#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 -1.96 -0.13 12.58 -2.24 -1.26 -4.86 114.28 116.41 1fr0 n THR 655 Ca 0.00 -0.53 -0.27 0.00 -2.27 0.00 0.00 64.05 60.99 1fr0 n THR 655 Cb 0.00 -1.74 -0.09 0.00 -2.10 0.00 0.00 70.33 66.40 1fr0 n THR 655 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fr0 n GLU 656 N -4.57 0.56 0.00 -0.78 1.02 -1.26 -4.95 120.64 110.67 1fr0 n GLU 656 Ca -0.30 0.24 0.00 0.00 -0.02 0.00 0.00 57.16 57.09 1fr0 n GLU 656 Cb 0.68 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 1fr0 n GLU 656 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1fr0 n GLU 657 N -4.22 0.00 -3.96 3.49 2.13 -1.26 -4.49 120.64 112.32 1fr0 n GLU 657 Ca -0.49 0.00 -0.30 0.00 0.66 0.00 0.00 57.16 57.03 1fr0 n GLU 657 Cb 0.84 0.00 -0.14 0.00 0.27 0.00 0.00 31.44 32.40 1fr0 n GLU 657 CO 0.00 0.00 0.00 -0.80 -0.41 0.00 0.00 177.13 175.92 1fr0 s ASN 658 N 0.00 4.49 -0.33 4.31 0.02 -1.26 -4.93 114.94 117.24 1fr0 s ASN 658 Ca 0.00 -2.52 0.07 0.00 -1.02 0.00 0.00 52.86 49.39 1fr0 s ASN 658 Cb 0.00 -1.57 0.65 0.00 0.02 0.00 0.00 41.25 40.35 1fr0 s ASN 658 CO 0.00 -0.31 1.74 -0.24 0.02 0.00 0.00 177.10 178.31 1fr0 n SER 659 N 3.76 4.30 -0.10 -1.22 2.88 -1.26 -4.54 113.62 117.44 1fr0 n SER 659 Ca 0.04 -3.19 0.26 0.00 -1.33 0.00 0.00 58.87 54.65 1fr0 n SER 659 Cb 0.37 -0.75 0.72 0.00 -0.75 0.00 0.00 64.21 63.80 1fr0 n SER 659 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1fr0 h LYS 660 N 1.96 0.00 -2.09 -1.46 3.64 -1.97 -1.50 116.57 115.16 1fr0 h LYS 660 Ca 0.34 0.00 -0.62 0.00 -1.27 0.00 0.00 60.65 59.10 1fr0 h LYS 660 Cb 2.34 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 33.76 1fr0 h LYS 660 CO 0.77 0.00 -0.42 0.43 -2.27 0.00 0.00 179.45 177.96 1fr0 n SER 661 N -4.15 4.96 0.00 4.20 7.64 -1.26 -4.50 113.62 120.51 1fr0 n SER 661 Ca 0.15 -3.70 0.00 0.00 1.01 0.00 0.00 58.87 56.33 1fr0 n SER 661 Cb 0.85 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 1fr0 n SER 661 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24 1fr0 n GLU 662 N -0.30 0.00 0.00 1.43 0.00 -0.83 -4.94 120.64 116.00 1fr0 n GLU 662 Ca 0.35 0.00 0.11 0.00 0.00 0.00 0.00 57.16 57.62 1fr0 n GLU 662 Cb 0.43 0.00 0.05 0.00 0.00 0.00 0.00 31.44 31.93 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1fr0 n ALA 663 N -0.38 4.15 -0.03 4.31 0.00 -0.63 -4.15 120.51 123.78 1fr0 n ALA 663 Ca 0.00 -0.48 -0.02 0.00 0.00 0.00 0.00 53.44 52.94 1fr0 n ALA 663 Cb 0.00 -0.94 -0.14 0.00 0.00 0.00 0.00 19.45 18.38 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 -1.52 0.34 -4.00 0.00 4.77 -1.26 -4.35 117.00 110.98 1fr0 n LEU 664 Ca 0.05 0.15 -0.10 0.00 -0.03 0.00 0.00 56.01 56.08 1fr0 n LEU 664 Cb 0.34 0.24 -0.08 0.00 -2.33 0.00 0.00 43.42 41.59 1fr0 n LEU 664 CO 0.39 0.28 -0.08 -1.48 -1.33 0.00 0.00 177.39 175.17 1fr0 s LEU 665 N -5.43 1.13 -0.28 2.23 0.05 -1.25 -1.73 118.68 113.39 1fr0 s LEU 665 Ca -0.07 -0.94 -0.26 0.00 0.05 0.00 0.00 54.13 52.92 1fr0 s LEU 665 Cb 0.09 1.01 0.00 0.00 -2.05 0.00 0.00 46.19 45.24 1fr0 s LEU 665 CO 0.84 -0.86 0.90 -0.62 -0.55 0.00 0.00 176.35 176.06 1fr0 s ASP 666 N -2.98 6.82 0.05 1.48 -1.08 -0.86 -4.45 116.67 115.65 1fr0 s ASP 666 Ca 0.18 0.93 -0.17 0.00 -0.52 0.00 0.00 52.55 52.98 1fr0 s ASP 666 Cb 0.04 -2.46 -0.18 0.00 -1.46 0.00 0.00 42.92 38.86 1fr0 s ASP 666 CO 0.00 -0.66 1.24 0.40 0.52 0.00 0.00 175.17 176.67 1fr0 h ILE 667 N 5.57 1.35 -0.01 4.11 1.08 -1.92 -2.45 117.51 125.24 1fr0 h ILE 667 Ca -0.22 -1.86 -0.02 0.00 -0.39 0.00 0.00 64.86 62.36 1fr0 h ILE 667 Cb 1.08 2.17 0.00 0.00 -3.07 0.00 0.00 36.82 37.00 1fr0 h ILE 667 CO 0.93 0.57 -0.09 1.55 -0.69 0.00 0.00 178.15 180.42 1fr0 h PRO 668 N 0.19 0.07 -0.89 2.37 0.13 -1.98 -1.41 132.00 130.49 1fr0 h PRO 668 Ca -0.04 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 65.11 1fr0 h PRO 668 Cb 1.20 0.02 -0.07 0.00 0.13 0.00 0.00 31.00 32.28 1fr0 h PRO 668 CO 0.12 0.78 0.54 1.98 -0.23 0.00 0.00 178.00 181.19 1fr0 h MET 669 N -0.61 0.90 -0.26 0.86 4.05 -1.98 0.13 114.93 118.01 1fr0 h MET 669 Ca -0.01 -0.05 -0.08 0.00 -0.28 0.00 0.00 59.70 59.27 1fr0 h MET 669 Cb 0.81 -0.20 -0.01 0.00 -0.80 0.00 0.00 31.60 31.40 1fr0 h MET 669 CO 0.02 0.59 -0.16 -0.07 0.23 0.00 0.00 176.91 177.52 1fr0 h LEU 670 N 0.92 0.60 -0.32 3.39 3.38 -1.47 -0.96 115.31 120.84 1fr0 h LEU 670 Ca 0.41 -0.43 0.01 0.00 0.09 0.00 0.00 57.88 57.97 1fr0 h LEU 670 Cb 0.31 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1fr0 h LEU 670 CO -0.22 0.90 0.18 -0.08 0.09 0.00 0.00 178.44 179.31 1fr0 h GLU 671 N 0.30 0.36 0.46 1.13 4.22 -0.37 -2.14 114.58 118.54 1fr0 h GLU 671 Ca 0.05 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.45 1fr0 h GLU 671 Cb 0.69 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1fr0 h GLU 671 CO 0.05 0.24 -0.22 0.37 -2.18 0.00 0.00 179.01 177.26 1fr0 h GLN 672 N 0.37 -0.60 -0.97 1.92 4.15 -0.73 -2.11 115.11 117.14 1fr0 h GLN 672 Ca 0.13 0.04 0.31 0.00 0.77 0.00 0.00 58.65 59.90 1fr0 h GLN 672 Cb 0.01 0.14 -0.16 0.00 0.21 0.00 0.00 27.48 27.68 1fr0 h GLN 672 CO -0.06 -0.34 0.40 1.88 -1.93 0.00 0.00 178.83 