#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 -2.51 4.28 -2.24 -1.26 -4.98 114.28 107.57 1fr0 n THR 655 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 1fr0 n THR 655 Cb 0.00 -1.28 0.01 0.00 -2.10 0.00 0.00 70.33 66.95 1fr0 n THR 655 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 1fr0 n GLU 656 N -0.44 4.22 0.00 -0.78 4.07 -1.26 -4.59 120.64 121.86 1fr0 n GLU 656 Ca 0.00 -3.94 0.11 0.00 -0.06 0.00 0.00 57.16 53.26 1fr0 n GLU 656 Cb 0.00 -2.71 -0.11 0.00 -0.06 0.00 0.00 31.44 28.56 1fr0 n GLU 656 CO 0.00 0.00 0.00 -0.85 -0.06 0.00 0.00 177.13 176.22 1fr0 n GLU 657 N 2.36 0.28 -0.59 5.31 0.00 -1.26 -4.59 120.64 122.15 1fr0 n GLU 657 Ca 0.40 -0.07 -0.01 0.00 0.00 0.00 0.00 57.16 57.48 1fr0 n GLU 657 Cb 0.32 -1.52 -0.01 0.00 0.00 0.00 0.00 31.44 30.24 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 1fr0 n ASN 658 N -1.84 -0.08 -2.72 -1.84 0.23 -1.26 -4.98 115.26 102.77 1fr0 n ASN 658 Ca 0.01 -1.34 -0.07 0.00 -0.53 0.00 0.00 54.58 52.65 1fr0 n ASN 658 Cb 0.43 -0.02 -0.01 0.00 -2.08 0.00 0.00 39.78 38.11 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1fr0 n SER 659 N 0.02 -1.71 0.25 0.53 7.64 -1.26 -4.73 113.62 114.36 1fr0 n SER 659 Ca -0.03 0.24 0.09 0.00 1.01 0.00 0.00 58.87 60.18 1fr0 n SER 659 Cb 0.58 -1.56 0.65 0.00 -1.01 0.00 0.00 64.21 62.87 1fr0 n SER 659 CO 0.00 0.00 0.00 0.07 -3.01 0.00 0.00 175.04 172.10 1fr0 h LYS 660 N -0.13 0.00 -0.69 1.43 2.10 -1.94 0.09 116.57 117.43 1fr0 h LYS 660 Ca -0.13 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.45 1fr0 h LYS 660 Cb 1.09 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.37 1fr0 h LYS 660 CO 0.17 0.08 0.10 0.45 -2.00 0.00 0.00 179.45 178.25 1fr0 n SER 661 N -4.23 5.02 0.00 7.07 2.88 -1.26 -3.78 113.62 119.32 1fr0 n SER 661 Ca -0.03 -2.94 0.00 0.00 -1.33 0.00 0.00 58.87 54.58 1fr0 n SER 661 Cb 0.16 -0.69 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 1fr0 n SER 661 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1fr0 n GLU 662 N 0.31 0.18 0.00 -1.46 1.02 -0.41 -4.78 120.64 115.50 1fr0 n GLU 662 Ca 0.30 0.00 0.14 0.00 -0.02 0.00 0.00 57.16 57.57 1fr0 n GLU 662 Cb 1.18 -0.62 0.47 0.00 -0.02 0.00 0.00 31.44 32.45 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1fr0 n ALA 663 N -1.59 2.63 -0.03 0.62 0.00 -0.12 -3.88 120.51 118.14 1fr0 n ALA 663 Ca 0.00 -0.46 -0.04 0.00 0.00 0.00 0.00 53.44 52.94 1fr0 n ALA 663 Cb 0.12 -1.13 -0.13 0.00 0.00 0.00 0.00 19.45 18.31 1fr0 n ALA 663 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fr0 n LEU 664 N 0.17 0.43 -4.02 0.00 4.77 -1.25 -4.08 117.00 113.04 1fr0 n LEU 664 Ca 0.18 0.20 -0.09 0.00 -0.03 0.00 0.00 56.01 56.27 1fr0 n LEU 664 Cb 0.37 0.24 -0.09 0.00 -2.33 0.00 0.00 43.42 41.62 1fr0 n LEU 664 CO 0.18 0.31 -0.21 -1.48 -1.33 0.00 0.00 177.39 174.85 1fr0 s LEU 665 N -5.57 1.75 -0.53 2.23 2.34 -1.25 -2.46 118.68 115.20 1fr0 s LEU 665 Ca -0.07 -0.93 -0.27 0.00 0.06 0.00 0.00 54.13 52.92 1fr0 s LEU 665 Cb 0.08 0.63 0.03 0.00 -0.56 0.00 0.00 46.19 46.37 1fr0 s LEU 665 CO 0.83 -0.72 1.10 -0.62 -1.06 0.00 0.00 176.35 175.89 1fr0 s ASP 666 N -2.94 6.49 0.03 1.48 -1.08 -0.95 -4.72 116.67 114.98 1fr0 s ASP 666 Ca 0.12 0.14 -0.22 0.00 -0.52 0.00 0.00 52.55 52.07 1fr0 s ASP 666 Cb 0.06 -2.52 -0.16 0.00 -1.46 0.00 0.00 42.92 38.85 1fr0 s ASP 666 CO -0.06 -1.32 1.36 0.40 0.52 0.00 0.00 175.17 176.07 1fr0 h ILE 667 N 6.15 1.34 0.02 4.11 5.03 -1.92 -2.27 117.51 129.96 1fr0 h ILE 667 Ca -0.24 -1.16 -0.00 0.00 -0.12 0.00 0.00 64.86 63.34 1fr0 h ILE 667 Cb 1.06 1.87 0.00 0.00 -3.03 0.00 0.00 36.82 36.73 1fr0 h ILE 667 CO 1.13 0.33 -0.01 1.55 -0.68 0.00 0.00 178.15 180.47 1fr0 h PRO 668 N -0.14 -0.03 -0.64 2.37 0.13 -1.98 -0.44 132.00 131.27 1fr0 h PRO 668 Ca 0.02 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.24 1fr0 h PRO 668 Cb 0.56 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.63 1fr0 h PRO 668 CO 0.02 0.50 0.30 1.98 -0.23 0.00 0.00 178.00 180.56 1fr0 h MET 669 N -0.57 0.51 -0.49 0.86 4.05 -1.98 -0.36 114.93 116.95 1fr0 h MET 669 Ca -0.00 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.27 1fr0 h MET 669 Cb 0.54 -0.11 -0.02 0.00 -0.80 0.00 0.00 31.60 31.21 1fr0 h MET 669 CO 0.00 0.34 -0.15 -0.07 0.23 0.00 0.00 176.91 177.27 1fr0 h LEU 670 N 0.52 0.95 