#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 -1.20 12.58 -2.24 -1.26 -1.16 114.28 121.00 1fr0 n THR 655 Ca 0.00 1.37 -0.25 0.00 -2.27 0.00 0.00 64.05 62.91 1fr0 n THR 655 Cb 0.00 -1.94 -0.10 0.00 -2.10 0.00 0.00 70.33 66.19 1fr0 n THR 655 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1fr0 n GLU 656 N -2.37 2.83 -0.65 -0.78 0.00 -1.26 -4.95 120.64 113.45 1fr0 n GLU 656 Ca 0.00 -1.68 -0.31 0.00 0.00 0.00 0.00 57.16 55.17 1fr0 n GLU 656 Cb 0.00 -2.35 0.18 0.00 0.00 0.00 0.00 31.44 29.27 1fr0 n GLU 656 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1fr0 n GLU 657 N 2.78 -1.47 -0.63 5.31 2.13 -0.31 -5.01 120.64 123.44 1fr0 n GLU 657 Ca 0.58 -0.40 -0.02 0.00 0.66 0.00 0.00 57.16 57.99 1fr0 n GLU 657 Cb 0.59 -1.88 0.01 0.00 0.27 0.00 0.00 31.44 30.43 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1fr0 n ASN 658 N -2.52 0.07 -1.68 4.31 3.02 -1.26 -4.98 115.26 112.23 1fr0 n ASN 658 Ca 0.03 -1.07 0.06 0.00 -0.03 0.00 0.00 54.58 53.57 1fr0 n ASN 658 Cb 0.58 -0.05 0.34 0.00 -0.61 0.00 0.00 39.78 40.05 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fr0 n SER 659 N -3.01 4.99 -4.57 6.41 3.41 -1.26 -4.96 113.62 114.63 1fr0 n SER 659 Ca 0.01 -2.78 -0.53 0.00 -0.26 0.00 0.00 58.87 55.31 1fr0 n SER 659 Cb 0.04 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.27 1fr0 n SER 659 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 1fr0 n LYS 660 N 0.53 0.96 -1.56 4.33 2.85 -1.26 0.11 118.16 124.12 1fr0 n LYS 660 Ca 0.23 0.34 -0.19 0.00 -1.05 0.00 0.00 58.31 57.65 1fr0 n LYS 660 Cb 1.05 -1.95 -0.08 0.00 -0.65 0.00 0.00 35.03 33.40 1fr0 n LYS 660 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1fr0 n SER 661 N 2.31 -5.33 0.00 -5.58 2.88 -1.26 -4.71 113.62 101.93 1fr0 n SER 661 Ca 0.18 0.47 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 1fr0 n SER 661 Cb 0.18 -4.52 0.00 0.00 -0.75 0.00 0.00 64.21 59.12 1fr0 n SER 661 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1fr0 n GLU 662 N -2.41 0.25 0.00 -1.46 2.13 0.30 -4.70 120.64 114.74 1fr0 n GLU 662 Ca -0.19 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.76 1fr0 n GLU 662 Cb 0.63 -0.68 0.66 0.00 0.27 0.00 0.00 31.44 32.32 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1fr0 n ALA 663 N -1.72 2.33 0.02 4.31 0.00 -0.13 -3.04 120.51 122.29 1fr0 n ALA 663 Ca 0.00 -0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.43 1fr0 n ALA 663 Cb 0.18 -1.44 -0.12 0.00 0.00 0.00 0.00 19.45 18.06 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 -1.34 0.23 -4.11 0.00 4.77 -1.26 -4.50 117.00 110.79 1fr0 n LEU 664 Ca 0.11 0.09 -0.14 0.00 -0.03 0.00 0.00 56.01 56.05 1fr0 n LEU 664 Cb 0.24 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.26 1fr0 n LEU 664 CO 0.22 -0.05 0.06 -1.48 -1.33 0.00 0.00 177.39 174.81 1fr0 s LEU 665 N -4.76 0.96 -0.27 2.23 0.05 -1.17 -2.69 118.68 113.03 1fr0 s LEU 665 Ca -0.06 -1.38 -0.15 0.00 0.05 0.00 0.00 54.13 52.59 1fr0 s LEU 665 Cb 0.13 1.26 -0.04 0.00 -2.05 0.00 0.00 46.19 45.49 1fr0 s LEU 665 CO 0.88 -1.17 0.37 -0.62 -0.55 0.00 0.00 176.35 175.26 1fr0 s ASP 666 N -3.19 6.24 -0.04 1.48 -1.08 -0.81 -4.71 116.67 114.56 1fr0 s ASP 666 Ca 0.31 0.25 -0.26 0.00 -0.52 0.00 0.00 52.55 52.33 1fr0 s ASP 666 Cb 0.01 -2.21 -0.21 0.00 -1.46 0.00 0.00 42.92 39.05 1fr0 s ASP 666 CO 0.17 -0.19 1.16 0.40 0.52 0.00 0.00 175.17 177.23 1fr0 h ILE 667 N 5.40 1.48 -0.00 4.11 5.03 -1.92 -2.51 117.51 129.09 1fr0 h ILE 667 Ca -0.32 -1.46 -0.00 0.00 -0.12 0.00 0.00 64.86 62.96 1fr0 h ILE 667 Cb 1.16 2.43 -0.00 0.00 -3.03 0.00 0.00 36.82 37.39 1fr0 h ILE 667 CO 0.64 0.39 -0.01 1.55 -0.68 0.00 0.00 178.15 180.04 1fr0 h PRO 668 N -0.55 0.01 0.38 2.37 0.13 -1.99 -2.63 132.00 129.73 1fr0 h PRO 668 Ca -0.00 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1fr0 h PRO 668 Cb 0.65 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.75 1fr0 h PRO 668 CO 0.01 0.56 -0.43 1.98 -0.23 0.00 0.00 178.00 179.89 1fr0 h MET 669 N -0.53 -0.81 -0.86 0.86 4.05 -1.98 0.16 114.93 115.81 1fr0 h MET 669 Ca 0.00 0.06 0.21 0.00 -0.28 0.00 0.00 59.70 59.69 1fr0 h MET 669 Cb 0.56 0.18 -0.13 0.00 -0.80 0.00 0.00 31.60 31.41 1fr0 h MET 669 CO 0.00 -0.54 0.29 -0.07 0.23 0.00 0.00 176.91 176.82 1fr0 h LEU 670 N -0.84 0.13 0.01 3.39 3.38 -1.54 0.55 115.31 