178.78 1fr0 h TYR 673 N -0.74 0.63 -0.08 3.99 -1.99 -1.02 1.75 116.97 119.51 1fr0 h TYR 673 Ca -0.06 0.05 -0.10 0.00 2.00 0.00 0.00 58.73 60.62 1fr0 h TYR 673 Cb 0.53 -0.12 -0.01 0.00 2.00 0.00 0.00 36.73 39.13 1fr0 h TYR 673 CO -0.02 -0.28 -0.39 -0.07 -0.00 0.00 0.00 178.16 177.41 1fr0 h LEU 674 N 0.19 0.17 0.00 3.88 3.38 -1.04 -1.55 115.31 120.33 1fr0 h LEU 674 Ca 0.69 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.60 1fr0 h LEU 674 Cb 1.57 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.28 1fr0 h LEU 674 CO -0.69 0.54 0.00 1.21 0.09 0.00 0.00 178.44 179.59 1fr0 n GLU 675 N -4.05 0.64 0.00 1.13 4.07 0.59 -2.12 120.64 120.89 1fr0 n GLU 675 Ca -0.01 0.02 -0.01 0.00 -0.06 0.00 0.00 57.16 57.10 1fr0 n GLU 675 Cb 0.45 -1.50 -0.00 0.00 -0.06 0.00 0.00 31.44 30.33 1fr0 n GLU 675 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1fr0 n LEU 676 N -1.08 0.32 -0.01 4.31 4.77 -0.72 -4.87 117.00 119.72 1fr0 n LEU 676 Ca 0.16 0.05 0.09 0.00 -0.03 0.00 0.00 56.01 56.27 1fr0 n LEU 676 Cb 0.11 -0.23 -0.13 0.00 -2.33 0.00 0.00 43.42 40.84 1fr0 n LEU 676 CO 0.15 -0.52 -0.62 0.52 -1.33 0.00 0.00 177.39 175.59 1fr0 n VAL 677 N -2.80 0.00 -2.61 4.08 0.31 -0.67 -5.10 118.33 111.54 1fr0 n VAL 677 Ca -0.01 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.96 1fr0 n VAL 677 Cb 0.04 0.22 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 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 1.50 -1.18 0.00 2.92 0.00 -0.90 -3.80 105.19 103.73 1fr0 n GLY 678 Ca -0.02 -1.49 0.10 0.00 0.00 0.00 0.00 46.02 44.61 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 0.50 -0.02 1.61 -0.04 -1.26 -3.44 135.00 132.35 1fr0 n PRO 679 Ca 0.00 0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.37 1fr0 n PRO 679 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 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 0.04 -0.10 0.54 3.11 -1.96 0.49 116.57 118.68 1fr0 h LYS 680 Ca 0.00 -0.02 -0.09 0.00 -2.81 0.00 0.00 60.65 57.73 1fr0 h LYS 680 Cb 0.08 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.32 1fr0 h LYS 680 CO 0.00 0.49 -0.30 1.25 -2.81 0.00 0.00 179.45 178.08 1fr0 h LEU 681 N -0.40 0.44 -0.58 5.20 5.85 -1.77 0.16 115.31 124.21 1fr0 h LEU 681 Ca 0.00 -0.60 -0.03 0.00 0.84 0.00 0.00 57.88 58.10 1fr0 h LEU 681 Cb 0.48 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1fr0 h LEU 681 CO 0.00 0.96 0.24 0.40 -0.34 0.00 0.00 178.44 179.71 1fr0 h ILE 682 N -0.05 1.22 -0.14 4.05 5.03 -1.65 0.81 117.51 126.79 1fr0 h ILE 682 Ca -0.01 -0.68 -0.21 