0.55 3.39 3.38 -1.42 -2.45 115.31 120.24 1fr0 h LEU 670 Ca 0.31 -0.32 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1fr0 h LEU 670 Cb 0.32 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 1fr0 h LEU 670 CO -0.26 1.09 -0.33 -0.08 0.09 0.00 0.00 178.44 178.95 1fr0 h GLU 671 N 0.84 -0.80 -0.05 1.13 4.81 0.25 -2.40 114.58 118.36 1fr0 h GLU 671 Ca 0.13 0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.45 1fr0 h GLU 671 Cb 0.70 0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.20 1fr0 h GLU 671 CO 0.05 -0.53 -0.29 0.37 -0.73 0.00 0.00 179.01 177.88 1fr0 h GLN 672 N -0.83 -0.40 -1.27 1.92 4.15 -1.11 0.45 115.11 118.02 1fr0 h GLN 672 Ca -0.07 0.03 0.38 0.00 0.77 0.00 0.00 58.65 59.76 1fr0 h GLN 672 Cb 0.67 0.09 -0.10 0.00 0.21 0.00 0.00 27.48 28.35 1fr0 h GLN 672 CO 0.08 -0.26 0.84 1.88 -1.93 0.00 0.00 178.83 179.43 1fr0 h TYR 673 N -0.41 0.45 0.00 3.99 0.05 -1.30 1.59 116.97 121.35 1fr0 h TYR 673 Ca 0.07 0.02 -0.09 0.00 0.05 0.00 0.00 58.73 58.78 1fr0 h TYR 673 Cb 0.52 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.13 1fr0 h TYR 673 CO -0.34 -0.08 -0.43 -0.07 -1.05 0.00 0.00 178.16 176.18 1fr0 h LEU 674 N 0.16 0.00 -0.62 3.88 3.38 -0.42 -0.85 115.31 120.83 1fr0 h LEU 674 Ca 0.73 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.70 1fr0 h LEU 674 Cb 2.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 43.06 1fr0 h LEU 674 CO -0.30 0.43 0.00 -0.62 0.09 0.00 0.00 178.44 178.05 1fr0 n GLU 675 N -3.27 1.14 0.00 1.13 1.02 0.54 -3.86 120.64 117.34 1fr0 n GLU 675 Ca 0.02 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 57.01 1fr0 n GLU 675 Cb 0.67 -1.28 0.00 0.00 -0.02 0.00 0.00 31.44 30.81 1fr0 n GLU 675 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1fr0 n LEU 676 N -0.18 0.00 0.01 -4.62 -0.00 -1.15 -5.02 117.00 106.04 1fr0 n LEU 676 Ca 0.01 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 56.00 1fr0 n LEU 676 Cb 0.16 0.07 -0.01 0.00 -0.00 0.00 0.00 43.42 43.65 1fr0 n LEU 676 CO 0.01 -0.25 -0.28 0.52 -0.00 0.00 0.00 177.39 177.39 1fr0 n VAL 677 N -2.00 0.93 0.00 1.47 0.31 -0.42 -5.13 118.33 113.49 1fr0 n VAL 677 Ca 0.00 0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 1fr0 n VAL 677 Cb 0.00 -1.65 0.00 0.00 -0.91 0.00 0.00 33.84 31.28 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 3.05 -0.67 0.00 2.92 0.00 -0.64 -4.31 105.19 105.54 1fr0 n GLY 678 Ca -0.04 -1.96 0.10 0.00 0.00 0.00 0.00 46.02 44.12 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 0.73 0.00 1.61 -0.04 -1.26 -3.77 135.00 132.27 1fr0 n PRO 679 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1fr0 n PRO 679 Cb 0.00 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 1fr0 n PRO 679 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1fr0 n LYS 680 N -0.94 0.00 0.15 0.54 5.02 -1.26 -0.67 118.16 121.00 1fr0 n LYS 680 Ca 0.15 0.44 0.02 0.00 -2.02 0.00 0.00 58.31 56.91 1fr0 n LYS 680 Cb 0.07 -1.41 0.16 0.00 -0.02 0.00 0.00 35.03 33.84 1fr0 n LYS 680 CO 0.00 0.00 0.00 1.37 -0.52 0.00 0.00 177.40 178.25 1fr0 h LEU 681 N 0.00 0.00 -0.34 -0.35 8.10 -1.89 -2.84 115.31 117.99 1fr0 h LEU 681 Ca 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.91 1fr0 h LEU 681 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.21 1fr0 h LEU 681 CO 0.00 0.53 -0.09 0.40 -4.11 0.00 0.00 178.44 175.17 1fr0 h ILE 682 N 0.00 1.28 0.00 0.15 2.04 -1.65 0.11 117.51 119.44 1fr0 h ILE 682 Ca -0.01 -1.15 -0.13 0.00 1.00 0.00 0.00 64.86 64.58 1fr0 h ILE 682 Cb 1.18 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.57 1fr0 h ILE 682 CO 0.07 0.38 -0.60 0.00 0.00 0.00 0.00 178.15 178.00 1fr0 h THR 683 N 0.45 1.31 0.03 -0.27 1.03 -0.93 -1.38 112.91 113.15 1fr0 h THR 683 Ca 0.09 -2.14 -0.00 0.00 -0.01 0.00 0.00 66.41 64.35 1fr0 h THR 683 Cb 0.59 2.19 0.00 0.00 -1.07 0.00 0.00 68.15 69.87 1fr0 h THR 683 CO 0.04 0.59 -0.02 -0.78 -0.01 0.00 0.00 175.52 175.34 1fr0 h ASP 684 N 0.00 -0.04 -0.31 0.00 1.82 -1.34 -1.84 116.42 114.71 1fr0 h ASP 684 Ca -0.01 -0.67 -0.03 0.00 -0.39 0.00 0.00 57.03 55.93 1fr0 h ASP 684 Cb 1.14 0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.15 1fr0 h ASP 684 CO 0.08 0.73 0.06 1.23 -1.61 0.00 0.00 179.24 179.74 1fr0 h GLY 685 N -0.89 0.54 1.37 -0.78 0.00 -0.85 -2.49 103.07 99.97 1fr0 h