120.39 1fr0 h LEU 670 Ca -0.03 0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1fr0 h LEU 670 Cb 0.76 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1fr0 h LEU 670 CO -0.09 -0.07 -0.01 -0.08 0.09 0.00 0.00 178.44 178.28 1fr0 h GLU 671 N 0.30 -0.02 -0.41 1.13 4.81 -0.90 -2.76 114.58 116.73 1fr0 h GLU 671 Ca 0.53 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.81 1fr0 h GLU 671 Cb 1.01 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 30.31 1fr0 h GLU 671 CO -0.58 0.11 -0.54 1.96 -0.73 0.00 0.00 179.01 179.23 1fr0 h GLN 672 N -0.14 -0.38 -0.71 1.92 1.08 0.16 0.82 115.11 117.86 1fr0 h GLN 672 Ca -0.00 0.03 0.16 0.00 -1.45 0.00 0.00 58.65 57.38 1fr0 h GLN 672 Cb 0.13 0.09 -0.12 0.00 -0.05 0.00 0.00 27.48 27.53 1fr0 h GLN 672 CO 0.00 -0.25 0.05 1.88 -0.95 0.00 0.00 178.83 179.56 1fr0 h TYR 673 N -0.39 0.04 -0.95 2.96 0.05 -1.37 0.34 116.97 117.65 1fr0 h TYR 673 Ca 0.08 0.05 0.22 0.00 0.05 0.00 0.00 58.73 59.13 1fr0 h TYR 673 Cb 0.60 0.09 -0.12 0.00 1.01 0.00 0.00 36.73 38.31 1fr0 h TYR 673 CO -0.71 -0.18 0.52 -0.07 -1.05 0.00 0.00 178.16 176.66 1fr0 h LEU 674 N 0.15 0.56 -0.11 3.88 -0.00 -0.55 0.70 115.31 119.94 1fr0 h LEU 674 Ca 0.39 0.13 -0.16 0.00 -0.00 0.00 0.00 57.88 58.24 1fr0 h LEU 674 Cb 0.67 0.05 0.01 0.00 -0.00 0.00 0.00 40.66 41.39 1fr0 h LEU 674 CO -0.59 0.10 -0.57 -0.08 -0.00 0.00 0.00 178.44 177.30 1fr0 h GLU 675 N 0.55 0.58 0.00 1.13 4.81 0.16 -2.18 114.58 119.61 1fr0 h GLU 675 Ca 0.59 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1fr0 h GLU 675 Cb 1.08 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1fr0 h GLU 675 CO -0.47 1.10 0.00 1.28 -0.73 0.00 0.00 179.01 180.19 1fr0 n LEU 676 N -4.17 0.06 -0.10 1.64 4.77 -0.03 -4.61 117.00 114.57 1fr0 n LEU 676 Ca -0.08 0.85 -0.16 0.00 -0.03 0.00 0.00 56.01 56.59 1fr0 n LEU 676 Cb 0.64 -0.41 -0.09 0.00 -2.33 0.00 0.00 43.42 41.23 1fr0 n LEU 676 CO 0.48 -0.41 -1.16 0.52 -1.33 0.00 0.00 177.39 175.49 1fr0 n VAL 677 N -1.73 1.12 0.00 4.08 0.31 0.03 -5.09 118.33 117.06 1fr0 n VAL 677 Ca 0.00 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1fr0 n VAL 677 Cb 0.00 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.57 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 2.31 0.51 0.00 2.92 0.00 -0.40 -4.62 105.19 105.92 1fr0 n GLY 678 Ca -0.36 -2.20 0.09 0.00 0.00 0.00 0.00 46.02 43.55 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 0.43 0.05 1.61 -0.04 -1.26 -3.67 135.00 132.12 1fr0 n PRO 679 Ca 0.00 0.06 -0.02 0.00 -0.04 0.00 0.00 63.50 63.49 1fr0 n PRO 679 Cb 0.00 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 31.95 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 -0.16 -0.73 0.54 1.57 -1.96 -1.20 116.57 114.64 1fr0 h LYS 680 Ca 0.00 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 1fr0 h LYS 680 Cb 0.09 0.04 -0.13 0.00 0.08 0.00 0.00 32.23 32.30 1fr0 h LYS 680 CO 0.00 -0.10 -0.31 1.25 -0.57 0.00 0.00 179.45 179.72 1fr0 h LEU 681 N -0.49 -1.11 -0.14 2.94 5.85 -1.88 1.94 115.31 122.43 1fr0 h LEU 681 Ca -0.02 0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1fr0 h LEU 681 Cb 0.12 0.59 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1fr0 h LEU 681 CO 0.03 -0.29 0.04 0.40 -0.34 0.00 0.00 178.44 178.28 1fr0 h ILE 682 N -0.08 0.97 -0.15 4.05 5.03 -1.69 0.22 117.51 125.85 1fr0 h ILE 682 Ca 0.30 -0.04 -0.07 0.00 -0.12 0.00 0.00 64.86 64.93 1fr0 h ILE 682 Cb 0.57 0.84 -0.01 0.00 -3.03 0.00 0.00 36.82 35.19 1fr0 h ILE 682 CO -0.78 0.02 -0.22 0.74 -0.68 0.00 0.00 178.15 177.22 1fr0 h THR 683 N 0.11 1.23 0.29 -0.27 2.02 0.52 0.41 112.91 117.22 1fr0 h THR 683 Ca 0.06 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.18 1fr0 h THR 683 Cb 0.03 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 1fr0 h THR 683 CO -0.06 0.32 -0.14 -0.78 0.37 0.00 0.00 175.52 175.23 1fr0 h ASP 684 N 0.23 -0.33 -0.21 4.18 1.82 0.37 0.93 116.42 123.41 1fr0 h ASP 684 Ca 0.04 0.01 0.06 0.00 -0.39 0.00 0.00 57.03 56.75 1fr0 h ASP 684 Cb 0.53 0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.61 1fr0 h ASP 684 CO 0.04 -0.03 0.18 1.23 -1.61 0.00 0.00 179.24 179.04 1fr0 h GLY 685 N -0.80 0.00 1.40 -0.78 0.00 -0.64 -1.00 103.07 101.25 1fr0 h GLY 685 Ca -0.04 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.01 1fr0 h GLY 685 CO 