#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 -2.03 4.28 -1.04 -1.26 -5.03 114.28 109.20 1fr0 n THR 655 Ca 0.00 -0.41 -0.01 0.00 -2.04 0.00 0.00 64.05 61.58 1fr0 n THR 655 Cb 0.00 -1.62 -0.02 0.00 -1.82 0.00 0.00 70.33 66.87 1fr0 n THR 655 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1fr0 n GLU 656 N -2.50 0.00 0.00 -2.82 0.28 -1.26 -5.13 120.64 109.21 1fr0 n GLU 656 Ca 0.08 -0.47 0.00 0.00 -0.16 0.00 0.00 57.16 56.61 1fr0 n GLU 656 Cb 0.27 0.05 0.00 0.00 1.43 0.00 0.00 31.44 33.20 1fr0 n GLU 656 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1fr0 n GLU 657 N 0.03 -0.10 -0.34 3.44 4.07 -1.26 -5.01 120.64 121.46 1fr0 n GLU 657 Ca -0.06 0.00 -0.27 0.00 -0.06 0.00 0.00 57.16 56.77 1fr0 n GLU 657 Cb 0.61 0.00 0.25 0.00 -0.06 0.00 0.00 31.44 32.24 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 1fr0 n ASN 658 N -2.41 -3.58 -0.01 4.31 6.94 -1.26 -4.96 115.26 114.28 1fr0 n ASN 658 Ca 0.00 -0.65 0.05 0.00 -0.02 0.00 0.00 54.58 53.96 1fr0 n ASN 658 Cb 0.00 -0.97 -0.09 0.00 -2.36 0.00 0.00 39.78 36.36 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1fr0 n SER 659 N -4.40 2.28 -4.70 0.53 7.64 -1.26 -4.86 113.62 108.85 1fr0 n SER 659 Ca 0.10 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.68 1fr0 n SER 659 Cb 0.53 1.51 0.15 0.00 -1.01 0.00 0.00 64.21 65.38 1fr0 n SER 659 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 1fr0 s LYS 660 N -2.80 1.10 0.00 1.43 2.20 -1.26 -1.13 119.74 119.28 1fr0 s LYS 660 Ca -0.04 0.89 0.00 0.00 -0.36 0.00 0.00 55.97 56.46 1fr0 s LYS 660 Cb 0.07 -1.79 0.00 0.00 -1.51 0.00 0.00 37.83 34.61 1fr0 s LYS 660 CO 0.49 -2.37 0.00 0.45 -0.36 0.00 0.00 175.35 173.57 1fr0 n SER 661 N -3.98 0.00 0.26 1.43 2.88 -1.26 -3.95 113.62 109.00 1fr0 n SER 661 Ca 0.07 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.77 1fr0 n SER 661 Cb 0.55 0.00 0.56 0.00 -0.75 0.00 0.00 64.21 64.57 1fr0 n SER 661 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1fr0 h GLU 662 N 0.00 0.00 0.00 -1.46 -0.00 -1.80 -2.95 114.58 108.36 1fr0 h GLU 662 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1fr0 h GLU 662 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1fr0 h GLU 662 CO 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 179.01 179.04 1fr0 n ALA 663 N -2.08 0.99 -0.09 1.06 0.00 -0.28 -1.53 120.51 118.58 1fr0 n ALA 663 Ca 0.01 0.16 -0.11 0.00 0.00 0.00 0.00 53.44 53.50 1fr0 n ALA 663 Cb 0.36 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.45 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 -2.10 0.67 -4.03 0.00 4.77 -1.11 -4.20 117.00 110.99 1fr0 n LEU 664 Ca -0.01 0.06 -0.09 0.00 -0.03 0.00 0.00 56.01 55.94 1fr0 n LEU 664 Cb 0.05 0.18 -0.08 0.00 -2.33 0.00 0.00 43.42 41.24 1fr0 n LEU 664 CO 0.08 0.55 -0.17 -1.48 -1.33 0.00 0.00 177.39 175.04 1fr0 s LEU 665 N -5.80 1.48 -0.30 2.23 0.05 -0.58 -2.21 118.68 113.54 1fr0 s LEU 665 Ca -0.13 -0.98 -0.18 0.00 0.05 0.00 0.00 54.13 52.89 1fr0 s LEU 665 Cb 0.07 0.74 -0.02 0.00 -2.05 0.00 0.00 46.19 44.93 1fr0 s LEU 665 CO 0.79 -0.78 0.51 -0.62 -0.55 0.00 0.00 176.35 175.70 1fr0 s ASP 666 N -2.98 6.37 0.03 1.48 -1.08 -0.88 -4.56 116.67 115.06 1fr0 s ASP 666 Ca 0.17 0.28 -0.20 0.00 -0.52 0.00 0.00 52.55 52.27 1fr0 s ASP 666 Cb 0.06 -2.27 -0.15 0.00 -1.46 0.00 0.00 42.92 39.09 1fr0 s ASP 666 CO -0.02 -0.37 1.32 0.40 0.52 0.00 0.00 175.17 177.03 1fr0 h ILE 667 N 5.49 1.36 -0.13 4.11 5.03 -1.92 -1.90 117.51 129.56 1fr0 h ILE 667 Ca -0.29 -1.35 -0.10 0.00 -0.12 0.00 0.00 64.86 63.01 1fr0 h ILE 667 Cb 1.13 1.93 0.00 0.00 -3.03 0.00 0.00 36.82 36.86 1fr0 h ILE 667 CO 0.74 0.40 -0.29 1.55 -0.68 0.00 0.00 178.15 179.86 1fr0 h PRO 668 N -0.04 0.42 -0.54 2.37 0.13 -1.99 -1.72 132.00 130.64 1fr0 h PRO 668 Ca 0.02 -0.28 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1fr0 h PRO 668 Cb 0.71 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 31.85 1fr0 h PRO 668 CO 0.04 0.89 0.35 1.98 -0.23 0.00 0.00 178.00 181.03 1fr0 h MET 669 N 0.01 0.71 -0.32 0.86 4.05 -1.98 -0.27 114.93 118.00 1fr0 h MET 669 Ca -0.00 -0.05 -0.02 0.00 -0.28 0.00 0.00 59.70 59.35 1fr0 h MET 669 Cb 0.89 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 31.52 1fr0 h MET 669 CO 0.06 0.49 0.12 -0.07 0.23 0.00 