0.00 -0.12 0.00 0.00 64.86 63.84 1fr0 h ILE 682 Cb 0.91 0.58 0.00 0.00 -3.03 0.00 0.00 36.82 35.29 1fr0 h ILE 682 CO 0.06 0.27 -0.74 0.74 -0.68 0.00 0.00 178.15 177.80 1fr0 h THR 683 N 0.80 1.31 0.32 -0.27 2.02 -0.93 -2.31 112.91 113.86 1fr0 h THR 683 Ca 0.20 -2.01 -0.02 0.00 0.77 0.00 0.00 66.41 65.35 1fr0 h THR 683 Cb 0.18 2.00 0.00 0.00 -1.74 0.00 0.00 68.15 68.60 1fr0 h THR 683 CO -0.02 0.63 -0.16 -0.78 0.37 0.00 0.00 175.52 175.56 1fr0 h ASP 684 N 0.45 -0.37 -0.27 4.18 3.58 -0.77 -0.59 116.42 122.63 1fr0 h ASP 684 Ca -0.04 0.01 0.06 0.00 0.42 0.00 0.00 57.03 57.49 1fr0 h ASP 684 Cb 1.35 0.10 -0.08 0.00 1.72 0.00 0.00 39.33 42.42 1fr0 h ASP 684 CO 0.14 -0.11 -0.35 1.23 -2.88 0.00 0.00 179.24 177.27 1fr0 h GLY 685 N -0.74 -0.41 0.47 -0.78 0.00 -0.97 -0.26 103.07 100.38 1fr0 h GLY 685 Ca -0.04 0.44 0.10 0.00 0.00 0.00 0.00 47.33 47.82 1fr0 h GLY 685 CO 0.07 -0.21 0.39 -2.00 0.00 0.00 0.00 176.54 174.79 1fr0 h LEU 686 N -0.34 0.52 -0.18 3.11 5.85 -1.51 -2.52 115.31 120.24 1fr0 h LEU 686 Ca 0.13 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.93 1fr0 h LEU 686 Cb 0.56 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 1fr0 h LEU 686 CO -0.46 0.29 -0.38 0.00 -0.34 0.00 0.00 178.44 177.55 1fr0 h ALA 687 N 1.44 -0.70 -0.90 1.25 0.00 0.63 0.27 119.26 121.25 1fr0 h ALA 687 Ca 0.37 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.45 1fr0 h ALA 687 Cb 0.39 0.93 -0.07 0.00 0.00 0.00 0.00 17.79 19.04 1fr0 h ALA 687 CO -0.27 -0.85 0.59 0.28 0.00 0.00 0.00 179.25 179.00 1fr0 h VAL 688 N -0.34 0.70 0.54 0.00 2.07 -1.18 -2.07 116.25 115.96 1fr0 h VAL 688 Ca 0.03 -0.15 -0.03 0.00 0.82 0.00 0.00 66.70 67.37 1fr0 h VAL 688 Cb 0.44 0.21 0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1fr0 h VAL 688 CO -0.35 0.08 -0.26 0.15 0.02 0.00 0.00 177.57 177.21 1fr0 h PHE 689 N 0.45 -0.67 -0.10 1.57 3.57 -0.33 -2.37 116.94 119.05 1fr0 h PHE 689 Ca 0.47 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.98 1fr0 h PHE 689 Cb 1.11 0.22 -0.00 0.00 2.79 0.00 0.00 35.95 40.06 1fr0 h PHE 689 CO -0.00 -0.35 0.45 0.93 -2.23 0.00 0.00 178.31 177.10 1fr0 h GLU 690 N -1.07 0.00 0.15 1.11 5.08 -0.01 0.30 114.58 120.14 1fr0 h GLU 690 Ca -0.07 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.08 1fr0 h GLU 690 Cb 0.62 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.90 1fr0 h GLU 690 CO 0.12 0.00 -0.91 -0.22 -1.00 0.00 0.00 179.01 177.00 1fr0 h LYS 691 N 0.00 0.32 -0.68 2.33 3.11 -1.06 -3.33 116.57 117.26 1fr0 h LYS 691 Ca 0.05 -0.55 0.00 0.00 -2.81 