0.07 0.00 -1.19 -2.00 0.00 0.00 0.00 176.54 173.41 1fr0 h LEU 686 N 0.00 0.70 0.20 3.11 5.85 -0.91 -1.77 115.31 122.49 1fr0 h LEU 686 Ca 0.10 -0.65 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 1fr0 h LEU 686 Cb 0.46 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.27 1fr0 h LEU 686 CO -0.00 1.48 -0.12 0.00 -0.34 0.00 0.00 178.44 179.45 1fr0 h ALA 687 N 0.45 -0.30 -0.02 1.25 0.00 0.57 0.18 119.26 121.39 1fr0 h ALA 687 Ca -0.16 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.54 1fr0 h ALA 687 Cb 1.87 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.79 1fr0 h ALA 687 CO 0.22 -0.67 -0.69 -0.39 0.00 0.00 0.00 179.25 177.71 1fr0 h VAL 688 N -0.31 1.46 -0.17 0.00 -1.51 -1.60 -2.71 116.25 111.42 1fr0 h VAL 688 Ca -0.02 -2.29 -0.11 0.00 -1.23 0.00 0.00 66.70 63.06 1fr0 h VAL 688 Cb 0.26 2.22 0.00 0.00 -2.13 0.00 0.00 31.29 31.64 1fr0 h VAL 688 CO 0.02 0.66 -0.31 0.15 -1.23 0.00 0.00 177.57 176.86 1fr0 h PHE 689 N 0.06 0.64 -0.42 5.19 3.57 -1.07 -1.78 116.94 123.13 1fr0 h PHE 689 Ca -0.01 -0.23 -0.11 0.00 3.53 0.00 0.00 57.97 61.15 1fr0 h PHE 689 Cb 1.23 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.83 1fr0 h PHE 689 CO 0.01 0.95 -0.17 1.05 -2.23 0.00 0.00 178.31 177.92 1fr0 h GLU 690 N 0.15 0.80 -0.39 1.11 4.11 -0.68 0.32 114.58 120.00 1fr0 h GLU 690 Ca 0.01 -0.30 -0.10 0.00 0.07 0.00 0.00 59.36 59.04 1fr0 h GLU 690 Cb 0.91 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.09 1fr0 h GLU 690 CO 0.07 0.91 -0.15 -0.22 0.07 0.00 0.00 179.01 179.69 1fr0 h LYS 691 N 0.71 0.79 -0.12 1.06 3.64 -1.48 -2.83 116.57 118.34 1fr0 h LYS 691 Ca 0.11 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.16 1fr0 h LYS 691 Cb 0.67 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.46 1fr0 h LYS 691 CO 0.05 0.95 0.00 -1.33 -2.27 0.00 0.00 179.45 176.85 1fr0 n MET 692 N -4.29 1.74 -0.12 1.90 2.81 -0.67 -4.18 117.12 114.31 1fr0 n MET 692 Ca -0.02 -1.10 -0.09 0.00 -1.81 0.00 0.00 57.70 54.68 1fr0 n MET 692 Cb 0.40 -1.43 -0.01 0.00 -0.71 0.00 0.00 33.22 31.47 1fr0 n MET 692 CO 0.00 0.00 0.00 1.98 1.51 0.00 0.00 175.97 179.46 1fr0 h MET 693 N 2.38 0.52 0.00 0.03 4.05 -0.08 0.45 114.93 122.28 1fr0 h MET 693 Ca 0.00 -0.07 -0.09 0.00 -0.28 0.00 0.00 59.70 59.26 1fr0 h MET 693 Cb 0.52 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 31.21 1fr0 h MET 693 CO 0.00 0.44 -0.43 -1.00 0.23 0.00 0.00 176.91 176.15 1fr0 h PRO 694 N 0.46 0.00 -0.03 0.39 0.13 -1.73 -2.71 132.00 128.50 1fr0 h PRO 694 Ca 0.13 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.07 1fr0 h PRO 694 Cb 0.09 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.23 1fr0 h PRO 694 CO -0.02 0.43 -0.70 0.78 -0.23 0.00 0.00 178.00 178.26 1fr0 h GLY 695 N 2.08 0.59 0.99 1.56 0.00 -1.67 -2.37 103.07 104.25 1fr0 h GLY 695 Ca -0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 47.33 46.31 1fr0 h GLY 695 CO 0.06 0.86 -0.46 -0.97 0.00 0.00 0.00 176.54 176.03 1fr0 h TYR 696 N 0.10 -1.18 -0.95 5.60 0.05 -0.86 -2.41 116.97 117.32 1fr0 h TYR 696 Ca -0.08 -0.03 0.17 0.00 0.05 0.00 0.00 58.73 58.85 1fr0 h TYR 696 Cb 1.38 0.39 -0.08 0.00 1.01 0.00 0.00 36.73 39.43 1fr0 h TYR 696 CO 0.13 -0.73 0.60 -0.39 -1.05 0.00 0.00 178.16 176.71 1fr0 h VAL 697 N -1.30 0.76 0.33 -2.88 -1.51 -1.60 -0.21 116.25 109.84 1fr0 h VAL 697 Ca -0.13 -0.23 -0.01 0.00 -1.23 0.00 0.00 66.70 65.10 1fr0 h VAL 697 Cb 0.98 0.02 -0.03 0.00 -2.13 0.00 0.00 31.29 30.13 1fr0 h VAL 697 CO 0.21 0.12 -0.44 -1.28 -1.23 0.00 0.00 177.57 174.96 1fr0 h SER 698 N 0.68 -1.24 0.03 4.19 0.87 -1.02 -0.65 113.55 116.42 1fr0 h SER 698 Ca 0.51 0.11 -0.01 0.00 -1.23 0.00 0.00 61.79 61.17 1fr0 h SER 698 Cb 0.87 0.42 -0.00 0.00 -0.44 0.00 0.00 62.40 63.26 1fr0 h SER 698 CO -0.27 -0.54 -0.03 0.58 -0.53 0.00 0.00 176.83 176.05 1fr0 h VAL 699 N -0.80 0.90 -0.53 2.23 2.07 -0.93 -1.92 116.25 117.28 1fr0 h VAL 699 Ca -0.04 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.39 1fr0 h VAL 699 Cb 0.72 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 31.51 1fr0 h VAL 699 CO -0.11 0.03 0.34 0.25 0.02 0.00 0.00 177.57 178.09 1fr0 h LEU 700 N 0.00 0.62 -0.47 2.57 5.85 0.32 -1.48 115.31 122.71 1fr0 h LEU 700 Ca -0.00 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 1fr0 h LEU 700 Cb 0.05 