2.79 0.00 0.00 178.44 178.11 1fr0 h GLU 747 N 0.46 0.00 -0.00 2.65 4.81 -1.72 0.27 114.58 121.04 1fr0 h GLU 747 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 1fr0 h GLU 747 Cb 0.81 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1fr0 h GLU 747 CO 0.06 0.00 -0.55 -3.47 -0.73 0.00 0.00 179.01 174.32 1fr0 n ASP 748 N -2.31 0.60 -0.05 1.04 2.03 -0.88 -4.49 116.55 112.50 1fr0 n ASP 748 Ca -0.01 -0.80 -0.01 0.00 0.52 0.00 0.00 54.79 54.48 1fr0 n ASP 748 Cb 0.04 0.98 -0.14 0.00 -0.72 0.00 0.00 41.12 41.28 1fr0 n ASP 748 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1fr0 n ASN 749 N -1.23 0.87 -0.33 1.67 3.02 -0.07 -4.48 115.26 114.71 1fr0 n ASN 749 Ca 0.02 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.66 1fr0 n ASN 749 Cb 0.19 1.29 0.19 0.00 -0.61 0.00 0.00 39.78 40.84 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 0.07 -0.69 2.41 2.07 -0.80 0.17 116.25 119.48 1fr0 h VAL 750 Ca -0.27 -0.01 0.10 0.00 0.82 0.00 0.00 66.70 67.35 1fr0 h VAL 750 Cb 1.54 0.06 -0.12 0.00 -1.52 0.00 0.00 31.29 31.25 1fr0 h VAL 750 CO 0.01 0.00 -0.42 1.23 0.02 0.00 0.00 177.57 178.42 1fr0 h GLY 751 N 0.02 -0.31 2.00 2.17 0.00 -1.84 0.91 103.07 106.02 1fr0 h GLY 751 Ca 0.50 0.55 0.00 0.00 0.00 0.00 0.00 47.33 48.38 1fr0 h GLY 751 CO -0.92 -0.16 0.00 -2.09 0.00 0.00 0.00 176.54 173.37 1fr0 h GLU 752 N -0.15 0.00 0.40 4.80 4.81 -1.02 -2.58 114.58 120.83 1fr0 h GLU 752 Ca 0.22 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1fr0 h GLU 752 Cb 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1fr0 h GLU 752 CO -0.76 0.00 -0.19 2.35 -0.73 0.00 0.00 179.01 179.67 1fr0 h TRP 753 N 0.00 -0.50 -0.29 0.92 2.91 0.21 -1.09 115.95 118.12 1fr0 h TRP 753 Ca 0.00 -0.01 -0.12 0.00 1.13 0.00 0.00 58.89 59.89 1fr0 h TRP 753 Cb 0.52 0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.32 1fr0 h TRP 753 CO 0.00 -0.20 -0.31 0.82 -1.03 0.00 0.00 178.44 177.72 1fr0 h ILE 754 N -1.04 1.28 0.55 2.65 2.04 -1.30 -1.36 117.51 120.32 1fr0 h ILE 754 Ca -0.05 -1.42 -0.03 0.00 1.00 0.00 0.00 64.86 64.36 1fr0 h ILE 754 Cb 0.52 1.39 0.01 0.00 -0.74 0.00 0.00 36.82 37.99 1fr0 h ILE 754 CO 0.09 0.46 -0.26 -0.08 0.00 0.00 0.00 178.15 178.35 1fr0 h GLU 755 N 0.52 -0.71 0.25 2.37 4.81 -1.53 -2.64 114.58 117.66 1fr0 h GLU 755 Ca 0.06 0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.33 1fr0 h GLU 755 Cb 0.79 0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.32 1fr0 h GLU 755 CO 0.06 -0.40 -0.16 1.49 -0.73 0.00 0.00 179.01 179.28 1fr0 h GLU 756 N -1.02 -0.39 -0.86 1.92 4.81 -1.23 -2.63 114.58 115.17 1fr0 h GLU 756 Ca -0.07 0.03 0.19 0.00 -0.13 0.00 0.00 59.36 59.37 1fr0 h GLU 756 Cb 0.63 0.09 -0.16 0.00 0.63 0.00 0.00 28.75 29.94 1fr0 h GLU 756 CO 0.12 -0.26 -0.11 1.98 -0.73 0.00 0.00 179.01 180.01 1fr0 h MET 757 N -0.40 0.03 0.49 1.92 4.05 -1.31 -0.24 114.93 119.47 1fr0 h MET 757 Ca -0.02 -0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.38 