0.00 0.00 60.65 57.34 1fr0 h LYS 691 Cb 0.94 0.20 0.00 0.00 -1.00 0.00 0.00 32.23 32.37 1fr0 h LYS 691 CO -0.00 1.26 0.00 -1.33 -2.81 0.00 0.00 179.45 176.57 1fr0 n MET 692 N -4.07 3.65 -0.03 1.90 0.00 -0.07 -4.44 117.12 114.05 1fr0 n MET 692 Ca -0.15 -2.89 -0.13 0.00 0.00 0.00 0.00 57.70 54.53 1fr0 n MET 692 Cb 0.86 -1.87 -0.11 0.00 0.00 0.00 0.00 33.22 32.10 1fr0 n MET 692 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 175.97 177.95 1fr0 h MET 693 N 4.22 0.03 -0.07 0.03 4.05 -0.61 -1.00 114.93 121.59 1fr0 h MET 693 Ca 0.00 -0.03 -0.14 0.00 -0.28 0.00 0.00 59.70 59.26 1fr0 h MET 693 Cb 1.42 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.21 1fr0 h MET 693 CO 0.21 0.67 -0.57 -1.00 0.23 0.00 0.00 176.91 176.45 1fr0 h PRO 694 N -0.60 0.21 -0.08 0.39 0.13 -1.79 -2.70 132.00 127.55 1fr0 h PRO 694 Ca -0.00 -0.13 -0.16 0.00 -0.87 0.00 0.00 66.00 64.84 1fr0 h PRO 694 Cb 0.67 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 1fr0 h PRO 694 CO 0.01 0.72 -0.63 0.78 -0.23 0.00 0.00 178.00 178.64 1fr0 h GLY 695 N 1.47 0.33 0.76 1.56 0.00 -1.78 -2.64 103.07 102.78 1fr0 h GLY 695 Ca -0.00 -0.43 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 1fr0 h GLY 695 CO 0.09 0.38 -0.37 -0.97 0.00 0.00 0.00 176.54 175.67 1fr0 h TYR 696 N 0.22 -0.95 -0.91 5.60 0.05 -0.97 -2.60 116.97 117.41 1fr0 h TYR 696 Ca -0.01 -0.02 0.20 0.00 0.05 0.00 0.00 58.73 58.94 1fr0 h TYR 696 Cb 1.16 0.31 -0.11 0.00 1.01 0.00 0.00 36.73 39.10 1fr0 h TYR 696 CO 0.03 -0.59 0.47 -0.39 -1.05 0.00 0.00 178.16 176.63 1fr0 h VAL 697 N -1.21 0.60 -0.37 -2.88 -1.51 -1.55 0.81 116.25 110.14 1fr0 h VAL 697 Ca -0.10 -0.19 0.08 0.00 -1.23 0.00 0.00 66.70 65.25 1fr0 h VAL 697 Cb 0.78 -0.00 -0.08 0.00 -2.13 0.00 0.00 31.29 29.86 1fr0 h VAL 697 CO 0.17 0.10 -0.19 -1.28 -1.23 0.00 0.00 177.57 175.15 1fr0 h SER 698 N 0.56 -0.63 -0.09 4.19 0.87 -1.30 0.15 113.55 117.29 1fr0 h SER 698 Ca 0.54 0.14 -0.08 0.00 -1.23 0.00 0.00 61.79 61.17 1fr0 h SER 698 Cb 0.93 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 63.21 1fr0 h SER 698 CO -0.44 -0.22 -0.17 0.58 -0.53 0.00 0.00 176.83 176.05 1fr0 h VAL 699 N -0.12 1.24 0.30 2.23 2.07 -0.55 -1.42 116.25 120.00 1fr0 h VAL 699 Ca 0.18 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.63 1fr0 h VAL 699 Cb 0.41 1.