0.00 176.91 177.75 1fr0 h LEU 670 N 0.73 0.44 0.22 3.39 3.38 -1.36 -1.84 115.31 120.27 1fr0 h LEU 670 Ca 0.20 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1fr0 h LEU 670 Cb -0.06 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1fr0 h LEU 670 CO -0.04 0.50 -0.20 -0.08 0.09 0.00 0.00 178.44 178.71 1fr0 h GLU 671 N 0.37 -0.43 -0.21 1.13 4.81 -0.94 -2.58 114.58 116.74 1fr0 h GLU 671 Ca 0.11 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.42 1fr0 h GLU 671 Cb 0.19 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 29.61 1fr0 h GLU 671 CO -0.01 -0.28 -0.21 0.37 -0.73 0.00 0.00 179.01 178.15 1fr0 h GLN 672 N -0.44 -0.21 -0.94 1.92 5.75 -0.96 -0.15 115.11 120.07 1fr0 h GLN 672 Ca -0.01 0.01 0.26 0.00 -0.15 0.00 0.00 58.65 58.77 1fr0 h GLN 672 Cb 0.41 0.05 -0.14 0.00 1.07 0.00 0.00 27.48 28.87 1fr0 h GLN 672 CO -0.03 -0.14 0.43 1.88 -2.65 0.00 0.00 178.83 178.31 1fr0 h TYR 673 N -0.22 0.70 0.00 3.99 -1.99 -1.08 2.03 116.97 120.40 1fr0 h TYR 673 Ca 0.13 0.04 -0.01 0.00 2.00 0.00 0.00 58.73 60.88 1fr0 h TYR 673 Cb 0.41 -0.16 -0.00 0.00 2.00 0.00 0.00 36.73 38.98 1fr0 h TYR 673 CO -0.35 -0.13 -0.07 -0.07 -0.00 0.00 0.00 178.16 177.54 1fr0 h LEU 674 N 0.34 0.00 -0.02 3.88 3.38 -0.67 0.13 115.31 122.34 1fr0 h LEU 674 Ca 0.63 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1fr0 h LEU 674 Cb 1.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.06 1fr0 h LEU 674 CO -0.59 0.07 0.00 1.21 0.09 0.00 0.00 178.44 179.22 1fr0 n GLU 675 N -3.18 1.01 0.00 1.13 2.13 0.69 -3.16 120.64 119.26 1fr0 n GLU 675 Ca 0.01 -0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.81 1fr0 n GLU 675 Cb 0.37 -1.12 0.00 0.00 0.27 0.00 0.00 31.44 30.96 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 -0.59 0.00 -0.05 4.31 -0.00 -0.97 -4.93 117.00 114.76 1fr0 n LEU 676 Ca 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 56.06 1fr0 n LEU 676 Cb 0.03 0.12 -0.16 0.00 -0.00 0.00 0.00 43.42 43.41 1fr0 n LEU 676 CO 0.04 -0.35 -0.95 1.33 -0.00 0.00 0.00 177.39 177.47 1fr0 n VAL 677 N -2.20 0.70 0.00 1.47 0.24 0.40 -5.10 118.33 113.84 1fr0 n VAL 677 Ca 0.00 -0.65 0.00 0.00 -2.04 0.00 0.00 64.34 61.65 1fr0 n VAL 677 Cb 0.00 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.12 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 1.59 -0.25 0.08 7.63 0.00 -0.96 -4.39 105.19 108.89 1fr0 n GLY 678 Ca -0.18 -1.87 0.12 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.35 0.17 -0.07 1.61 -0.04 -1.26 -3.43 135.00 131.63 1fr0 n PRO 679 Ca 0.00 0.23 -0.05 0.00 -0.04 0.00 0.00 63.50 63.64 1fr0 n PRO 679 Cb 0.00 -1.73 0.15 0.00 -0.04 0.00 0.00 33.50 31.88 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 0.71 -0.25 0.54 3.64 -1.99 -1.12 116.57 118.10 1fr0 h LYS 680 Ca 0.00 -0.23 -0.19 0.00 -1.27 0.00 0.00 60.65 58.96 1fr0 h LYS 680 Cb 0.55 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1fr0 h LYS 680 CO 0.00 0.81 -0.58 1.25 -2.27 0.00 0.00 179.45 178.66 1fr0 h LEU 681 N 0.64 0.90 -0.34 5.20 5.85 -1.76 -1.03 115.31 124.77 1fr0 h LEU 681 Ca 0.11 -0.50 -0.19 0.00 0.84 0.00 0.00 57.88 58.14 1fr0 h LEU 681 Cb 0.58 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.35 1fr0 h LEU 681 CO 0.04 1.28 -0.75 0.40 -0.34 0.00 0.00 178.44 179.07 1fr0 h ILE 682 N 0.61 1.36 0.01 4.05 5.03 -1.68 -1.05 117.51 125.83 1fr0 h ILE 682 Ca 0.00 -2.13 -0.19 0.00 -0.12 0.00 0.00 64.86 62.43 1fr0 h ILE 682 Cb 1.18 2.11 0.02 0.00 -3.03 0.00 0.00 36.82 37.09 1fr0 h ILE 682 CO 0.12 0.65 -0.75 0.00 -0.68 0.00 0.00 178.15 177.49 1fr0 h THR 683 N 0.32 1.39 -0.06 -0.27 1.03 -1.21 -1.33 112.91 112.78 1fr0 h THR 683 Ca -0.04 -2.15 -0.04 0.00 -0.01 0.00 0.00 66.41 64.17 1fr0 h THR 683 Cb 1.34 2.57 0.00 0.00 -1.07 0.00 0.00 68.15 70.99 1fr0 h THR 683 CO 0.13 0.64 -0.14 -0.78 -0.01 0.00 0.00 175.52 175.37 1fr0 h ASP 684 N 0.03 0.22 -0.50 0.00 3.58 -1.25 -1.97 116.42 116.53 1fr0 h ASP 684 Ca -0.10 -0.58 -0.09 0.00 0.42 0.00 0.00 57.03 56.68 1fr0 h ASP 684 Cb 1.45 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 42.41 1fr0 h ASP 684 CO 0.15 0.76 -0.05 1.23 -2.88 0.00 0.00 179.24 178.45 1fr0 h GLY 685 N -0.31 0.99 1.34 -0.78 0.00 -1.31 -2.71 103.07 100.30 1fr0 h GLY 685 Ca -0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 