1fr0 h MET 757 Cb 0.33 -0.01 -0.01 0.00 -0.80 0.00 0.00 31.60 31.12 1fr0 h MET 757 CO 0.02 0.02 -0.38 -0.22 0.23 0.00 0.00 176.91 176.58 1fr0 h LYS 758 N 0.03 -0.82 -3.17 0.39 3.64 -1.12 0.36 116.57 115.88 1fr0 h LYS 758 Ca 0.45 0.06 -0.68 0.00 -1.27 0.00 0.00 60.65 59.21 1fr0 h LYS 758 Cb 0.77 0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1fr0 h LYS 758 CO -0.84 -0.55 3.64 -1.91 -2.27 0.00 0.00 179.45 177.52 1fr0 n GLU 759 N -5.50 3.60 0.00 1.90 2.13 -0.11 -3.79 120.64 118.87 1fr0 n GLU 759 Ca -0.11 -2.35 0.00 0.00 0.66 0.00 0.00 57.16 55.35 1fr0 n GLU 759 Cb 0.39 -2.88 0.00 0.00 0.27 0.00 0.00 31.44 29.22 1fr0 n GLU 759 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1fr0 n GLU 760 N 3.95 0.00 -0.29 5.31 -0.58 -1.16 -4.92 120.64 122.94 1fr0 n GLU 760 Ca 0.73 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 57.59 1fr0 n GLU 760 Cb 0.26 0.00 0.28 0.00 -0.57 0.00 0.00 31.44 31.41 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 -0.48 0.00 0.00 177.13 176.76 1fr0 h TRP 761 N 0.00 0.38 0.11 -0.32 5.08 -1.02 0.63 115.95 120.82 1fr0 h TRP 761 Ca 0.00 0.05 0.02 0.00 1.08 0.00 0.00 58.89 60.04 1fr0 h TRP 761 Cb 0.00 -0.03 -0.03 0.00 -3.00 0.00 0.00 29.16 26.10 1fr0 h TRP 761 CO 0.00 -0.18 -0.25 -0.09 -1.28 0.00 0.00 178.44 176.64 1fr0 h ARG 762 N 0.24 -0.44 -0.81 0.12 2.43 -1.81 -2.41 114.38 111.69 1fr0 h ARG 762 Ca 0.54 0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.86 1fr0 h ARG 762 Cb 1.07 0.10 -0.13 0.00 -0.42 0.00 0.00 29.97 30.59 1fr0 h ARG 762 CO -0.63 -0.29 -0.41 1.25 -1.51 0.00 0.00 179.97 178.38 1fr0 h HIS 763 N -0.45 -1.20 -0.31 2.20 -0.00 -1.25 0.51 115.15 114.65 1fr0 h HIS 763 Ca 0.03 0.10 0.04 0.00 -0.00 0.00 0.00 60.37 60.54 1fr0 h HIS 763 Cb 0.48 0.64 -0.08 0.00 -0.00 0.00 0.00 27.41 28.46 1fr0 h HIS 763 CO -0.23 -0.40 -0.55 -0.44 -0.00 0.00 0.00 177.93 176.30 1fr0 h ASP 764 N -0.09 -1.82 -0.92 3.26 3.32 -1.15 0.18 116.42 119.21 1fr0 h ASP 764 Ca 0.26 0.23 0.19 0.00 0.02 0.00 0.00 57.03 57.73 1fr0 h ASP 764 Cb 0.56 0.73 -0.11 0.00 0.22 0.00 0.00 39.33 40.73 1fr0 h ASP 764 CO -0.85 -0.43 0.48 0.58 -1.72 0.00 0.00 179.24 177.30 1fr0 h VAL 765 N -0.47 0.61 0.48 -1.35 2.07 -0.70 0.18 116.25 117.08 1fr0 h VAL 765 Ca 0.06 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.36 1fr0 h VAL 765 Cb 0.63 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1fr0 h VAL 765 CO -0.54 0.10 -0.26 -0.08 0.02 0.00 0.00 177.57 176.81 1fr0 h GLU 766 N 0.57 -0.66 -0.52 1.57 4.22 0.10 -1.48 114.58 118.38 1fr0 h GLU 766 Ca 0.55 0.04 0.15 0.00 0.08 0.00 0.00 59.36 60.18 1fr0 h GLU 766 Cb 0.93 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 30.31 1fr0 h GLU 766 CO -0.44 -0.44 0.39 0.28 -2.18 0.00 0.00 179.01 176.62 1fr0 h VAL 767 N -0.68 0.71 -0.54 0.32 2.07 -0.66 0.34 116.25 117.80 1fr0 h VAL 767 Ca -0.07 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.43 1fr0 h VAL 767 Cb 0.54 