GLY 685 Ca -0.00 -0.34 -0.06 0.00 0.00 0.00 0.00 47.33 46.92 1fr0 h GLY 685 CO 0.01 0.32 0.08 -2.00 0.00 0.00 0.00 176.54 174.95 1fr0 h LEU 686 N 0.33 0.74 0.84 3.11 5.85 -1.37 -0.66 115.31 124.14 1fr0 h LEU 686 Ca 0.09 -0.15 -0.04 0.00 0.84 0.00 0.00 57.88 58.63 1fr0 h LEU 686 Cb 0.31 -0.19 0.01 0.00 0.37 0.00 0.00 40.66 41.16 1fr0 h LEU 686 CO 0.00 0.76 -0.40 0.00 -0.34 0.00 0.00 178.44 178.46 1fr0 h ALA 687 N 1.34 -1.26 -0.53 1.25 0.00 -1.10 0.11 119.26 119.07 1fr0 h ALA 687 Ca 0.16 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1fr0 h ALA 687 Cb 0.34 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1fr0 h ALA 687 CO 0.01 -1.18 0.36 -0.39 0.00 0.00 0.00 179.25 178.04 1fr0 h VAL 688 N -1.16 1.00 -0.06 0.00 -1.51 -1.44 0.59 116.25 113.68 1fr0 h VAL 688 Ca -0.11 -0.18 -0.07 0.00 -1.23 0.00 0.00 66.70 65.11 1fr0 h VAL 688 Cb 0.86 0.44 -0.01 0.00 -2.13 0.00 0.00 31.29 30.45 1fr0 h VAL 688 CO 0.19 0.09 -0.30 0.15 -1.23 0.00 0.00 177.57 176.48 1fr0 h PHE 689 N 0.52 0.11 -0.46 5.19 3.57 -0.81 -2.51 116.94 122.55 1fr0 h PHE 689 Ca 0.23 -0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 1fr0 h PHE 689 Cb 0.24 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1fr0 h PHE 689 CO -0.00 0.39 -0.15 0.93 -2.23 0.00 0.00 178.31 177.25 1fr0 h GLU 690 N 0.09 0.92 -0.18 1.11 4.39 0.16 0.21 114.58 121.28 1fr0 h GLU 690 Ca 0.01 -0.37 -0.03 0.00 0.34 0.00 0.00 59.36 59.31 1fr0 h GLU 690 Cb 0.57 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 1fr0 h GLU 690 CO 0.04 1.03 0.01 0.87 -1.16 0.00 0.00 179.01 179.80 1fr0 h LYS 691 N 0.76 0.32 -0.01 2.33 1.57 -1.18 -2.83 116.57 117.54 1fr0 h LYS 691 Ca 0.11 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1fr0 h LYS 691 Cb 0.71 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1fr0 h LYS 691 CO 0.05 0.51 0.00 -0.12 -0.57 0.00 0.00 179.45 179.33 1fr0 n MET 692 N -4.73 1.36 0.11 3.15 1.56 -0.97 -4.11 117.12 113.48 1fr0 n MET 692 Ca -0.05 -0.52 -0.13 0.00 -0.27 0.00 0.00 57.70 56.74 1fr0 n MET 692 Cb 0.21 -1.49 -0.06 0.00 2.15 0.00 0.00 33.22 34.03 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 1.27 -0.29 -0.23 2.12 4.05 -0.31 -0.05 114.93 121.48 1fr0 h MET 693 Ca 0.00 0.02 -0.14 0.00 -0.28 0.00 0.00 59.70 59.30 1fr0 h MET 693 Cb 0.27 0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.13 1fr0 h MET 693 CO 0.00 -0.19 -0.45 -1.00 0.23 0.00 0.00 176.91 175.50 1fr0 h PRO 694 N -0.30 0.58 -0.51 0.39 0.13 -1.73 -2.68 132.00 127.88 1fr0 h PRO 694 Ca 0.01 -0.32 -0.03 0.00 -0.87 0.00 0.00 66.00 64.80 1fr0 h PRO 694 Cb 0.30 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.42 1fr0 h PRO 694 CO -0.05 0.91 0.21 0.78 -0.23 0.00 0.00 178.00 179.62 1fr0 h GLY 695 N 1.05 0.78 0.11 1.56 0.00 -1.68 -0.40 103.07 104.49 1fr0 h GLY 695 Ca 0.03 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.97 1fr0 h GLY 695 CO 0.09 0.36 -0.05 -0.97 0.00 0.00 0.00 176.54 175.97 1fr0 h TYR 696 N 0.73 -0.14 -0.95 5.60 0.05 -0.79 -2.29 116.97 119.18 1fr0 h TYR 696 Ca 0.18 -0.00 0.26 0.00 0.05 0.00 0.00 58.73 59.22 1fr0 h TYR 696 Cb 0.14 0.05 -0.14 0.00 1.01 0.00 0.00 36.73 37.79 1fr0 h TYR 696 CO 0.01 -0.09 0.44 -0.39 -1.05 0.00 0.00 178.16 177.08 1fr0 h VAL 697 N -0.23 0.38 0.52 -2.88 -1.51 -1.50 -0.38 116.25 110.64 1fr0 h VAL 697 Ca -0.02 -0.12 -0.01 0.00 -1.23 0.00 0.00 66.70 65.32 1fr0 h VAL 697 Cb 0.11 -0.00 -0.02 0.00 -2.13 0.00 0.00 31.29 29.25 1fr0 h VAL 697 CO 0.03 0.06 -0.48 0.28 -1.23 0.00 0.00 177.57 176.23 1fr0 h SER 698 N 0.35 -1.30 -0.94 4.19 0.02 -1.08 -1.39 113.55 113.39 1fr0 h SER 698 Ca 0.63 0.10 0.18 0.00 -0.84 0.00 0.00 61.79 61.87 1fr0 h SER 698 Cb 1.32 0.42 -0.08 0.00 0.14 0.00 0.00 62.40 64.20 1fr0 h SER 698 CO -0.58 -0.65 0.60 0.58 -1.14 0.00 0.00 176.83 175.64 1fr0 h VAL 699 N -0.99 0.73 -0.04 2.27 2.07 -0.51 -1.12 116.25 118.66 1fr0 h VAL 699 Ca -0.06 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.29 1fr0 h VAL 699 Cb 0.86 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 1fr0 h VAL 699 CO -0.04 0.11 -0.22 0.25 0.02 0.00 0.00 177.57 177.68 1fr0 h LEU 700 N 0.61 -0.67 -0.27 2.57 5.85 -0.17 -1.91 115.31 121.32 1fr0 h LEU 700 Ca 0.50 0.10 0.05 0.00 0.84 0.00 0.00 57.88 59.37 1fr0 h LEU 700 Cb 0.97 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 