47.33 46.51 1fr0 h GLY 685 CO 0.03 0.70 0.13 -2.00 0.00 0.00 0.00 176.54 175.41 1fr0 h LEU 686 N 0.78 0.77 0.17 3.11 5.85 -1.28 -1.58 115.31 123.12 1fr0 h LEU 686 Ca 0.14 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1fr0 h LEU 686 Cb 0.59 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1fr0 h LEU 686 CO 0.04 0.75 -0.08 0.00 -0.34 0.00 0.00 178.44 178.81 1fr0 h ALA 687 N 1.35 -0.23 0.20 1.25 0.00 -1.14 0.16 119.26 120.85 1fr0 h ALA 687 Ca 0.18 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1fr0 h ALA 687 Cb 0.29 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1fr0 h ALA 687 CO -0.00 -0.57 -0.11 0.28 0.00 0.00 0.00 179.25 178.86 1fr0 h VAL 688 N -0.36 0.78 0.00 0.00 2.07 -1.34 -1.45 116.25 115.95 1fr0 h VAL 688 Ca -0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1fr0 h VAL 688 Cb 0.28 0.78 -0.00 0.00 -1.52 0.00 0.00 31.29 30.82 1fr0 h VAL 688 CO 0.04 0.00 -0.05 0.15 0.02 0.00 0.00 177.57 177.73 1fr0 h PHE 689 N -0.28 0.00 -0.20 1.57 3.04 -1.25 -2.09 116.94 117.73 1fr0 h PHE 689 Ca -0.02 0.00 -0.20 0.00 3.98 0.00 0.00 57.97 61.73 1fr0 h PHE 689 Cb 0.23 0.00 0.01 0.00 2.56 0.00 0.00 35.95 38.74 1fr0 h PHE 689 CO -0.08 0.05 -0.64 0.93 -2.02 0.00 0.00 178.31 176.56 1fr0 h GLU 690 N 0.00 0.78 -0.64 1.11 4.39 0.26 0.33 114.58 120.81 1fr0 h GLU 690 Ca -0.00 -0.58 -0.03 0.00 0.34 0.00 0.00 59.36 59.09 1fr0 h GLU 690 Cb 0.13 0.10 -0.03 0.00 -0.10 0.00 0.00 28.75 28.86 1fr0 h GLU 690 CO 0.01 1.20 0.27 0.87 -1.16 0.00 0.00 179.01 180.19 1fr0 h LYS 691 N 0.52 0.96 -0.17 2.33 1.57 -0.61 -2.45 116.57 118.71 1fr0 h LYS 691 Ca -0.02 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.59 1fr0 h LYS 691 Cb 1.26 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1fr0 h LYS 691 CO 0.14 0.79 0.00 -1.33 -0.57 0.00 0.00 179.45 178.48 1fr0 n MET 692 N -4.44 2.03 0.14 3.15 2.81 -1.06 -4.34 117.12 115.40 1fr0 n MET 692 Ca 0.04 -1.53 -0.14 0.00 -1.81 0.00 0.00 57.70 54.27 1fr0 n MET 692 Cb 0.16 -1.45 -0.08 0.00 -0.71 0.00 0.00 33.22 31.14 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 3.27 -0.30 0.00 0.03 -1.53 0.17 0.22 114.93 116.79 1fr0 h MET 693 Ca 0.00 0.02 -0.09 0.00 -3.44 0.00 0.00 59.70 56.20 1fr0 h MET 693 Cb 0.71 0.07 -0.01 0.00 -0.55 0.00 0.00 31.60 31.82 1fr0 h MET 693 CO 0.00 -0.07 -0.41 -1.00 0.14 0.00 0.00 176.91 175.57 1fr0 h PRO 694 N -0.50 0.00 -0.12 0.39 0.13 -1.76 -2.29 132.00 127.85 1fr0 h PRO 694 Ca -0.03 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.89 1fr0 h PRO 694 Cb 0.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.51 1fr0 h PRO 694 CO 0.05 0.41 -0.76 0.78 -0.23 0.00 0.00 178.00 178.25 1fr0 h GLY 695 N 1.33 0.71 0.84 1.56 0.00 -1.72 -1.81 103.07 103.98 1fr0 h GLY 695 Ca -0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.31 1fr0 h GLY 695 CO 0.05 0.89 -0.11 -0.97 0.00 0.00 0.00 176.54 176.40 1fr0 h TYR 696 N 0.44 -0.30 -0.90 5.60 0.05 -0.27 -2.52 116.97 119.07 1fr0 h TYR 696 Ca -0.04 -0.01 0.02 0.00 0.05 0.00 0.00 58.73 58.74 1fr0 h TYR 696 Cb 1.37 0.10 -0.05 0.00 1.01 0.00 0.00 36.73 39.16 1fr0 h TYR 696 CO 0.07 -0.07 0.60 0.28 -1.05 0.00 0.00 178.16 177.99 1fr0 h VAL 697 N -0.48 1.21 -0.02 -2.88 2.07 -1.47 -2.15 116.25 112.54 1fr0 h VAL 697 Ca -0.03 -0.41 0.03 0.00 0.82 0.00 0.00 66.70 67.11 1fr0 h VAL 697 Cb 0.36 -0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 29.99 1fr0 h VAL 697 CO 0.05 0.22 -0.33 0.77 0.02 0.00 0.00 177.57 178.30 1fr0 h SER 698 N 1.20 -0.99 -0.61 0.57 4.64 -1.08 0.12 113.55 117.40 1fr0 h SER 698 Ca 0.34 0.13 0.08 0.00 -0.47 0.00 0.00 61.79 61.87 1fr0 h SER 698 Cb -0.10 0.40 -0.04 0.00 -0.31 0.00 0.00 62.40 62.35 1fr0 h SER 698 CO -0.08 -0.39 0.41 0.58 -0.87 0.00 0.00 176.83 176.48 1fr0 h VAL 699 N -0.47 0.95 0.50 0.95 2.07 -1.08 -2.34 116.25 116.83 1fr0 h VAL 699 Ca 0.06 -0.18 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1fr0 h VAL 699 Cb 0.57 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1fr0 h VAL 699 CO -0.28 0.09 -0.42 0.25 0.02 0.00 0.00 177.57 177.23 1fr0 h LEU 700 N 0.51 -1.11 -0.77 2.57 7.12 -0.16 -1.92 115.31 121.55 1fr0 h LEU 700 Ca 0.28 0.08 0.14 0.00 0.13 0.00 0.00 57.88 58.50 1fr0 h LEU 700 Cb 0.41 0.35 -0.09 0.00 -0.53 0.00 0.00 