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1fr0 h LEU 700 CO 0.00 0.47 -0.00 -0.33 -0.34 0.00 0.00 178.44 178.24 1fr0 h GLU 701 N 0.71 0.83 -0.88 1.25 5.08 -0.38 -2.02 114.58 119.17 1fr0 h GLU 701 Ca 0.19 -0.27 0.09 0.00 -1.00 0.00 0.00 59.36 58.38 1fr0 h GLU 701 Cb -0.05 -0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.05 1fr0 h GLU 701 CO -0.04 0.88 0.53 1.03 -1.00 0.00 0.00 179.01 180.41 1fr0 h SER 702 N 0.68 0.78 0.51 1.42 0.87 -1.13 0.65 113.55 117.33 1fr0 h SER 702 Ca 0.13 0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.64 1fr0 h SER 702 Cb 0.51 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1fr0 h SER 702 CO 0.02 0.46 -0.43 -1.13 -0.53 0.00 0.00 176.83 175.23 1fr0 h ASN 703 N 0.90 0.00 0.48 6.23 -1.24 -1.01 -2.77 115.58 118.17 1fr0 h ASN 703 Ca 0.41 0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.40 1fr0 h ASN 703 Cb 0.33 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.38 1fr0 h ASN 703 CO -0.23 0.43 -0.23 0.25 -1.29 0.00 0.00 177.43 176.36 1fr0 h LEU 704 N 0.00 -0.55 -1.31 0.34 7.12 -0.13 -0.69 115.31 120.09 1fr0 h LEU 704 Ca -0.00 0.01 0.00 0.00 0.13 0.00 0.00 57.88 58.02 1fr0 h LEU 704 Cb 0.80 0.14 0.00 0.00 -0.53 0.00 0.00 40.66 41.07 1fr0 h LEU 704 CO 0.06 -0.38 0.00 0.00 -0.13 0.00 0.00 178.44 177.99 1fr0 h THR 705 N -0.66 0.00 -0.23 1.05 1.03 -1.45 -1.68 112.91 110.96 1fr0 h THR 705 Ca -0.07 -0.25 0.00 0.00 -0.01 0.00 0.00 66.41 66.09 1fr0 h THR 705 Cb 0.50 1.05 0.00 0.00 -1.07 0.00 0.00 68.15 68.63 1fr0 h THR 705 CO 0.11 0.00 0.00 0.00 -0.01 0.00 0.00 175.52 175.62 1fr0 n ALA 706 N -1.90 2.49 -3.18 0.00 0.00 -0.75 -4.91 120.51 112.26 1fr0 n ALA 706 Ca 0.00 -0.58 -0.23 0.00 0.00 0.00 0.00 53.44 52.64 1fr0 n ALA 706 Cb 0.20 -1.05 0.05 0.00 0.00 0.00 0.00 19.45 18.65 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 0.44 -5.79 -3.05 0.00 1.13 -0.63 -4.90 117.38 104.57 1fr0 n GLN 707 Ca 0.15 0.88 -0.44 0.00 -1.94 0.00 0.00 57.00 55.65 1fr0 n GLN 707 Cb 0.34 -5.78 -0.00 0.00 0.11 0.00 0.00 30.24 24.90 1fr0 n GLN 707 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1fr0 s ASP 708 N -2.89 7.07 0.14 1.08 1.11 -0.34 -4.80 116.67 118.03 1fr0 s ASP 708 Ca 0.39 -3.01 -0.06 0.00 0.18 0.00 0.00 52.55 50.04 1fr0 s ASP 708 Cb -0.17 -2.35 -0.06 0.00 1.07 0.00 0.00 42.92 41.41 1fr0 s ASP 708 CO 0.48 -0.67 1.35 0.07 1.18 0.00 0.00 175.17 177.57 1fr0 h LYS 709 N 7.27 0.54 0.12 8.23 2.10 -1.91 -2.09 116.57 130.83 1fr0 h LYS 709 Ca 0.26 -0.48 -0.01 0.00 -2.00 0.00 0.00 60.65 58.42 1fr0 h LYS 709 Cb 0.90 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 1fr0 h LYS 709 CO 1.15 1.11 -0.06 -0.22 -2.00 0.00 0.00 179.45 179.44 1fr0 h LYS 710 N 0.35 -0.16 0.63 0.07 3.64 -2.00 -1.46 116.57 117.64 1fr0 h LYS 710 Ca -0.06 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1fr0 h LYS 710 Cb 1.43 0.04 0.01 0.00 -0.41 0.00 0.00 32.23 33.30 1fr0 h LYS 710 CO 0.15 0.04 -0.30 0.78 -2.27 0.00 0.00 179.45 177.85 1fr0 h GLY 711 N -0.33 -0.88 -0.43 5.01 0.00 -1.97 -2.79 103.07 101.69 1fr0 h GLY 711 Ca -0.02 0.33 0.30 0.00 0.00 0.00 0.00 47.33 47.95 1fr0 h GLY 711 CO 0.03 -0.32 0.61 -2.22 0.00 0.00 0.00 176.54 174.64 1fr0 h ILE 712 N -1.11 0.37 0.69 2.60 2.04 -1.43 0.21 117.51 120.89 1fr0 h ILE 712 Ca -0.09 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 65.61 1fr0 h ILE 712 Cb 0.69 -0.04 0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1fr0 h ILE 712 CO 0.14 0.07 -0.33 0.58 0.00 0.00 0.00 178.15 178.61 1fr0 h VAL 713 N 0.38 0.28 0.54 1.67 2.07 -1.10 -0.16 116.25 119.93 1fr0 h VAL 713 Ca 0.70 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 68.10 1fr0 h VAL 713 Cb 1.61 0.31 0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1fr0 h VAL 713 CO -0.52 0.01 -0.26 -0.33 0.02 0.00 0.00 177.57 176.49 1fr0 h GLU 714 N -1.00 -0.70 -0.32 1.57 4.39 -0.93 -2.55 114.58 115.04 1fr0 h GLU 714 Ca -0.10 0.05 0.09 0.00 0.34 0.00 0.00 59.36 59.75 1fr0 h GLU 714 Cb 0.73 0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1fr0 h GLU 714 CO 0.16 -0.40 0.62 0.93 -1.16 0.00 0.00 179.01 179.16 1fr0 h GLU 715 N -1.09 0.00 0.00 2.33 5.08 -0.73 -0.55 114.58 119.61 1fr0 h GLU 715 Ca -0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1fr0 h GLU 715 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1fr0 h GLU 715 CO 