1fr0 h LEU 700 CO -0.25 -0.29 -0.02 -0.33 -0.34 0.00 0.00 178.44 177.21 1fr0 h GLU 701 N -0.34 0.05 -0.81 1.25 5.08 -0.60 -1.16 114.58 118.06 1fr0 h GLU 701 Ca 0.07 -0.00 0.18 0.00 -1.00 0.00 0.00 59.36 58.61 1fr0 h GLU 701 Cb 0.43 -0.01 -0.12 0.00 0.50 0.00 0.00 28.75 29.56 1fr0 h GLU 701 CO -0.23 0.03 0.27 0.77 -1.00 0.00 0.00 179.01 178.85 1fr0 h SER 702 N 0.05 0.15 0.53 1.42 0.02 -1.06 0.60 113.55 115.27 1fr0 h SER 702 Ca 0.13 0.15 -0.08 0.00 -0.84 0.00 0.00 61.79 61.15 1fr0 h SER 702 Cb 0.18 0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1fr0 h SER 702 CO -0.24 -0.02 -0.38 0.78 -1.14 0.00 0.00 176.83 175.84 1fr0 h ASN 703 N 0.33 0.00 0.03 3.07 2.35 -0.53 -2.56 115.58 118.28 1fr0 h ASN 703 Ca 0.48 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.23 1fr0 h ASN 703 Cb 0.85 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.22 1fr0 h ASN 703 CO -0.52 0.38 -0.04 0.25 -1.65 0.00 0.00 177.43 175.85 1fr0 h LEU 704 N 0.00 -0.10 -1.22 1.61 7.12 0.14 -1.50 115.31 121.35 1fr0 h LEU 704 Ca -0.00 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 58.01 1fr0 h LEU 704 Cb 0.74 0.04 -0.00 0.00 -0.53 0.00 0.00 40.66 40.91 1fr0 h LEU 704 CO 0.05 -0.06 -0.05 0.71 -0.13 0.00 0.00 178.44 178.96 1fr0 h THR 705 N -0.08 0.12 -0.13 1.05 1.35 -1.38 -2.51 112.91 111.32 1fr0 h THR 705 Ca 0.01 -0.71 0.00 0.00 -0.55 0.00 0.00 66.41 65.16 1fr0 h THR 705 Cb 0.09 1.62 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 1fr0 h THR 705 CO -0.02 0.05 0.00 0.00 -0.25 0.00 0.00 175.52 175.30 1fr0 n ALA 706 N -2.12 2.51 -3.34 6.62 0.00 -0.66 -4.88 120.51 118.64 1fr0 n ALA 706 Ca 0.01 -0.29 -0.24 0.00 0.00 0.00 0.00 53.44 52.91 1fr0 n ALA 706 Cb 0.36 -1.06 0.03 0.00 0.00 0.00 0.00 19.45 18.77 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 -0.11 -4.89 -3.30 0.00 1.13 -0.94 -4.90 117.38 104.37 1fr0 n GLN 707 Ca 0.09 0.72 -0.46 0.00 -1.94 0.00 0.00 57.00 55.41 1fr0 n GLN 707 Cb 0.16 -5.56 -0.01 0.00 0.11 0.00 0.00 30.24 24.93 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 -2.87 7.05 -0.02 1.08 1.11 -0.67 -4.88 116.67 117.47 1fr0 s ASP 708 Ca 0.43 -3.12 -0.22 0.00 0.18 0.00 0.00 52.55 49.82 1fr0 s ASP 708 Cb -0.21 -2.23 -0.13 0.00 1.07 0.00 0.00 42.92 41.42 1fr0 s ASP 708 CO 0.53 -0.46 0.94 0.11 1.18 0.00 0.00 175.17 177.47 1fr0 h LYS 709 N 7.25 -0.54 -0.09 8.23 1.57 -1.90 -2.57 116.57 128.53 1fr0 h LYS 709 Ca 0.15 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1fr0 h LYS 709 Cb 0.95 0.12 -0.02 0.00 0.08 0.00 0.00 32.23 33.37 1fr0 h LYS 709 CO 0.92 -0.25 -0.10 -0.22 -0.57 0.00 0.00 179.45 179.23 1fr0 h LYS 710 N -1.02 -0.05 -0.52 3.15 3.64 -2.00 -0.31 116.57 119.45 1fr0 h LYS 710 Ca -0.06 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.38 1fr0 h LYS 710 Cb 0.54 0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.28 1fr0 h LYS 710 CO 0.09 -0.04 -0.56 0.78 -2.27 0.00 0.00 179.45 177.45 1fr0 h GLY 711 N -0.06 -0.98 -0.86 5.01 0.00 -1.99 -0.59 103.07 103.61 1fr0 h GLY 711 Ca 0.02 0.74 0.13 0.00 0.00 0.00 0.00 47.33 48.21 1fr0 h GLY 711 CO -0.11 -0.09 -0.43 -2.22 0.00 0.00 0.00 176.54 173.69 1fr0 h ILE 712 N -0.32 0.03 0.43 2.60 2.04 -0.95 -0.56 117.51 120.78 1fr0 h ILE 712 Ca 0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1fr0 h ILE 712 Cb 0.56 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 1fr0 h ILE 712 CO -0.66 0.00 -0.39 0.58 0.00 0.00 0.00 178.15 177.68 1fr0 h VAL 713 N -0.05 0.21 -0.42 1.67 2.07 0.39 0.13 116.25 120.25 1fr0 h VAL 713 Ca 0.27 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.86 1fr0 h VAL 713 Cb 0.55 0.21 -0.09 0.00 -1.52 0.00 0.00 31.29 30.44 1fr0 h VAL 713 CO -0.90 0.00 -0.45 -0.33 0.02 0.00 0.00 177.57 175.91 1fr0 h GLU 714 N -0.83 -0.32 0.00 1.57 5.08 0.02 1.41 114.58 121.52 1fr0 h GLU 714 Ca -0.04 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1fr0 h GLU 714 Cb 0.72 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.05 1fr0 h GLU 714 CO -0.04 -0.21 0.00 0.39 -1.00 0.00 0.00 179.01 178.15 1fr0 n GLU 715 N -5.41 0.10 0.04 2.33 -0.58 -0.35 -1.93 120.64 114.85 1fr0 n GLU 715 Ca -0.01 0.22 -0.03 0.00 -0.42 0.00 0.00 57.16 56.93 1fr0 n GLU 715 Cb 0.35 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.71 1fr0 n GLU 715 