40.66 40.81 1fr0 h LEU 700 CO -0.08 -0.59 0.35 -0.08 -0.13 0.00 0.00 178.44 177.90 1fr0 h GLU 701 N -0.91 0.50 -0.63 1.25 4.81 -0.78 0.27 114.58 119.10 1fr0 h GLU 701 Ca -0.05 -0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.27 1fr0 h GLU 701 Cb 0.78 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.01 1fr0 h GLU 701 CO -0.01 0.33 0.43 1.03 -0.73 0.00 0.00 179.01 180.06 1fr0 h SER 702 N 0.52 0.27 0.69 1.04 0.87 -1.01 0.67 113.55 116.61 1fr0 h SER 702 Ca 0.42 0.01 -0.18 0.00 -1.23 0.00 0.00 61.79 60.81 1fr0 h SER 702 Cb 0.59 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 1fr0 h SER 702 CO -0.37 0.15 -0.82 0.78 -0.53 0.00 0.00 176.83 176.04 1fr0 h ASN 703 N 0.30 0.12 -0.35 6.23 4.21 0.26 -3.10 115.58 123.25 1fr0 h ASN 703 Ca 0.30 -0.10 -0.03 0.00 1.21 0.00 0.00 56.30 57.69 1fr0 h ASN 703 Cb 0.76 -0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 37.91 1fr0 h ASN 703 CO -0.07 0.89 0.11 0.25 -1.29 0.00 0.00 177.43 177.32 1fr0 h LEU 704 N 0.05 0.51 0.00 1.61 7.12 -0.20 0.36 115.31 124.76 1fr0 h LEU 704 Ca -0.02 -0.21 0.00 0.00 0.13 0.00 0.00 57.88 57.78 1fr0 h LEU 704 Cb 1.44 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 41.44 1fr0 h LEU 704 CO 0.12 0.58 0.00 0.35 -0.13 0.00 0.00 178.44 179.36 1fr0 n THR 705 N -4.64 0.21 0.31 1.05 -2.24 -0.98 -2.40 114.28 105.58 1fr0 n THR 705 Ca -0.01 0.05 0.04 0.00 -2.27 0.00 0.00 64.05 61.86 1fr0 n THR 705 Cb 0.17 -0.70 0.03 0.00 -2.10 0.00 0.00 70.33 67.73 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 -1.17 2.49 -3.25 6.98 0.00 -0.64 -4.99 120.51 119.94 1fr0 n ALA 706 Ca 0.13 -0.55 -0.16 0.00 0.00 0.00 0.00 53.44 52.85 1fr0 n ALA 706 Cb 0.13 -0.25 0.06 0.00 0.00 0.00 0.00 19.45 19.39 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 0.39 -5.56 -2.60 0.00 6.02 -0.14 -4.92 117.38 110.57 1fr0 n GLN 707 Ca 0.04 0.59 -0.41 0.00 -0.01 0.00 0.00 57.00 57.21 1fr0 n GLN 707 Cb 0.18 -4.91 0.01 0.00 1.02 0.00 0.00 30.24 26.54 1fr0 n GLN 707 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1fr0 n ASP 708 N -1.83 7.09 -0.01 1.08 2.03 -0.07 -4.81 116.55 120.03 1fr0 n ASP 708 Ca -0.02 -3.49 -0.09 0.00 0.52 0.00 0.00 54.79 51.71 1fr0 n ASP 708 Cb 0.55 -1.25 -0.03 0.00 -0.72 0.00 0.00 41.12 39.68 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 4.69 -0.25 -0.86 -0.67 1.57 -1.91 -0.07 116.57 119.06 1fr0 h LYS 709 Ca 0.47 0.02 0.23 0.00 -1.87 0.00 0.00 60.65 59.50 1fr0 h LYS 709 Cb 0.41 0.06 -0.15 0.00 0.08 0.00 0.00 32.23 32.63 1fr0 h LYS 709 CO 1.30 -0.17 0.15 -0.22 -0.57 0.00 0.00 179.45 179.94 1fr0 h LYS 710 N -0.26 0.14 -0.11 3.15 3.64 -2.00 0.16 116.57 121.29 1fr0 h LYS 710 Ca 0.11 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.36 1fr0 h LYS 710 Cb 0.42 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.21 1fr0 h LYS 710 CO -0.31 0.09 -0.39 0.78 -2.27 0.00 0.00 179.45 177.36 1fr0 h GLY 711 N 0.15 0.51 0.57 5.01 0.00 -1.73 -2.47 103.07 105.10 1fr0 h GLY 711 Ca 0.53 -0.67 0.07 0.00 0.00 0.00 0.00 47.33 47.25 1fr0 h GLY 711 CO -0.70 0.60 0.27 -2.22 0.00 0.00 0.00 176.54 174.49 1fr0 h ILE 712 N 0.05 0.88 -0.33 2.60 2.04 0.90 0.10 117.51 123.75 1fr0 h ILE 712 Ca -0.02 -0.17 -0.05 0.00 1.00 0.00 0.00 64.86 65.62 1fr0 h ILE 712 Cb 1.02 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1fr0 h ILE 712 CO 0.08 0.09 -0.01 0.58 0.00 0.00 0.00 178.15 178.90 1fr0 h VAL 713 N 0.50 1.26 0.62 1.67 2.07 -0.82 0.57 116.25 122.12 1fr0 h VAL 713 Ca 0.27 -0.97 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 1fr0 h VAL 713 Cb 0.25 1.25 0.01 0.00 -1.52 0.00 0.00 31.29 31.27 1fr0 h VAL 713 CO -0.22 0.32 -0.30 -0.08 0.02 0.00 0.00 177.57 177.30 1fr0 h GLU 714 N 0.38 -0.81 0.00 1.57 4.57 -0.94 -1.70 114.58 117.66 1fr0 h GLU 714 Ca 0.09 0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.33 1fr0 h GLU 714 Cb 0.46 0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 1fr0 h GLU 714 CO 0.02 -0.50 0.00 0.39 -1.18 0.00 0.00 179.01 177.74 1fr0 n GLU 715 N -5.40 0.08 0.05 1.92 1.02 0.30 -1.72 120.64 116.89 1fr0 n GLU 715 Ca -0.13 0.46 -0.02 0.00 -0.02 0.00 0.00 57.16 57.46 1fr0 n GLU 715 Cb 0.36 -1.71 -0.01 0.00 -0.02 0.00 0.00 31.44 30.05 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 1.11 -0.14 2.00 