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.36 1fr0 h VAL 699 CO -0.45 0.35 -0.43 -0.07 0.02 0.00 0.00 177.57 176.99 1fr0 h LEU 700 N 0.42 -1.21 -1.09 2.57 4.07 0.12 0.58 115.31 120.77 1fr0 h LEU 700 Ca 0.07 0.11 -0.05 0.00 0.08 0.00 0.00 57.88 58.09 1fr0 h LEU 700 Cb 0.54 0.43 -0.02 0.00 1.08 0.00 0.00 40.66 42.68 1fr0 h LEU 700 CO 0.03 -0.55 0.04 -0.33 -1.08 0.00 0.00 178.44 176.56 1fr0 h GLU 701 N -0.78 0.69 -0.28 1.13 5.08 -1.13 -1.26 114.58 118.01 1fr0 h GLU 701 Ca -0.02 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1fr0 h GLU 701 Cb 0.74 -0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 1fr0 h GLU 701 CO -0.14 0.67 -0.02 0.77 -1.00 0.00 0.00 179.01 179.30 1fr0 h SER 702 N 0.66 -0.15 0.23 1.42 0.02 -0.42 -1.24 113.55 114.07 1fr0 h SER 702 Ca 0.14 0.07 -0.12 0.00 -0.84 0.00 0.00 61.79 61.04 1fr0 h SER 702 Cb 0.34 0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1fr0 h SER 702 CO 0.01 -0.04 -0.45 0.78 -1.14 0.00 0.00 176.83 175.99 1fr0 h ASN 703 N 0.07 0.29 -0.62 3.07 4.21 -0.61 -3.07 115.58 118.92 1fr0 h ASN 703 Ca 0.14 -0.13 0.13 0.00 1.21 0.00 0.00 56.30 57.65 1fr0 h ASN 703 Cb 0.19 -0.08 -0.10 0.00 -1.12 0.00 0.00 38.32 37.20 1fr0 h ASN 703 CO -0.24 0.70 0.02 0.25 -1.29 0.00 0.00 177.43 176.87 1fr0 h LEU 704 N 0.22 -0.23 -0.99 1.61 7.12 -0.02 0.22 115.31 123.24 1fr0 h LEU 704 Ca 0.02 0.15 -0.02 0.00 0.13 0.00 0.00 57.88 58.15 1fr0 h LEU 704 Cb 0.88 0.26 -0.04 0.00 -0.53 0.00 0.00 40.66 41.23 1fr0 h LEU 704 CO 0.07 -0.10 0.41 0.71 -0.13 0.00 0.00 178.44 179.40 1fr0 h THR 705 N 0.14 1.24 0.00 1.05 1.35 -1.38 -0.44 112.91 114.87 1fr0 h THR 705 Ca 0.33 -0.64 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1fr0 h THR 705 Cb 0.53 0.20 0.00 0.00 -1.73 0.00 0.00 68.15 67.15 1fr0 h THR 705 CO -0.52 0.28 0.00 0.00 -0.25 0.00 0.00 175.52 175.03 1fr0 n ALA 706 N -2.42 2.60 -3.11 6.62 0.00 0.53 -4.87 120.51 119.86 1fr0 n ALA 706 Ca 0.08 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.18 1fr0 n ALA 706 Cb 0.12 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 18.30 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 -0.81 -5.36 -2.13 0.00 3.00 0.18 -4.87 117.38 107.39 1fr0 n GLN 707 Ca 0.15 0.86 -0.42 0.00 -0.01 0.00 0.00 57.00 57.57 1fr0 n GLN 707 Cb 0.07 -5.68 0.00 0.00 0.00 0.00 0.00 30.24 24.62 1fr0 n GLN 707 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1fr0 n ASP 708 N -2.45 4.45 0.02 1.08 9.92 -0.58 -4.79 116.55 124.20 1fr0 n ASP 708 Ca -0.08 -2.92 -0.01 0.00 -0.53 0.00 0.00 54.79 51.24 1fr0 n ASP 708 Cb 0.60 -1.63 -0.00 0.00 -0.64 0.00 0.00 41.12 39.45 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.11 0.13 0.00 0.00 177.20 177.44 1fr0 h LYS 709 N 6.36 -0.06 -0.97 -1.24 1.57 -1.89 -0.49 116.57 119.86 1fr0 