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1fr0 h GLY 716 N 2.05 -0.18 2.00 0.62 0.00 0.47 -0.92 103.07 107.11 1fr0 h GLY 716 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 47.33 47.39 1fr0 h GLY 716 CO 0.00 -0.07 -0.02 1.12 0.00 0.00 0.00 176.54 177.58 1fr0 h HIS 717 N -0.74 0.00 0.00 5.60 2.07 -1.38 -1.86 115.15 118.84 1fr0 h HIS 717 Ca -0.02 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.50 1fr0 h HIS 717 Cb 0.13 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.11 1fr0 h HIS 717 CO 0.01 0.02 -0.03 -0.22 -3.07 0.00 0.00 177.93 174.63 1fr0 h LYS 718 N 0.00 0.00 0.56 5.12 3.64 -1.49 -1.76 116.57 122.64 1fr0 h LYS 718 Ca -0.00 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1fr0 h LYS 718 Cb 0.60 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.43 1fr0 h LYS 718 CO 0.00 0.68 -0.27 0.82 -2.27 0.00 0.00 179.45 178.42 1fr0 h ILE 719 N -1.00 0.00 0.04 2.00 2.04 -1.18 -2.45 117.51 116.96 1fr0 h ILE 719 Ca -0.01 -0.23 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 1fr0 h ILE 719 Cb 0.69 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.78 1fr0 h ILE 719 CO -0.00 0.00 -0.02 0.11 0.00 0.00 0.00 178.15 178.24 1fr0 h LYS 720 N -0.98 -0.05 -1.01 2.37 1.57 -1.48 -1.93 116.57 115.06 1fr0 h LYS 720 Ca -0.08 0.00 0.32 0.00 -1.87 0.00 0.00 60.65 59.03 1fr0 h LYS 720 Cb 0.57 0.01 -0.15 0.00 0.08 0.00 0.00 32.23 32.75 1fr0 h LYS 720 CO 0.13 0.01 0.57 0.78 -0.57 0.00 0.00 179.45 180.37 1fr0 h GLY 721 N -0.09 2.06 1.88 3.86 0.00 -1.39 1.09 103.07 110.47 1fr0 h GLY 721 Ca -0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 47.33 46.92 1fr0 h GLY 721 CO 0.01 -0.48 -0.72 0.00 0.00 0.00 0.00 176.54 175.35 1fr0 h ALA 722 N 1.84 0.77 -0.16 3.60 0.00 -0.88 -2.83 119.26 121.60 1fr0 h ALA 722 Ca 0.73 -0.63 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1fr0 h ALA 722 Cb 1.67 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 19.36 1fr0 h ALA 722 CO -0.60 0.84 -0.25 0.00 0.00 0.00 0.00 179.25 179.25 1fr0 h ALA 723 N 1.19 0.24 0.00 0.00 0.00 0.18 -2.82 119.26 118.06 1fr0 h ALA 723 Ca -0.02 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1fr0 h ALA 723 Cb 1.27 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1fr0 h ALA 723 CO 0.10 0.22 0.00 0.78 0.00 0.00 0.00 179.25 180.35 1fr0 h GLY 724 N 0.08 0.00 2.00 0.00 0.00 -0.83 -2.15 103.07 102.17 1fr0 h GLY 724 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.21 1fr0 h GLY 724 CO 0.06 0.00 -0.63 1.76 0.00 0.00 0.00 176.54 177.72 1fr0 h SER 725 N 0.00 0.00 0.73 0.19 0.02 -1.23 -2.45 113.55 110.80 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 0.32 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1fr0 h SER 725 CO 0.00 0.63 -0.00 0.52 -1.14 0.00 0.00 176.83 176.84 1fr0 n VAL 726 N -3.76 0.00 0.00 2.27 0.31 -0.84 -4.81 118.33 111.50 1fr0 n VAL 726 Ca -0.01 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.32 1fr0 n VAL 726 Cb 0.63 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 33.07 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 1.36 0.42 2.87 2.92 0.00 -0.93 -4.95 105.19 106.89 1fr0 n GLY 727 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 6.60 0.12 0.99 4.77 0.16 -2.23 117.00 127.40 1fr0 n LEU 728 Ca 0.00 -4.40 -0.16 0.00 -0.03 0.00 0.00 56.01 51.42 1fr0 n LEU 728 Cb 0.00 -1.57 -0.10 0.00 -2.33 0.00 0.00 43.42 39.42 1fr0 n LEU 728 CO 0.00 1.18 0.51 0.03 -1.33 0.00 0.00 177.39 177.79 1fr0 h ARG 729 N 5.99 -0.72 -0.87 3.23 2.47 -1.65 -2.35 114.38 120.49 1fr0 h ARG 729 Ca 0.46 0.05 0.08 0.00 -1.26 0.00 0.00 59.98 59.31 1fr0 h ARG 729 Cb 0.66 0.16 -0.10 0.00 -1.65 0.00 0.00 29.97 29.03 1fr0 h ARG 729 CO 1.71 -0.48 -0.51 1.58 0.56 0.00 0.00 179.97 182.83 1fr0 n HIS 730 N -5.38 -0.38 -0.15 3.04 -0.00 -1.15 -0.50 115.22 110.70 1fr0 n HIS 730 Ca -0.08 1.09 -0.05 0.00 0.46 0.00 0.00 57.72 59.13 1fr0 n HIS 730 Cb 0.40 -0.57 0.01 0.00 -0.12 0.00 0.00 29.99 29.72 1fr0 n HIS 730 CO 0.00 0.00 0.00 -0.07 0.46 0.00 0.00 176.34 176.73 1fr0 h LEU 731 N 0.00 -0.88 -0.63 0.27 -0.00 -1.77 -1.73 115.31 110.57 1fr0 h LEU 731 Ca 0.14 0.19 0.09 0.00 -0.00 0.00 0.00 57.88 58.30 1fr0 h LEU 731 Cb 0.36 0.46 -0.11 0.00 -0.00 0.00 0.00 40.66 41.36 1fr0 h LEU 731 CO -0.82 -0.27 -0.43 -0.61 -0.00 0.00 0.00 178.44 176.31 1fr0 h GLN 732 N -0.15 -0.19 0.24 1.13 -0.00 -0.26 -1.73 115.11 114.15 1fr0 h GLN 732 Ca 0.22 0.01 0.01 0.00 -0.00 0.00 0.00 58.65 58.89 1fr0 h GLN 732 Cb 0.50 0.04 -0.04 0.00 0.00 0.00 0.00 27.48 27.98 1fr0 h GLN 732 CO -0.58 -0.13 -0.49 1.96 0.00 0.00 0.00 178.83 179.60 1fr0 h GLN 733 N -0.20 -0.77 -0.96 1.69 7.50 -0.86 -1.75 115.11 119.76 1fr0 h GLN 733 Ca 0.19 0.05 0.15 0.00 0.50 0.00 0.00 58.65 59.55 1fr0 h GLN 733 Cb 0.56 0.18 -0.16 0.00 0.05 0.00 0.00 27.48 28.11 1fr0 h GLN 733 CO -0.72 -0.52 -0.38 -0.07 -1.50 0.00 0.00 178.83 175.65 1fr0 h LEU 734 N -0.80 -1.38 0.44 1.46 4.07 -0.92 0.84 115.31 119.01 1fr0 h LEU 734 Ca -0.01 0.30 -0.01 0.00 0.08 0.00 0.00 57.88 58.24 1fr0 h LEU 734 Cb 0.77 0.73 -0.02 0.00 1.08 0.00 0.00 40.66 43.23 1fr0 h LEU 734 CO -0.20 -0.29 -0.40 1.23 -1.08 0.00 0.00 178.44 177.69 1fr0 h GLY 735 N -0.01 -0.98 -0.83 0.83 0.00 -0.95 -0.59 103.07 100.53 1fr0 h GLY 735 Ca 0.34 0.46 0.33 0.00 0.00 0.00 0.00 47.33 48.47 1fr0 h GLY 735 CO -0.97 -0.33 0.34 -1.61 0.00 0.00 0.00 176.54 173.97 1fr0 h GLN 736 N -0.85 0.08 -0.40 4.80 4.15 -0.01 0.99 115.11 123.87 1fr0 h GLN 736 Ca -0.04 -0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.22 1fr0 h GLN 736 Cb 0.74 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.41 1fr0 h GLN 736 CO -0.04 0.05 -0.34 1.96 -1.93 0.00 0.00 178.83 178.54 1fr0 h GLN 737 N 0.08 0.94 0.00 1.69 7.50 -0.28 -2.46 115.11 122.58 1fr0 h GLN 737 Ca 0.71 -0.47 0.00 0.00 0.50 0.00 0.00 58.65 59.39 1fr0 h GLN 737 Cb 1.68 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.21 1fr0 h GLN 737 CO -0.77 1.13 0.00 0.82 -1.50 0.00 0.00 178.83 178.51 1fr0 h ILE 738 N 0.77 0.00 0.00 2.54 2.04 0.25 -1.31 117.51 121.80 1fr0 h ILE 738 Ca 0.07 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.92 1fr0 h ILE 738 Cb 0.93 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1fr0 h ILE 738 CO 0.09 0.00 0.00 1.67 0.00 0.00 0.00 178.15 179.91 1fr0 n GLN 739 N -2.31 0.71 -3.13 2.37 -0.06 -0.69 -3.73 117.38 110.54 1fr0 n GLN 739 Ca -0.01 0.00 -0.21 0.00 -2.00 0.00 0.00 57.00 54.77 1fr0 n GLN 739 Cb 0.05 -1.30 -0.04 0.00 -4.06 0.00 0.00 30.24 24.89 1fr0 n GLN 739 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1fr0 n SER 740 N -0.80 1.90 -1.97 1.69 3.41 -0.49 -4.95 113.62 112.41 1fr0 n SER 740 Ca 0.10 -3.19 -0.03 0.00 -0.26 0.00 0.00 58.87 55.50 1fr0 n SER 740 Cb 0.05 -0.61 -0.04 0.00 -0.26 0.00 0.00 64.21 63.35 1fr0 n SER 740 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1fr0 n PRO 741 N 0.25 0.72 0.00 4.33 -0.04 -1.24 -2.85 135.00 136.17 1fr0 n PRO 741 Ca 0.27 -0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 1fr0 n PRO 741 Cb 0.56 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 1fr0 n PRO 741 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fr0 n ASP 742 N 2.19 1.79 -4.75 3.54 5.68 -1.26 -4.92 116.55 118.81 1fr0 n ASP 742 Ca 0.09 -0.17 -0.41 0.00 -0.50 0.00 0.00 54.79 53.80 1fr0 n ASP 742 Cb 0.34 0.71 -0.02 0.00 -1.14 0.00 0.00 41.12 41.00 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1fr0 s LEU 743 N -1.77 4.41 0.52 -2.12 1.43 -1.13 -4.87 118.68 115.15 1fr0 s LEU 743 Ca 0.00 2.60 0.34 0.00 -1.03 0.00 0.00 54.13 56.04 1fr0 s LEU 743 Cb 0.00 -3.63 1.62 0.00 0.03 0.00 0.00 46.19 44.22 1fr0 s LEU 743 CO 0.00 -0.58 2.03 1.55 0.23 0.00 0.00 176.35 179.58 1fr0 h PRO 744 N 4.47 0.00 0.00 1.29 0.13 -1.96 -2.21 132.00 133.72 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 0.73 0.00 -1.72 0.00 -0.23 0.00 0.00 178.00 176.78 1fr0 n ALA 745 N -2.00 3.26 0.02 -0.56 0.00 -1.26 -4.20 120.51 115.76 1fr0 n ALA 745 Ca -0.01 -0.52 -0.19 0.00 0.00 0.00 0.00 53.44 52.73 1fr0 n ALA 745 Cb 0.19 -0.73 -0.10 0.00 0.00 0.00 0.00 19.45 18.81 1fr0 n ALA 745 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.50 179.85 1fr0 h TRP 746 N 0.00 0.86 0.00 0.00 7.01 -1.76 -2.00 115.95 120.06 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 0.85 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 27.80 1fr0 h TRP 746 CO 0.00 1.28 0.00 -1.91 -2.79 0.00 0.00 178.44 175.02 1fr0 n GLU 747 N -4.03 0.40 -0.02 2.65 2.13 -1.12 -0.61 120.64 120.04 1fr0 n GLU 747 Ca -0.10 0.06 0.04 0.00 0.66 0.00 0.00 57.16 57.82 1fr0 n GLU 747 Cb 0.77 -1.50 -0.12 0.00 0.27 0.00 0.00 31.44 30.86 