0.62 0.00 0.06 -1.82 103.07 104.90 1fr0 h GLY 716 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1fr0 h GLY 716 CO 0.00 -0.05 0.00 1.12 0.00 0.00 0.00 176.54 177.61 1fr0 h HIS 717 N -0.25 0.00 0.01 5.60 2.07 -1.46 -2.09 115.15 119.03 1fr0 h HIS 717 Ca -0.01 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1fr0 h HIS 717 Cb 0.10 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.08 1fr0 h HIS 717 CO 0.08 0.00 -0.00 -0.22 -3.07 0.00 0.00 177.93 174.72 1fr0 h LYS 718 N 0.00 -0.01 0.07 5.12 1.63 -1.41 -2.21 116.57 119.76 1fr0 h LYS 718 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1fr0 h LYS 718 Cb 0.48 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.11 1fr0 h LYS 718 CO 0.00 0.73 -0.04 0.82 -3.45 0.00 0.00 179.45 177.51 1fr0 h ILE 719 N -0.98 1.17 -0.79 2.00 2.04 -1.35 -1.51 117.51 118.08 1fr0 h ILE 719 Ca -0.00 -1.43 -0.03 0.00 1.00 0.00 0.00 64.86 64.40 1fr0 h ILE 719 Cb 0.74 2.02 -0.04 0.00 -0.74 0.00 0.00 36.82 38.80 1fr0 h ILE 719 CO 0.00 0.32 0.39 0.11 0.00 0.00 0.00 178.15 178.97 1fr0 h LYS 720 N -0.82 1.14 -0.36 2.37 6.56 -1.53 -1.91 116.57 122.02 1fr0 h LYS 720 Ca -0.01 -0.16 -0.02 0.00 -1.06 0.00 0.00 60.65 59.39 1fr0 h LYS 720 Cb 0.61 -0.21 -0.02 0.00 -0.57 0.00 0.00 32.23 32.05 1fr0 h LYS 720 CO 0.02 0.88 0.13 0.78 -2.06 0.00 0.00 179.45 179.19 1fr0 h GLY 721 N 1.12 0.58 0.65 3.86 0.00 -1.47 0.47 103.07 108.28 1fr0 h GLY 721 Ca 0.27 -0.33 0.02 0.00 0.00 0.00 0.00 47.33 47.29 1fr0 h GLY 721 CO -0.04 0.31 -0.20 0.00 0.00 0.00 0.00 176.54 176.62 1fr0 h ALA 722 N 0.97 -0.32 -0.90 3.60 0.00 -0.92 -2.19 119.26 119.52 1fr0 h ALA 722 Ca 0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1fr0 h ALA 722 Cb 0.21 0.31 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1fr0 h ALA 722 CO -0.01 -0.72 0.49 0.00 0.00 0.00 0.00 179.25 179.02 1fr0 h ALA 723 N 0.46 1.18 -0.75 0.00 0.00 -1.24 -1.71 119.26 117.20 1fr0 h ALA 723 Ca 0.03 -0.13 0.21 0.00 0.00 0.00 0.00 54.91 55.02 1fr0 h ALA 723 Cb 0.39 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1fr0 h ALA 723 CO -0.12 0.66 0.54 0.78 0.00 0.00 0.00 179.25 181.11 1fr0 h GLY 724 N 1.26 0.06 2.00 0.00 0.00 -0.28 0.63 103.07 106.73 1fr0 h GLY 724 Ca 0.32 -0.01 -0.03 0.00 0.00 0.00 0.00 47.33 47.60 1fr0 h GLY 724 CO -0.05 0.00 -0.15 0.23 0.00 0.00 0.00 176.54 176.57 1fr0 h SER 725 N 0.03 0.00 -0.24 0.19 0.87 -0.92 -2.25 113.55 111.23 1fr0 h SER 725 Ca 0.36 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.92 1fr0 h SER 725 Cb 1.39 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1fr0 h SER 725 CO -0.02 0.15 0.00 0.52 -0.53 0.00 0.00 176.83 176.96 1fr0 n VAL 726 N -3.30 0.32 0.00 2.23 0.31 0.22 -4.82 118.33 113.30 1fr0 n VAL 726 Ca 0.00 -0.35 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 1fr0 n VAL 726 Cb 0.40 0.19 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 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 0.96 0.82 3.16 2.92 0.00 -0.85 -4.96 105.19 107.25 1fr0 n GLY 727 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 5.95 0.29 0.99 4.77 -0.33 -2.07 117.00 126.60 1fr0 n LEU 728 Ca 0.00 -4.58 0.19 0.00 -0.03 0.00 0.00 56.01 51.59 1fr0 n LEU 728 Cb 0.00 -1.54 0.83 0.00 -2.33 0.00 0.00 43.42 40.38 1fr0 n LEU 728 CO 0.00 1.08 1.04 0.08 -1.33 0.00 0.00 177.39 178.26 1fr0 h ARG 729 N 6.41 0.00 0.46 3.23 0.11 -1.65 -2.73 114.38 120.21 1fr0 h ARG 729 Ca 0.35 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.41 1fr0 h ARG 729 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 1fr0 h ARG 729 CO 1.43 0.01 -0.22 1.25 0.10 0.00 0.00 179.97 182.53 1fr0 h HIS 730 N 0.00 -0.57 -0.69 4.08 2.76 -1.61 -2.48 115.15 116.64 1fr0 h HIS 730 Ca -0.00 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 1fr0 h HIS 730 Cb 0.38 0.19 -0.05 0.00 1.55 0.00 0.00 27.41 29.47 1fr0 h HIS 730 CO 0.00 -0.36 0.41 -0.07 -1.30 0.00 0.00 177.93 176.61 1fr0 h LEU 731 N -0.74 0.63 -0.49 0.26 3.38 -1.79 -2.08 115.31 114.48 1fr0 h LEU 731 Ca -0.06 0.02 0.07 0.00 0.09 0.00 0.00 57.88 57.99 1fr0 h LEU 731 Cb 0.47 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 41.02 1fr0 h LEU 731 CO 0.10 0.42 -0.50 -0.61 0.09 0.00 0.00 178.44 177.94 1fr0 h GLN 732 N 0.76 -0.30 -0.87 1.13 4.15 -1.37 0.18 115.11 