0.12 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.54 1fr0 n GLY 716 N -1.44 -1.30 0.36 -3.84 0.00 -0.07 -1.59 105.19 97.31 1fr0 n GLY 716 Ca 0.06 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.23 1fr0 n GLY 716 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1fr0 h HIS 717 N 0.00 0.97 -0.78 1.61 2.07 -1.46 0.25 115.15 117.82 1fr0 h HIS 717 Ca 0.00 0.03 0.12 0.00 -2.85 0.00 0.00 60.37 57.67 1fr0 h HIS 717 Cb 0.00 -0.29 -0.08 0.00 2.57 0.00 0.00 27.41 29.61 1fr0 h HIS 717 CO 0.00 0.19 0.38 -0.22 -3.07 0.00 0.00 177.93 175.22 1fr0 h LYS 718 N 0.67 0.59 0.00 5.12 3.64 -1.19 1.36 116.57 126.76 1fr0 h LYS 718 Ca 0.58 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.92 1fr0 h LYS 718 Cb 1.02 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 1fr0 h LYS 718 CO -0.36 0.39 0.00 -0.89 -2.27 0.00 0.00 179.45 176.32 1fr0 n ILE 719 N -4.87 0.00 -0.14 2.00 5.41 0.79 -2.37 119.36 120.18 1fr0 n ILE 719 Ca 0.14 0.16 0.16 0.00 1.00 0.00 0.00 62.75 64.20 1fr0 n ILE 719 Cb 0.35 -0.44 0.53 0.00 -0.71 0.00 0.00 39.64 39.36 1fr0 n ILE 719 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.55 176.62 1fr0 h LYS 720 N 0.00 0.35 0.16 0.38 -0.00 -1.37 -1.01 116.57 115.09 1fr0 h LYS 720 Ca 0.00 -0.02 -0.01 0.00 -0.00 0.00 0.00 60.65 60.62 1fr0 h LYS 720 Cb 0.00 -0.08 0.00 0.00 -0.00 0.00 0.00 32.23 32.15 1fr0 h LYS 720 CO 0.00 0.23 -0.08 0.78 -0.00 0.00 0.00 179.45 180.39 1fr0 h GLY 721 N 0.36 -0.23 -0.10 0.07 0.00 0.17 -1.59 103.07 101.76 1fr0 h GLY 721 Ca 0.35 0.08 0.25 0.00 0.00 0.00 0.00 47.33 48.01 1fr0 h GLY 721 CO -0.10 -0.08 0.63 0.00 0.00 0.00 0.00 176.54 176.99 1fr0 h ALA 722 N 0.48 1.97 -0.39 3.60 0.00 -0.81 0.38 119.26 124.49 1fr0 h ALA 722 Ca -0.02 0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1fr0 h ALA 722 Cb 0.27 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1fr0 h ALA 722 CO 0.04 -0.40 -0.21 0.00 0.00 0.00 0.00 179.25 178.68 1fr0 h ALA 723 N 1.67 0.91 -0.93 0.00 0.00 -1.00 -2.78 119.26 117.13 1fr0 h ALA 723 Ca 0.61 -0.36 0.27 0.00 0.00 0.00 0.00 54.91 55.43 1fr0 h ALA 723 Cb 1.30 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 1fr0 h ALA 723 CO -0.38 0.62 0.81 0.78 0.00 0.00 0.00 179.25 181.08 1fr0 h GLY 724 N 0.97 0.00 2.00 0.00 0.00 0.70 0.89 103.07 107.64 1fr0 h GLY 724 Ca 0.09 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.29 1fr0 h GLY 724 CO 0.05 0.00 -0.65 1.48 0.00 0.00 0.00 176.54 177.42 1fr0 h SER 725 N 0.00 0.00 -0.02 0.19 4.64 -1.50 -2.62 113.55 114.24 1fr0 h SER 725 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1fr0 h SER 725 Cb 2.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.15 1fr0 h SER 725 CO -0.00 0.65 0.00 0.52 -0.87 0.00 0.00 176.83 177.13 1fr0 n VAL 726 N -3.74 0.03 -0.03 0.95 0.31 0.31 -4.78 118.33 111.37 1fr0 n VAL 726 Ca -0.01 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1fr0 n VAL 726 Cb 0.65 -0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.48 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 0.67 0.89 3.37 2.92 0.00 -0.99 -4.93 105.19 107.12 1fr0 n GLY 727 Ca 0.07 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 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 5.46 0.13 0.99 4.77 -0.51 -1.93 117.00 125.90 1fr0 n LEU 728 Ca 0.00 -4.52 -0.02 0.00 -0.03 0.00 0.00 56.01 51.44 1fr0 n LEU 728 Cb 0.00 -1.59 0.15 0.00 -2.33 0.00 0.00 43.42 39.65 1fr0 n LEU 728 CO 0.00 0.86 0.47 0.08 -1.33 0.00 0.00 177.39 177.47 1fr0 h ARG 729 N 6.88 0.03 -0.69 3.23 0.11 -1.69 -2.78 114.38 119.47 1fr0 h ARG 729 Ca 0.32 -0.02 0.04 0.00 0.10 0.00 0.00 59.98 60.42 1fr0 h ARG 729 Cb 0.83 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.87 1fr0 h ARG 729 CO 1.29 0.66 0.41 1.25 0.10 0.00 0.00 179.97 183.68 1fr0 h HIS 730 N 0.02 0.76 -0.02 4.08 2.76 -1.74 -1.61 115.15 119.40 1fr0 h HIS 730 Ca -0.01 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.16 1fr0 h HIS 730 Cb 1.14 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.86 1fr0 h HIS 730 CO 0.00 0.40 -0.10 -0.07 -1.30 0.00 0.00 177.93 176.86 1fr0 h LEU 731 N 0.78 0.12 -0.92 0.26 -0.00 -1.79 -2.73 115.31 111.03 1fr0 h LEU 731 Ca 0.29 -0.68 0.22 0.00 -0.00 0.00 0.00 57.88 57.71 1fr0 h LEU 731 Cb 0.10 -0.04 -0.12 0.00 -0.00 0.00 0.00 40.66 40.61 1fr0 h LEU 731 CO -0.14 0.78 