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 -1.23 1.37 -0.00 4.31 -0.08 -1.15 -4.50 116.55 115.27 1fr0 n ASP 748 Ca 0.12 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.47 1fr0 n ASP 748 Cb 0.16 1.50 -0.10 0.00 2.34 0.00 0.00 41.12 45.02 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 -2.18 1.35 -0.52 1.67 0.23 -0.76 -4.46 115.26 110.59 1fr0 n ASN 749 Ca -0.08 -0.26 0.43 0.00 -0.53 0.00 0.00 54.58 54.14 1fr0 n ASN 749 Cb 0.56 1.47 0.75 0.00 -2.08 0.00 0.00 39.78 40.48 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -0.93 0.00 0.00 177.26 176.91 1fr0 h VAL 750 N 0.00 0.17 0.43 3.53 2.07 -1.09 0.11 116.25 121.48 1fr0 h VAL 750 Ca 0.00 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 1fr0 h VAL 750 Cb 0.57 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1fr0 h VAL 750 CO 0.00 0.01 -0.43 1.23 0.02 0.00 0.00 177.57 178.40 1fr0 h GLY 751 N 0.04 -1.03 2.00 2.17 0.00 -1.84 -0.35 103.07 104.04 1fr0 h GLY 751 Ca 0.79 0.50 0.00 0.00 0.00 0.00 0.00 47.33 48.61 1fr0 h GLY 751 CO -0.11 -0.34 0.00 0.83 0.00 0.00 0.00 176.54 176.92 1fr0 h GLU 752 N -0.87 0.00 -0.02 4.80 5.08 -1.13 -1.86 114.58 120.57 1fr0 h GLU 752 Ca -0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1fr0 h GLU 752 Cb 0.77 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.02 1fr0 h GLU 752 CO -0.06 0.00 -0.04 2.35 -1.00 0.00 0.00 179.01 180.25 1fr0 h TRP 753 N 0.00 0.09 0.01 4.33 2.91 -0.33 -0.48 115.95 122.47 1fr0 h TRP 753 Ca 0.00 -0.03 -0.19 0.00 1.13 0.00 0.00 58.89 59.80 1fr0 h TRP 753 Cb 0.34 -0.02 -0.02 0.00 -0.51 0.00 0.00 29.16 28.95 1fr0 h TRP 753 CO 0.00 0.62 -0.89 0.82 -1.03 0.00 0.00 178.44 177.96 1fr0 h ILE 754 N -0.46 1.60 0.17 2.65 2.04 -1.04 -2.48 117.51 119.99 1fr0 h ILE 754 Ca 0.00 -2.94 -0.01 0.00 1.00 0.00 0.00 64.86 62.92 1fr0 h ILE 754 Cb 0.61 2.60 0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1fr0 h ILE 754 CO 0.01 0.84 -0.08 -0.33 0.00 0.00 0.00 178.15 178.59 1fr0 h GLU 755 N 0.02 -0.22 -0.44 2.37 5.08 -1.39 -2.43 114.58 117.57 1fr0 h GLU 755 Ca -0.02 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1fr0 h GLU 755 Cb 1.55 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 1fr0 h GLU 755 CO 0.12 0.18 0.28 1.49 -1.00 0.00 0.00 179.01 180.08 1fr0 h GLU 756 N -0.90 0.56 0.48 2.33 4.57 -1.20 -2.43 114.58 117.99 1fr0 h GLU 756 Ca -0.02 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 1fr0 h GLU 756 Cb 0.51 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.95 1fr0 h GLU 756 CO 0.04 0.37 -0.48 1.98 -1.18 0.00 0.00 179.01 179.74 1fr0 h MET 757 N 0.57 -0.92 -0.59 1.92 4.05 -1.53 -2.86 114.93 115.57 1fr0 h MET 757 Ca 0.17 0.06 0.07 0.00 -0.28 0.00 0.00 59.70 59.72 1fr0 h MET 757 Cb -0.04 0.21 -0.10 0.00 -0.80 0.00 0.00 31.60 30.87 1fr0 h MET 757 CO -0.05 -0.61 -0.52 -0.22 0.23 0.00 0.00 176.91 175.74 1fr0 h LYS 758 N -0.95 -0.25 -2.79 0.39 3.64 -1.32 0.20 116.57 115.48 1fr0 h LYS 758 Ca -0.06 0.02 -0.58 0.00 -1.27 0.00 0.00 60.65 58.75 1fr0 h LYS 758 Cb 0.83 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1fr0 h LYS 758 CO -0.06 -0.17 2.98 0.39 -2.27 0.00 0.00 179.45 180.33 1fr0 n GLU 759 N -5.36 3.43 0.00 1.90 -0.58 -0.92 -3.79 120.64 115.31 1fr0 n GLU 759 Ca -0.01 -2.05 0.00 0.00 -0.42 0.00 0.00 57.16 54.69 1fr0 n GLU 759 Cb 0.33 -2.64 0.00 0.00 -0.57 0.00 0.00 31.44 28.56 1fr0 n GLU 759 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1fr0 n GLU 760 N 3.26 0.00 -0.28 3.49 0.00 -0.48 -4.91 120.64 121.72 1fr0 n GLU 760 Ca 0.71 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.95 1fr0 n GLU 760 Cb 0.36 0.00 0.20 0.00 0.00 0.00 0.00 31.44 32.00 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 177.13 177.24 1fr0 h TRP 761 N 0.00 0.06 -0.76 4.31 5.08 -0.76 0.12 115.95 124.00 1fr0 h TRP 761 Ca 0.00 0.06 0.12 0.00 1.08 0.00 0.00 58.89 60.15 1fr0 h TRP 761 Cb 0.00 0.10 -0.13 0.00 -3.00 0.00 0.00 29.16 26.13 1fr0 h TRP 761 CO 0.00 -0.25 -0.37 -0.09 -1.28 0.00 0.00 178.44 176.45 1fr0 h ARG 762 N 0.13 -0.10 -0.75 0.12 9.65 -1.82 0.73 114.38 122.34 1fr0 h ARG 762 Ca 0.47 0.01 0.13 0.00 -1.10 0.00 0.00 59.98 59.48 1fr0 h ARG 762 Cb 0.87 0.02 -0.09 0.00 -1.39 0.00 0.00 29.97 29.38 1fr0 h ARG 762 CO -0.69 -0.07 0.33 1.25 2.80 0.00 0.00 179.97 183.59 1fr0 h HIS 763 N -0.10 0.57 -0.92 