118.79 1fr0 h GLN 732 Ca 0.30 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.75 1fr0 h GLN 732 Cb 0.13 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 27.85 1fr0 h GLN 732 CO -0.16 -0.20 0.58 1.96 -1.93 0.00 0.00 178.83 179.08 1fr0 h GLN 733 N -0.31 1.15 0.10 1.69 7.50 -1.10 -1.99 115.11 122.14 1fr0 h GLN 733 Ca 0.12 -0.07 0.02 0.00 0.50 0.00 0.00 58.65 59.23 1fr0 h GLN 733 Cb 0.58 -0.26 -0.04 0.00 0.05 0.00 0.00 27.48 27.81 1fr0 h GLN 733 CO -0.64 0.76 -0.31 -0.07 -1.50 0.00 0.00 178.83 177.07 1fr0 h LEU 734 N 1.18 -0.89 -0.47 1.46 4.07 -0.02 -2.07 115.31 118.57 1fr0 h LEU 734 Ca 0.32 0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.39 1fr0 h LEU 734 Cb -0.14 0.34 -0.02 0.00 1.08 0.00 0.00 40.66 41.92 1fr0 h LEU 734 CO -0.07 -0.39 0.30 1.23 -1.08 0.00 0.00 178.44 178.43 1fr0 h GLY 735 N -0.52 0.68 -0.30 0.83 0.00 -0.95 -1.99 103.07 100.82 1fr0 h GLY 735 Ca 0.04 -0.27 0.28 0.00 0.00 0.00 0.00 47.33 47.38 1fr0 h GLY 735 CO -0.20 0.26 0.61 -1.61 0.00 0.00 0.00 176.54 175.61 1fr0 h GLN 736 N 0.64 0.44 0.01 4.80 4.15 -0.82 0.25 115.11 124.58 1fr0 h GLN 736 Ca 0.17 -0.03 -0.24 0.00 0.77 0.00 0.00 58.65 59.32 1fr0 h GLN 736 Cb -0.04 -0.10 0.01 0.00 0.21 0.00 0.00 27.48 27.56 1fr0 h GLN 736 CO -0.03 0.29 -0.99 1.96 -1.93 0.00 0.00 178.83 178.13 1fr0 h GLN 737 N 0.45 0.50 -0.01 1.69 7.50 -0.71 -3.10 115.11 121.43 1fr0 h GLN 737 Ca 0.67 -0.55 0.00 0.00 0.50 0.00 0.00 58.65 59.28 1fr0 h GLN 737 Cb 1.47 0.16 -0.00 0.00 0.05 0.00 0.00 27.48 29.16 1fr0 h GLN 737 CO -0.48 1.18 0.01 0.82 -1.50 0.00 0.00 178.83 178.86 1fr0 h ILE 738 N 0.28 0.31 0.00 2.54 2.04 0.06 0.59 117.51 123.32 1fr0 h ILE 738 Ca -0.10 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.76 1fr0 h ILE 738 Cb 1.63 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 1fr0 h ILE 738 CO 0.18 0.00 0.00 1.67 0.00 0.00 0.00 178.15 180.00 1fr0 n GLN 739 N -3.53 0.16 -2.76 2.37 0.00 -0.77 -3.44 117.38 109.41 1fr0 n GLN 739 Ca -0.03 0.16 -0.30 0.00 -0.00 0.00 0.00 57.00 56.83 1fr0 n GLN 739 Cb 0.09 -1.50 -0.02 0.00 0.00 0.00 0.00 30.24 28.81 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 -1.35 5.07 -2.15 1.69 7.64 0.20 -4.90 113.62 119.82 1fr0 n SER 740 Ca 0.07 -3.70 -0.04 0.00 1.01 0.00 0.00 58.87 56.20 1fr0 n SER 740 Cb 0.15 -0.65 -0.06 0.00 -1.01 0.00 0.00 64.21 62.64 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 -0.28 0.85 0.00 1.43 -0.04 -1.22 -2.82 135.00 132.92 1fr0 n PRO 741 Ca 0.36 -0.37 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1fr0 n PRO 741 Cb 0.42 -1.63 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 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 2.55 2.15 -4.75 3.54 8.00 -1.26 -4.93 116.55 121.84 1fr0 n ASP 742 Ca 0.16 -0.03 -0.41 0.00 0.71 0.00 0.00 54.79 55.21 1fr0 n ASP 742 Cb 0.39 0.50 -0.02 0.00 -0.02 0.00 0.00 41.12 41.97 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fr0 s LEU 743 N -1.43 4.39 0.36 0.64 1.02 -1.13 -4.86 118.68 117.68 1fr0 s LEU 743 Ca 0.00 2.68 0.27 0.00 0.02 0.00 0.00 54.13 57.09 1fr0 s LEU 743 Cb 0.00 -3.63 1.21 0.00 0.02 0.00 0.00 46.19 43.79 1fr0 s LEU 743 CO 0.00 -0.67 1.80 1.55 0.02 0.00 0.00 176.35 179.05 1fr0 h PRO 744 N 4.64 0.00 0.00 1.29 0.13 -1.96 -2.07 132.00 134.02 1fr0 h PRO 744 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.75 0.00 -1.94 0.00 -0.23 0.00 0.00 178.00 176.57 1fr0 n ALA 745 N -1.86 2.83 0.11 -0.56 0.00 -1.26 -4.15 120.51 115.62 1fr0 n ALA 745 Ca 0.01 -0.51 -0.18 0.00 0.00 0.00 0.00 53.44 52.76 1fr0 n ALA 745 Cb 0.19 -0.73 -0.14 0.00 0.00 0.00 0.00 19.45 18.77 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 0.61 0.00 0.00 7.01 -1.74 -2.56 115.95 119.26 1fr0 h TRP 746 Ca 0.00 -0.45 0.00 0.00 2.11 0.00 0.00 58.89 60.55 1fr0 h TRP 746 Cb 0.96 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 27.99 1fr0 h TRP 746 CO 0.00 1.37 0.00 -0.85 -2.79 0.00 0.00 178.44 176.17 1fr0 n GLU 747 N -3.57 0.20 -0.10 2.65 0.28 -0.97 -0.79 120.64 118.35 1fr0 n GLU 747 Ca -0.12 0.29 -0.20 0.00 -0.16 0.00 0.00 57.16 56.98 1fr0 n GLU 747 Cb 1.05 -1.80 -0.12 0.00 1.43 0.00 0.00 31.44 32.00 1fr0 n GLU 747 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1fr0 n ASP 748 N -2.16 2.01 -0.16 -1.84 2.03 -1.23 -4.33 116.55 110.87 1fr0 n ASP 748 Ca 0.04 -0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.47 1fr0 n ASP 748 Cb 0.32 -0.57 0.31 0.00 -0.72 0.00 0.00 41.12 40.47 1fr0 n ASP 748 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1fr0 n ASN 749 N -3.42 0.87 -0.45 1.67 0.23 -0.97 -4.18 115.26 109.01 1fr0 n ASN 749 Ca -0.43 -0.69 0.37 0.00 -0.53 0.00 0.00 54.58 53.31 1fr0 n ASN 749 Cb 0.99 0.20 0.68 0.00 -2.08 0.00 0.00 39.78 39.57 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 0.79 0.21 0.88 3.53 3.04 -1.15 0.29 116.25 123.84 1fr0 h VAL 750 Ca 0.00 -0.04 -0.04 0.00 -1.01 0.00 0.00 66.70 65.61 1fr0 h VAL 750 Cb 0.51 0.10 0.00 0.00 -2.01 0.00 0.00 31.29 29.89 1fr0 h VAL 750 CO 0.00 0.02 -0.47 1.23 -1.01 0.00 0.00 177.57 177.34 1fr0 h GLY 751 N 0.10 -1.34 0.56 3.17 0.00 -1.85 -1.89 103.07 101.82 1fr0 h GLY 751 Ca 0.76 0.52 0.21 0.00 0.00 0.00 0.00 47.33 48.82 1fr0 h GLY 751 CO -0.26 -0.47 0.52 -2.09 0.00 0.00 0.00 176.54 174.24 1fr0 h GLU 752 N -1.24 0.00 -0.04 4.80 4.57 -1.26 -0.69 114.58 120.71 1fr0 h GLU 752 Ca -0.12 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.06 1fr0 h GLU 752 Cb 0.97 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.56 1fr0 h GLU 752 CO 0.17 0.00 0.03 2.35 -1.18 0.00 0.00 179.01 180.37 1fr0 h TRP 753 N 0.00 0.06 -0.34 0.92 2.91 -0.84 0.74 115.95 119.40 1fr0 h TRP 753 Ca 0.34 -0.00 -0.06 0.00 1.13 0.00 0.00 58.89 60.30 1fr0 h TRP 753 Cb 1.38 -0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.00 1fr0 h TRP 753 CO 0.00 0.09 -0.01 0.82 -1.03 0.00 0.00 178.44 178.30 1fr0 h ILE 754 N 0.01 1.26 0.88 2.65 2.04 -0.76 -1.78 117.51 121.82 1fr0 h ILE 754 Ca 0.02 -0.99 -0.04 0.00 1.00 0.00 0.00 64.86 64.84 1fr0 h ILE 754 Cb 0.05 1.24 0.01 0.00 -0.74 0.00 0.00 36.82 37.37 1fr0 h ILE 754 CO -0.00 0.33 -0.42 -0.08 0.00 0.00 0.00 178.15 177.97 1fr0 h GLU 755 N 0.41 -1.14 -0.53 2.37 4.81 -1.24 -2.63 114.58 116.63 1fr0 h GLU 755 Ca 0.09 0.08 0.10 0.00 -0.13 0.00 0.00 59.36 59.50 1fr0 h GLU 755 Cb 0.47 0.26 -0.08 0.00 0.63 0.00 0.00 28.75 30.03 1fr0 h GLU 755 CO 0.02 -0.76 0.05 1.49 -0.73 0.00 0.00 179.01 179.09 1fr0 h GLU 756 N -1.18 0.17 -0.01 1.92 4.81 -0.89 -2.56 114.58 116.85 1fr0 h GLU 756 Ca -0.12 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 1fr0 h GLU 756 Cb 0.90 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.24 1fr0 h GLU 756 CO 0.20 0.11 -0.01 1.98 -0.73 0.00 0.00 179.01 180.56 1fr0 h MET 757 N 0.18 -0.01 -0.61 1.92 4.05 -1.16 -2.72 114.93 116.57 1fr0 h MET 757 Ca 0.27 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.75 1fr0 h MET 757 Cb 0.40 0.00 -0.08 0.00 -0.80 0.00 0.00 31.60 31.12 1fr0 h MET 757 CO -0.40 -0.01 -0.47 0.87 0.23 0.00 0.00 176.91 177.14 1fr0 h LYS 758 N -0.01 -0.13 -2.78 0.39 1.57 -1.27 0.21 116.57 114.54 1fr0 h LYS 758 Ca 0.00 0.01 -0.58 0.00 -1.87 0.00 0.00 60.65 58.21 1fr0 h LYS 758 Cb 0.02 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1fr0 h LYS 758 CO -0.01 -0.09 2.95 -1.91 -0.57 0.00 0.00 179.45 179.83 1fr0 n GLU 759 N -4.84 3.42 0.01 3.15 2.13 -0.98 -3.97 120.64 119.56 1fr0 n GLU 759 Ca -0.00 -2.04 0.00 0.00 0.66 0.00 0.00 57.16 55.78 1fr0 n GLU 759 Cb 0.24 -2.63 0.00 0.00 0.27 0.00 0.00 31.44 29.31 1fr0 n GLU 759 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1fr0 n GLU 760 N 3.25 0.00 -0.31 5.31 4.07 -0.53 -4.87 120.64 127.56 1fr0 n GLU 760 Ca 0.71 0.00 0.16 0.00 -0.06 0.00 0.00 57.16 57.97 1fr0 n GLU 760 Cb 0.36 0.00 0.34 0.00 -0.06 0.00 0.00 31.44 32.08 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 -0.06 0.00 0.00 177.13 177.18 1fr0 h TRP 761 N 0.00 0.38 0.00 4.31 5.08 -0.77 0.45 115.95 125.41 1fr0 h TRP 761 Ca 0.00 0.05 0.03 0.00 1.08 0.00 0.00 58.89 60.05 1fr0 h TRP 761 Cb 0.00 -0.02 -0.05 0.00 -3.00 0.00 0.00 29.16 26.09 1fr0 h TRP 761 CO 0.00 -0.27 -0.41 -0.09 -1.28 0.00 0.00 178.44 176.39 1fr0 h ARG 762 N 0.16 -0.54 -0.88 0.12 2.43 -1.79 -0.38 114.38 113.50 1fr0 h ARG 762 Ca 0.61 0.04 0.20 0.00 -0.81 0.00 0.00 59.98 60.01 1fr0 h ARG 762 Cb 1.30 0.12 -0.12 0.00 -0.42 0.00 0.00 29.97 30.86 1fr0 h ARG 762 CO -0.71 -0.36 0.39 1.25 -1.51 0.00 0.00 179.97 179.03 1fr0 h HIS 763 N -0.56 0.65 -0.79 2.20 2.76 -1.28 0.30 115.15 118.42 1fr0 h HIS 763 Ca 0.05 