0.45 -0.61 -0.00 0.00 0.00 178.44 178.92 1fr0 h GLN 732 N -0.53 0.46 0.30 1.13 4.15 -1.30 -1.48 115.11 117.84 1fr0 h GLN 732 Ca -0.01 -0.03 -0.01 0.00 0.77 0.00 0.00 58.65 59.37 1fr0 h GLN 732 Cb 0.78 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.37 1fr0 h GLN 732 CO 0.02 0.31 -0.15 1.96 -1.93 0.00 0.00 178.83 179.04 1fr0 h GLN 733 N 0.48 -0.39 -0.91 1.69 1.08 -1.32 -2.36 115.11 113.39 1fr0 h GLN 733 Ca 0.57 0.03 0.24 0.00 -1.45 0.00 0.00 58.65 58.03 1fr0 h GLN 733 Cb 1.04 0.09 -0.16 0.00 -0.05 0.00 0.00 27.48 28.40 1fr0 h GLN 733 CO -0.49 -0.06 0.06 -0.07 -0.95 0.00 0.00 178.83 177.32 1fr0 h LEU 734 N -0.78 -0.35 0.03 1.46 4.07 -0.97 0.27 115.31 119.03 1fr0 h LEU 734 Ca -0.04 0.24 -0.00 0.00 0.08 0.00 0.00 57.88 58.16 1fr0 h LEU 734 Cb 0.51 0.41 0.00 0.00 1.08 0.00 0.00 40.66 42.66 1fr0 h LEU 734 CO 0.07 -0.27 -0.01 1.23 -1.08 0.00 0.00 178.44 178.38 1fr0 h GLY 735 N 0.07 -0.04 -1.08 0.83 0.00 -1.29 -1.76 103.07 99.81 1fr0 h GLY 735 Ca 0.54 0.01 0.44 0.00 0.00 0.00 0.00 47.33 48.32 1fr0 h GLY 735 CO -0.80 -0.01 1.05 -1.61 0.00 0.00 0.00 176.54 175.16 1fr0 h GLN 736 N -0.18 0.05 0.00 4.80 4.15 0.09 1.19 115.11 125.21 1fr0 h GLN 736 Ca -0.00 -0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.25 1fr0 h GLN 736 Cb 0.17 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.82 1fr0 h GLN 736 CO 0.01 0.03 -1.27 1.96 -1.93 0.00 0.00 178.83 177.63 1fr0 h GLN 737 N 0.05 0.00 0.00 1.69 7.50 -0.91 -3.32 115.11 120.12 1fr0 h GLN 737 Ca 0.75 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 59.86 1fr0 h GLN 737 Cb 2.82 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 30.34 1fr0 h GLN 737 CO -0.11 0.36 -0.21 0.82 -1.50 0.00 0.00 178.83 178.19 1fr0 h ILE 738 N 0.00 0.83 0.00 2.54 1.08 0.23 -1.80 117.51 120.39 1fr0 h ILE 738 Ca -0.14 -0.81 0.00 0.00 -0.39 0.00 0.00 64.86 63.52 1fr0 h ILE 738 Cb 1.58 1.48 0.00 0.00 -3.07 0.00 0.00 36.82 36.81 1fr0 h ILE 738 CO 0.05 0.20 0.00 0.00 -0.69 0.00 0.00 178.15 177.72 1fr0 n GLN 739 N -3.83 0.97 -2.45 2.37 6.02 -0.92 -3.79 117.38 115.76 1fr0 n GLN 739 Ca -0.02 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.68 1fr0 n GLN 739 Cb 0.30 -1.18 0.00 0.00 1.02 0.00 0.00 30.24 30.39 1fr0 n GLN 739 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 1fr0 n SER 740 N -0.68 5.14 -2.56 1.08 7.64 -0.68 -4.90 113.62 118.66 1fr0 n SER 740 Ca 0.09 -3.73 -0.07 0.00 1.01 0.00 0.00 58.87 56.16 1fr0 n SER 740 Cb 0.04 -0.57 -0.04 0.00 -1.01 0.00 0.00 64.21 62.63 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 -0.46 0.88 0.00 1.43 -0.04 -1.25 -2.78 135.00 132.78 1fr0 n PRO 741 Ca 0.41 -0.58 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 1fr0 n PRO 741 Cb 0.57 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 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 3.33 1.36 -4.75 3.54 8.00 -1.26 -4.98 116.55 121.79 1fr0 n ASP 742 Ca 0.19 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.28 1fr0 n ASP 742 Cb 0.25 0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.58 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 -0.92 4.42 0.38 0.64 1.02 -1.12 -4.87 118.68 118.24 1fr0 s LEU 743 Ca 0.00 2.53 0.27 0.00 0.02 0.00 0.00 54.13 56.96 1fr0 s LEU 743 Cb 0.00 -3.63 1.31 0.00 0.02 0.00 0.00 46.19 43.89 1fr0 s LEU 743 CO 0.00 -0.53 1.83 1.55 0.02 0.00 0.00 176.35 179.21 1fr0 h PRO 744 N 4.55 0.00 0.00 1.29 0.13 -1.97 -2.01 132.00 133.99 1fr0 h PRO 744 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 1fr0 h PRO 744 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1fr0 h PRO 744 CO 0.73 0.00 -2.03 0.00 -0.23 0.00 0.00 178.00 176.47 1fr0 n ALA 745 N -1.86 2.62 -0.01 -0.56 0.00 -1.26 -4.24 120.51 115.20 1fr0 n ALA 745 Ca -0.00 -0.61 -0.18 0.00 0.00 0.00 0.00 53.44 52.65 1fr0 n ALA 745 Cb 0.15 -0.66 -0.08 0.00 0.00 0.00 0.00 19.45 18.87 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 1.07 0.00 0.00 7.01 -1.72 -1.18 115.95 121.13 1fr0 h TRP 746 Ca -0.07 -0.50 0.00 0.00 2.11 0.00 0.00 58.89 60.43 1fr0 h TRP 746 Cb 1.14 -0.16 0.00 0.00 -2.10 0.00 0.00 29.16 28.04 1fr0 h TRP 746 CO 0.00 1.33 0.00 -1.91 -2.79 0.00 0.00 178.44 175.07 1fr0 n GLU 747 N -3.92 0.71 -0.00 2.65 2.13 -1.08 -1.26 120.64 119.87 1fr0 n GLU 747 Ca -0.08 0.01 0.01 0.00 0.66 0.00 0.00 57.16 57.75 