2.20 2.76 -1.14 0.54 115.15 119.06 1fr0 h HIS 763 Ca 0.27 0.03 0.23 0.00 -2.20 0.00 0.00 60.37 58.70 1fr0 h HIS 763 Cb 0.57 -0.14 -0.13 0.00 1.55 0.00 0.00 27.41 29.26 1fr0 h HIS 763 CO -0.75 0.12 0.43 0.22 -1.30 0.00 0.00 177.93 176.65 1fr0 h ASP 764 N 0.50 0.39 -0.06 3.26 1.82 0.76 0.13 116.42 123.22 1fr0 h ASP 764 Ca 0.40 0.15 -0.20 0.00 -0.39 0.00 0.00 57.03 56.99 1fr0 h ASP 764 Cb 0.55 0.12 0.00 0.00 0.68 0.00 0.00 39.33 40.69 1fr0 h ASP 764 CO -0.36 0.01 -0.68 0.58 -1.61 0.00 0.00 179.24 177.17 1fr0 h VAL 765 N 0.42 1.30 0.13 2.25 2.07 -0.47 -2.64 116.25 119.32 1fr0 h VAL 765 Ca 0.58 -1.93 0.01 0.00 0.82 0.00 0.00 66.70 66.18 1fr0 h VAL 765 Cb 1.11 1.90 -0.04 0.00 -1.52 0.00 0.00 31.29 32.74 1fr0 h VAL 765 CO -0.52 0.61 -0.42 -0.08 0.02 0.00 0.00 177.57 177.18 1fr0 h GLU 766 N 0.49 -0.60 -0.68 1.57 4.81 -0.07 0.16 114.58 120.27 1fr0 h GLU 766 Ca -0.02 0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1fr0 h GLU 766 Cb 1.28 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.77 1fr0 h GLU 766 CO 0.14 -0.40 0.45 -0.24 -0.73 0.00 0.00 179.01 178.23 1fr0 h VAL 767 N -0.62 1.17 0.11 0.32 3.04 -1.56 -2.61 116.25 116.10 1fr0 h VAL 767 Ca -0.01 -0.31 0.02 0.00 -1.01 0.00 0.00 66.70 65.39 1fr0 h VAL 767 Cb 0.61 0.18 -0.04 0.00 -2.01 0.00 0.00 31.29 30.03 1fr0 h VAL 767 CO -0.21 0.17 -0.35 0.25 -1.01 0.00 0.00 177.57 176.42 1fr0 h LEU 768 N 0.91 -1.01 -0.87 3.16 5.85 -1.04 0.20 115.31 122.51 1fr0 h LEU 768 Ca 0.25 0.12 0.17 0.00 0.84 0.00 0.00 57.88 59.25 1fr0 h LEU 768 Cb -0.10 0.38 -0.10 0.00 0.37 0.00 0.00 40.66 41.22 1fr0 h LEU 768 CO -0.06 -0.43 0.44 0.50 -0.34 0.00 0.00 178.44 178.55 1fr0 h LYS 769 N -0.57 0.57 -0.19 1.25 1.63 -0.50 -1.24 116.57 117.51 1fr0 h LYS 769 Ca 0.03 -0.03 -0.04 0.00 -0.85 0.00 0.00 60.65 59.76 1fr0 h LYS 769 Cb 0.60 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.10 1fr0 h LYS 769 CO -0.21 0.38 -0.04 0.00 -3.45 0.00 0.00 179.45 176.12 1fr0 h ALA 770 N 1.60 0.27 -0.83 5.00 0.00 -0.91 -2.63 119.26 121.76 1fr0 h ALA 770 Ca 0.49 -0.24 0.21 0.00 0.00 0.00 0.00 54.91 55.36 1fr0 h ALA 770 Cb 0.76 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.34 1fr0 h ALA 770 CO -0.40 0.03 0.10 2.35 0.00 0.00 0.00 179.25 181.34 1fr0 h TRP 771 N 0.09 0.12 -0.17 0.00 7.01 0.58 0.63 115.95 124.21 1fr0 h TRP 771 Ca 0.05 0.05 -0.04 0.00 2.11 0.00 0.00 58.89 61.06 1fr0 h TRP 771 Cb 0.48 0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 27.62 1fr0 h TRP 771 CO 0.05 -0.24 -0.05 0.28 -2.79 0.00 0.00 178.44 175.69 1fr0 h VAL 772 N 0.14 1.29 -0.33 2.65 2.07 -1.39 0.66 116.25 121.35 1fr0 h VAL 772 Ca 0.49 -1.04 -0.05 0.00 0.82 0.00 0.00 66.70 66.93 1fr0 h VAL 772 Cb 0.93 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.31 1fr0 h VAL 772 CO -0.69 0.31 0.01 0.00 0.02 0.00 0.00 177.57 177.22 1fr0 h ALA 773 N 0.71 1.40 0.00 1.67 0.00 -0.58 -0.37 119.26 122.10 1fr0 h ALA 773 Ca 0.04 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1fr0 h ALA 773 Cb 0.50 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1fr0 h ALA 773 CO 0.02 0.42 -0.14 0.87 0.00 0.00 0.00 179.25 180.42 1fr0 h LYS 774 N 0.49 0.00 -0.67 0.00 1.79 0.28 -3.39 116.57 115.07 1fr0 h LYS 774 Ca 0.11 0.00 0.14 0.00 -2.18 0.00 0.00 60.65 58.72 1fr0 h LYS 774 Cb 0.31 0.00 -0.11 0.00 -1.58 0.00 0.00 32.23 30.85 1fr0 h LYS 774 CO 0.01 0.00 0.07 0.00 -1.08 0.00 0.00 179.45 178.45 1fr0 h ALA 775 N -1.72 0.75 -0.14 3.86 0.00 0.20 -3.42 119.26 118.79 1fr0 h ALA 775 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1fr0 h ALA 775 Cb 0.14 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1fr0 h ALA 775 CO 0.00 -0.37 0.00 0.25 0.00 0.00 0.00 179.25 179.13 1fr0 n THR 776 N -5.24 0.00 -4.12 0.00 -2.24 -0.15 -4.42 114.28 98.11 1fr0 n THR 776 Ca 0.11 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.62 1fr0 n THR 776 Cb 0.40 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.59 1fr0 n THR 776 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1fr0 s LYS 777 N 0.00 2.25 0.00 -0.78 1.02 -1.26 -4.72 119.74 116.24 1fr0 s LYS 777 Ca 0.00 -2.06 0.00 0.00 0.02 0.00 0.00 55.97 53.93 1fr0 s LYS 777 Cb 0.00 -1.95 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 1fr0 s LYS 777 CO 0.00 -0.46 0.00 1.17 -0.92 0.00 0.00 175.35 175.14