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1fr0 h VAL 767 CO 0.09 0.00 0.23 0.25 0.02 0.00 0.00 177.57 178.16 1fr0 h LEU 768 N 0.00 0.74 0.13 2.57 5.85 -0.14 0.21 115.31 124.67 1fr0 h LEU 768 Ca 0.25 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1fr0 h LEU 768 Cb 1.02 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.86 1fr0 h LEU 768 CO -0.00 0.69 -0.06 0.50 -0.34 0.00 0.00 178.44 179.23 1fr0 h LYS 769 N 0.74 -0.16 -0.71 1.25 3.11 0.11 -2.24 116.57 118.67 1fr0 h LYS 769 Ca 0.18 0.01 -0.05 0.00 -2.81 0.00 0.00 60.65 57.99 1fr0 h LYS 769 Cb 0.17 0.04 -0.03 0.00 -1.00 0.00 0.00 32.23 31.41 1fr0 h LYS 769 CO -0.02 -0.07 0.25 0.00 -2.81 0.00 0.00 179.45 176.81 1fr0 h ALA 770 N 0.65 1.11 -0.94 5.00 0.00 -1.33 -2.41 119.26 121.34 1fr0 h ALA 770 Ca -0.02 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.78 1fr0 h ALA 770 Cb 0.17 -0.28 -0.07 0.00 0.00 0.00 0.00 17.79 17.62 1fr0 h ALA 770 CO 0.03 0.62 0.60 2.35 0.00 0.00 0.00 179.25 182.85 1fr0 h TRP 771 N 1.03 1.06 -0.39 0.00 7.01 -0.29 -0.15 115.95 124.22 1fr0 h TRP 771 Ca 0.23 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 61.12 1fr0 h TRP 771 Cb 0.24 -0.34 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 1fr0 h TRP 771 CO 0.02 0.51 -0.32 0.28 -2.79 0.00 0.00 178.44 176.13 1fr0 h VAL 772 N 1.00 1.28 0.00 2.65 2.07 -0.93 0.50 116.25 122.81 1fr0 h VAL 772 Ca 0.42 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.45 1fr0 h VAL 772 Cb 0.32 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1fr0 h VAL 772 CO -0.18 0.50 0.00 0.00 0.02 0.00 0.00 177.57 177.91 1fr0 n ALA 773 N -2.53 2.58 0.00 1.67 0.00 -0.63 -3.56 120.51 118.05 1fr0 n ALA 773 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1fr0 n ALA 773 Cb 0.51 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.61 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 -0.85 0.52 0.02 0.00 5.02 -0.17 -4.26 118.16 118.45 1fr0 n LYS 774 Ca 0.16 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.44 1fr0 n LYS 774 Cb 0.07 -0.98 -0.00 0.00 -0.02 0.00 0.00 35.03 34.09 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fr0 h ALA 775 N 0.00 -0.59 0.00 7.82 0.00 -0.11 -3.31 119.26 123.07 1fr0 h ALA 775 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fr0 h ALA 775 Cb 0.97 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1fr0 h ALA 775 CO 0.00 -0.59 0.00 -2.37 0.00 0.00 0.00 179.25 176.29 1fr0 n THR 776 N -2.26 0.62 -1.38 0.00 5.66 -1.23 -5.02 114.28 110.67 1fr0 n THR 776 Ca -0.01 -0.21 0.16 0.00 -3.05 0.00 0.00 64.05 60.94 1fr0 n THR 776 Cb 0.02 -0.66 -0.08 0.00 -1.55 0.00 0.00 70.33 68.06 1fr0 n THR 776 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1fr0 n LYS 777 N -2.26 -3.00 -0.54 1.09 5.02 -1.24 -5.07 118.16 112.16 1fr0 n LYS 777 Ca 0.05 2.38 0.00 0.00 -2.02 0.00 0.00 58.31 58.72 1fr0 n LYS 777 Cb 0.40 -3.59 0.00 0.00 -0.02 0.00 0.00 35.03 31.82 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51