1fr0 n GLU 747 Cb 0.78 -1.50 -0.01 0.00 0.27 0.00 0.00 31.44 30.98 1fr0 n GLU 747 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 1fr0 n ASP 748 N -1.02 1.31 -0.05 4.31 -0.08 -1.09 -4.65 116.55 115.27 1fr0 n ASP 748 Ca 0.17 -0.39 0.01 0.00 -1.51 0.00 0.00 54.79 53.08 1fr0 n ASP 748 Cb 0.09 1.01 -0.00 0.00 2.34 0.00 0.00 41.12 44.56 1fr0 n ASP 748 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1fr0 n ASN 749 N -1.16 0.62 -0.24 1.67 6.94 -0.47 -4.66 115.26 117.96 1fr0 n ASN 749 Ca 0.00 -0.81 0.04 0.00 -0.02 0.00 0.00 54.58 53.79 1fr0 n ASN 749 Cb 0.02 0.55 0.16 0.00 -2.36 0.00 0.00 39.78 38.15 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1fr0 h VAL 750 N 0.25 0.63 -0.40 3.53 2.07 -1.40 -1.65 116.25 119.29 1fr0 h VAL 750 Ca 0.00 -0.13 0.05 0.00 0.82 0.00 0.00 66.70 67.45 1fr0 h VAL 750 Cb 0.09 0.24 -0.08 0.00 -1.52 0.00 0.00 31.29 30.01 1fr0 h VAL 750 CO 0.00 0.07 -0.54 1.23 0.02 0.00 0.00 177.57 178.35 1fr0 h GLY 751 N 0.36 -0.94 2.00 2.17 0.00 -1.85 0.88 103.07 105.69 1fr0 h GLY 751 Ca 0.38 0.69 -0.00 0.00 0.00 0.00 0.00 47.33 48.40 1fr0 h GLY 751 CO -0.42 -0.13 -0.01 -2.09 0.00 0.00 0.00 176.54 173.90 1fr0 h GLU 752 N -0.39 0.00 0.49 4.80 4.22 -1.70 -2.64 114.58 119.36 1fr0 h GLU 752 Ca 0.08 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.50 1fr0 h GLU 752 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1fr0 h GLU 752 CO -0.59 0.01 -0.23 2.35 -2.18 0.00 0.00 179.01 178.36 1fr0 h TRP 753 N 0.00 -0.61 -0.47 0.92 2.91 0.16 0.74 115.95 119.61 1fr0 h TRP 753 Ca -0.00 -0.01 -0.04 0.00 1.13 0.00 0.00 58.89 59.97 1fr0 h TRP 753 Cb 0.07 0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 28.90 1fr0 h TRP 753 CO 0.00 -0.28 0.13 0.82 -1.03 0.00 0.00 178.44 178.07 1fr0 h ILE 754 N -0.96 1.20 0.34 2.65 2.04 -1.13 -2.39 117.51 119.25 1fr0 h ILE 754 Ca -0.07 -0.69 -0.02 0.00 1.00 0.00 0.00 64.86 65.09 1fr0 h ILE 754 Cb 0.60 0.71 0.00 0.00 -0.74 0.00 0.00 36.82 37.39 1fr0 h ILE 754 CO 0.11 0.26 -0.16 -0.08 0.00 0.00 0.00 178.15 178.27 1fr0 h GLU 755 N 0.68 -0.44 -0.84 2.37 4.81 -1.44 -1.55 114.58 118.17 1fr0 h GLU 755 Ca 0.16 0.03 0.23 0.00 -0.13 0.00 0.00 59.36 59.65 1fr0 h GLU 755 Cb 0.23 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 29.67 1fr0 h GLU 755 CO -0.01 -0.11 0.60 1.49 -0.73 0.00 0.00 179.01 180.25 1fr0 h GLU 756 N -0.90 0.08 0.08 1.92 4.81 -0.80 -1.96 114.58 117.81 1fr0 h GLU 756 Ca -0.05 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.17 1fr0 h GLU 756 Cb 0.53 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1fr0 h GLU 756 CO 0.08 0.06 -0.04 1.98 -0.73 0.00 0.00 179.01 180.35 1fr0 h MET 757 N 0.09 -0.10 -0.18 1.92 4.05 -1.32 -3.33 114.93 116.05 1fr0 h MET 757 Ca 0.41 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.86 1fr0 h MET 757 Cb 1.50 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 32.27 1fr0 h MET 757 CO -0.04 0.42 -0.37 0.87 0.23 0.00 0.00 176.91 178.01 1fr0 h LYS 758 N -0.90 -0.32 -2.95 0.39 1.57 -0.52 0.24 116.57 114.07 1fr0 h LYS 758 Ca -0.01 0.02 -0.67 0.00 -1.87 0.00 0.00 60.65 58.12 1fr0 h LYS 758 Cb 0.57 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.97 1fr0 h LYS 758 CO 0.02 -0.22 3.67 -1.91 -0.57 0.00 0.00 179.45 180.44 1fr0 n GLU 759 N -4.51 3.77 0.00 3.15 0.00 -1.00 -3.82 120.64 118.23 1fr0 n GLU 759 Ca -0.03 -2.30 0.00 0.00 0.00 0.00 0.00 57.16 54.83 1fr0 n GLU 759 Cb 0.24 -2.77 0.00 0.00 0.00 0.00 0.00 31.44 28.91 1fr0 n GLU 759 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1fr0 n GLU 760 N 3.39 0.00 -0.24 5.31 4.07 -0.90 -4.93 120.64 127.34 1fr0 n GLU 760 Ca 0.77 0.00 0.02 0.00 -0.06 0.00 0.00 57.16 57.89 1fr0 n GLU 760 Cb 0.24 0.00 0.11 0.00 -0.06 0.00 0.00 31.44 31.73 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 -0.17 -0.60 4.31 5.08 -0.64 0.53 115.95 124.45 1fr0 h TRP 761 Ca 0.00 0.06 0.12 0.00 1.08 0.00 0.00 58.89 60.14 1fr0 h TRP 761 Cb 0.00 0.19 -0.12 0.00 -3.00 0.00 0.00 29.16 26.23 1fr0 h TRP 761 CO 0.00 -0.25 -0.19 -0.09 -1.28 0.00 0.00 178.44 176.63 1fr0 h ARG 762 N 0.06 -0.04 -0.21 0.12 2.43 -1.80 -0.08 114.38 114.86 1fr0 h ARG 762 Ca 0.36 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.59 1fr0 h ARG 762 Cb 0.60 0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.09 1fr0 h ARG 762 CO -0.65 -0.03 -0.24 1.25 -1.51 0.00 0.00 179.97 178.79 1fr0 h HIS 763 N -0.04 -0.64 -1.11 2.20 2.76 -1.27 0.79 115.15 117.84 1fr0 h HIS 763 Ca 0.28 0.04 0.32 0.00 -2.20 0.00 0.00 60.37 58.81 1fr0 h HIS 763 Cb 0.47 0.31 -0.11 0.00 1.55 0.00 0.00 27.41 29.63 1fr0 h HIS 763 CO -0.52 -0.32 0.70 0.22 -1.30 0.00 0.00 177.93 176.71 1fr0 h ASP 764 N -0.26 0.41 0.31 3.26 1.82 -0.70 -1.89 116.42 119.37 1fr0 h ASP 764 Ca 0.13 0.12 -0.02 0.00 -0.39 0.00 0.00 57.03 56.87 1fr0 h ASP 764 Cb 0.46 0.06 0.00 0.00 0.68 0.00 0.00 39.33 40.53 1fr0 h ASP 764 CO -0.36 -0.02 -0.15 0.58 -1.61 0.00 0.00 179.24 177.68 1fr0 h VAL 765 N 0.31 0.00 -1.38 2.25 2.07 -0.36 -2.52 116.25 116.62 1fr0 h VAL 765 Ca 0.68 -0.17 0.40 0.00 0.82 0.00 0.00 66.70 68.43 1fr0 h VAL 765 Cb 1.81 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 1fr0 h VAL 765 CO -0.39 0.00 1.18 -0.33 0.02 0.00 0.00 177.57 178.05 1fr0 h GLU 766 N -0.59 0.00 0.40 1.57 5.08 -0.98 0.53 114.58 120.60 1fr0 h GLU 766 Ca -0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1fr0 h GLU 766 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 1fr0 h GLU 766 CO 0.07 0.00 -0.19 0.28 -1.00 0.00 0.00 179.01 178.17 1fr0 h VAL 767 N 0.00 0.00 -0.75 3.13 2.07 -1.16 -2.82 116.25 116.72 1fr0 h VAL 767 Ca 0.65 -0.54 0.22 0.00 0.82 0.00 0.00 66.70 67.85 1fr0 h VAL 767 Cb 3.00 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 32.74 1fr0 h VAL 767 CO -0.01 0.00 0.63 0.17 0.02 0.00 0.00 177.57 178.39 1fr0 h LEU 768 N -1.08 0.00 0.37 2.57 8.10 -0.48 -1.09 115.31 123.69 1fr0 h LEU 768 Ca -0.06 0.00 -0.02 0.00 0.11 0.00 0.00 57.88 57.92 1fr0 h LEU 768 Cb 0.41 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.64 1fr0 h LEU 768 CO 0.09 0.00 -0.18 0.50 -4.11 0.00 0.00 178.44 174.75 1fr0 h LYS 769 N 0.00 -0.47 -0.13 0.17 3.64 -1.32 -2.58 116.57 115.87 1fr0 h LYS 769 Ca 0.36 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.81 1fr0 h LYS 769 Cb 1.62 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 33.54 1fr0 h LYS 769 CO -0.00 -0.16 0.17 0.00 -2.27 0.00 0.00 179.45 177.19 1fr0 h ALA 770 N -0.46 1.67 -0.16 5.00 0.00 -0.95 -1.48 119.26 122.88 1fr0 h ALA 770 Ca -0.05 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1fr0 h ALA 770 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1fr0 h ALA 770 CO 0.08 -0.24 -0.35 2.35 0.00 0.00 0.00 179.25 181.09 1fr0 h TRP 771 N 0.00 0.65 0.18 0.00 7.01 -1.19 -2.94 115.95 119.67 1fr0 h TRP 771 Ca 0.06 -0.24 -0.01 0.00 2.11 0.00 0.00 58.89 60.81 1fr0 h TRP 771 Cb 0.41 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 1fr0 h TRP 771 CO 0.00 0.97 -0.09 0.28 -2.79 0.00 0.00 178.44 176.82 1fr0 h VAL 772 N 0.15 0.92 -0.12 2.65 2.07 -0.89 1.35 116.25 122.38 1fr0 h VAL 772 Ca 0.00 -0.54 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1fr0 h VAL 772 Cb 0.95 1.24 -0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1fr0 h VAL 772 CO 0.08 0.12 0.28 0.00 0.02 0.00 0.00 177.57 178.07 1fr0 h ALA 773 N 0.24 1.54 0.00 1.67 0.00 -1.56 -1.30 119.26 119.85 1fr0 h ALA 773 Ca -0.03 -0.00 -0.41 0.00 0.00 0.00 0.00 54.91 54.47 1fr0 h ALA 773 Cb 0.39 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1fr0 h ALA 773 CO 0.04 -0.34 -2.39 1.63 0.00 0.00 0.00 179.25 178.19 1fr0 n LYS 774 N -3.26 0.54 -0.36 0.00 5.02 -0.98 -4.49 118.16 114.63 1fr0 n LYS 774 Ca 0.00 0.21 0.08 0.00 -2.02 0.00 0.00 58.31 56.58 1fr0 n LYS 774 Cb 0.37 -1.41 0.25 0.00 -0.02 0.00 0.00 35.03 34.23 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 -0.71 1.54 -0.47 7.82 0.00 0.20 -3.32 119.26 124.33 1fr0 h ALA 775 Ca -0.61 0.02 -0.43 0.00 0.00 0.00 0.00 54.91 53.89 1fr0 h ALA 775 Cb 1.61 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 19.14 1fr0 h ALA 775 CO -0.32 0.21 1.64 -2.37 0.00 0.00 0.00 179.25 178.40 1fr0 n THR 776 N -4.62 -0.02 -3.36 0.00 5.66 -0.51 -2.21 114.28 109.21 1fr0 n THR 776 Ca 0.19 -0.33 -0.11 0.00 -3.05 0.00 0.00 64.05 60.76 1fr0 n THR 776 Cb 0.37 -1.18 0.00 0.00 -1.55 0.00 0.00 70.33 67.97 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 8.25 -1.41 0.00 1.09 5.02 -1.26 -5.04 118.16 124.81 1fr0 n LYS 777 Ca 0.57 1.17 0.13 0.00 -2.02 0.00 0.00 58.31 58.16 1fr0 n LYS 777 Cb 0.22 -4.43 0.42 0.00 -0.02 0.00 0.00 35.03 31.21 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05