0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.33 1fr0 h HIS 763 Cb 0.64 -0.15 -0.06 0.00 1.55 0.00 0.00 27.41 29.39 1fr0 h HIS 763 CO -0.41 0.00 0.46 -0.44 -1.30 0.00 0.00 177.93 176.24 1fr0 h ASP 764 N 0.44 0.69 0.17 3.26 5.19 -0.70 -1.36 116.42 124.11 1fr0 h ASP 764 Ca 0.53 0.03 -0.01 0.00 -0.62 0.00 0.00 57.03 56.96 1fr0 h ASP 764 Cb 0.95 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.36 1fr0 h ASP 764 CO -0.49 0.42 -0.08 0.58 -3.12 0.00 0.00 179.24 176.55 1fr0 h VAL 765 N 0.82 0.95 -1.01 -1.35 2.07 0.28 -1.29 116.25 116.71 1fr0 h VAL 765 Ca 0.36 -0.77 0.30 0.00 0.82 0.00 0.00 66.70 67.41 1fr0 h VAL 765 Cb 0.25 1.40 -0.14 0.00 -1.52 0.00 0.00 31.29 31.29 1fr0 h VAL 765 CO -0.21 0.17 0.59 -0.33 0.02 0.00 0.00 177.57 177.82 1fr0 h GLU 766 N -0.62 0.38 -0.02 1.57 5.08 -0.77 1.83 114.58 122.02 1fr0 h GLU 766 Ca -0.02 -0.02 -0.13 0.00 -1.00 0.00 0.00 59.36 58.18 1fr0 h GLU 766 Cb 0.46 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1fr0 h GLU 766 CO 0.04 0.25 -0.59 0.28 -1.00 0.00 0.00 179.01 177.98 1fr0 h VAL 767 N 0.39 1.41 0.44 3.13 2.07 -1.04 -2.28 116.25 120.38 1fr0 h VAL 767 Ca 0.71 -2.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.20 1fr0 h VAL 767 Cb 1.57 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 33.41 1fr0 h VAL 767 CO -0.56 0.58 -0.21 0.25 0.02 0.00 0.00 177.57 177.65 1fr0 h LEU 768 N 0.06 -0.50 -0.39 2.57 5.85 0.39 -0.07 115.31 123.21 1fr0 h LEU 768 Ca -0.01 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.73 1fr0 h LEU 768 Cb 1.07 0.13 -0.07 0.00 0.37 0.00 0.00 40.66 42.16 1fr0 h LEU 768 CO 0.08 -0.08 -0.06 0.50 -0.34 0.00 0.00 178.44 178.55 1fr0 h LYS 769 N -1.08 0.04 -0.47 1.25 3.64 -0.82 -0.93 116.57 118.20 1fr0 h LYS 769 Ca -0.06 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 1fr0 h LYS 769 Cb 0.53 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.31 1fr0 h LYS 769 CO 0.10 0.03 0.27 0.00 -2.27 0.00 0.00 179.45 177.58 1fr0 h ALA 770 N 1.37 0.60 -0.22 5.00 0.00 -1.46 -0.21 119.26 124.34 1fr0 h ALA 770 Ca 0.19 -0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.16 1fr0 h ALA 770 Cb 0.29 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1fr0 h ALA 770 CO -0.37 -0.05 -0.15 2.35 0.00 0.00 0.00 179.25 181.03 1fr0 h TRP 771 N 0.54 -0.36 0.00 0.00 7.01 0.26 0.18 115.95 123.58 1fr0 h TRP 771 Ca 0.19 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.19 1fr0 h TRP 771 Cb 0.04 0.20 -0.00 0.00 -2.10 0.00 0.00 29.16 27.29 1fr0 h TRP 771 CO -0.08 -0.22 -0.15 0.28 -2.79 0.00 0.00 178.44 175.49 1fr0 h VAL 772 N -0.14 0.86 0.00 2.65 2.07 -0.80 1.61 116.25 122.50 1fr0 h VAL 772 Ca 0.13 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 67.02 1fr0 h VAL 772 Cb 0.33 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1fr0 h VAL 772 CO -0.31 0.15 -0.26 0.00 0.02 0.00 0.00 177.57 177.17 1fr0 h ALA 773 N 1.85 0.87 0.00 1.67 0.00 0.97 -3.23 119.26 121.39 1fr0 h ALA 773 Ca -0.00 -0.24 -0.19 0.00 0.00 0.00 0.00 54.91 54.48 1fr0 h ALA 773 Cb 0.32 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1fr0 h ALA 773 CO 0.02 0.33 -1.87 1.63 0.00 0.00 0.00 179.25 179.36 1fr0 n LYS 774 N -3.23 1.48 0.00 0.00 5.02 0.39 -4.34 118.16 117.48 1fr0 n LYS 774 Ca 0.02 -0.04 0.11 0.00 -2.02 0.00 0.00 58.31 56.39 1fr0 n LYS 774 Cb 0.57 -1.35 0.67 0.00 -0.02 0.00 0.00 35.03 34.90 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fr0 n ALA 775 N -2.39 2.33 -0.05 7.82 0.00 0.54 -4.07 120.51 124.69 1fr0 n ALA 775 Ca -0.18 -0.14 -0.03 0.00 0.00 0.00 0.00 53.44 53.09 1fr0 n ALA 775 Cb 0.81 -1.37 -0.02 0.00 0.00 0.00 0.00 19.45 18.88 1fr0 n ALA 775 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1fr0 h THR 776 N 0.00 0.00 -3.73 0.00 2.02 -1.75 -3.24 112.91 106.21 1fr0 h THR 776 Ca 0.00 0.00 -0.77 0.00 0.77 0.00 0.00 66.41 66.41 1fr0 h THR 776 Cb 0.00 0.00 -0.28 0.00 -1.74 0.00 0.00 68.15 66.13 1fr0 h THR 776 CO 0.00 0.00 -0.03 -0.75 0.37 0.00 0.00 175.52 175.11 1fr0 s LYS 777 N -3.59 3.32 0.00 6.66 2.36 -1.26 -5.16 119.74 122.07 1fr0 s LYS 777 Ca -0.03 -2.46 0.00 0.00 -2.55 0.00 0.00 55.97 50.93 1fr0 s LYS 777 Cb 0.02 -4.25 0.00 0.00 -1.05 0.00 0.00 37.83 32.55 1fr0 s LYS 777 CO 0.14 -1.26 0.00 1.17 1.55 0.00 0.00 175.35 176.95