h LYS 709 Ca 0.49 0.00 0.25 0.00 -1.87 0.00 0.00 60.65 59.53 1fr0 h LYS 709 Cb 0.70 0.01 -0.18 0.00 0.08 0.00 0.00 32.23 32.85 1fr0 h LYS 709 CO 1.69 -0.04 -0.00 -0.22 -0.57 0.00 0.00 179.45 180.31 1fr0 h LYS 710 N -0.07 0.02 0.03 3.15 3.64 -2.00 0.37 116.57 121.71 1fr0 h LYS 710 Ca -0.01 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1fr0 h LYS 710 Cb 0.05 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1fr0 h LYS 710 CO 0.01 0.01 -0.01 0.78 -2.27 0.00 0.00 179.45 177.97 1fr0 h GLY 711 N 0.02 -0.04 0.81 5.01 0.00 -1.94 -2.36 103.07 104.57 1fr0 h GLY 711 Ca 0.57 0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.94 1fr0 h GLY 711 CO -0.91 -0.01 0.02 -2.22 0.00 0.00 0.00 176.54 173.41 1fr0 h ILE 712 N -0.13 0.92 -0.50 2.60 2.04 0.13 -1.91 117.51 120.66 1fr0 h ILE 712 Ca -0.00 -0.03 0.10 0.00 1.00 0.00 0.00 64.86 65.93 1fr0 h ILE 712 Cb 0.12 0.84 -0.08 0.00 -0.74 0.00 0.00 36.82 36.96 1fr0 h ILE 712 CO 0.01 0.01 -0.01 0.58 0.00 0.00 0.00 178.15 178.74 1fr0 h VAL 713 N 0.07 0.59 -0.20 1.67 2.07 -0.73 0.16 116.25 119.88 1fr0 h VAL 713 Ca 0.07 -0.04 0.01 0.00 0.82 0.00 0.00 66.70 67.56 1fr0 h VAL 713 Cb 0.07 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1fr0 h VAL 713 CO -0.10 0.02 0.10 -0.08 0.02 0.00 0.00 177.57 177.53 1fr0 h GLU 714 N 0.11 0.21 0.00 1.57 4.22 -1.04 0.52 114.58 120.16 1fr0 h GLU 714 Ca 0.25 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.68 1fr0 h GLU 714 Cb 0.39 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1fr0 h GLU 714 CO -0.43 0.14 0.00 0.39 -2.18 0.00 0.00 179.01 176.93 1fr0 n GLU 715 N -5.00 0.06 0.00 1.92 -0.58 -0.63 -1.73 120.64 114.68 1fr0 n GLU 715 Ca -0.03 0.25 -0.01 0.00 -0.42 0.00 0.00 57.16 56.95 1fr0 n GLU 715 Cb 0.05 -1.50 -0.00 0.00 -0.57 0.00 0.00 31.44 29.42 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 2.15 -0.05 2.00 0.62 0.00 0.16 -2.68 103.07 105.28 1fr0 h GLY 716 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1fr0 h GLY 716 CO 0.00 -0.02 0.00 1.12 0.00 0.00 0.00 176.54 177.64 1fr0 h HIS 717 N -0.37 0.00 0.01 5.60 2.07 -1.52 -1.70 115.15 119.24 1fr0 h HIS 717 Ca -0.00 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.51 1fr0 h HIS 717 Cb 0.03 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.01 1fr0 h HIS 717 CO 0.01 0.00 -0.01 -0.22 -3.07 0.00 0.00 177.93 174.65 1fr0 h LYS 718 N 0.00 -0.02 0.09 5.12 1.63 -1.45 -2.75 116.57 119.20 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 0.37 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.00 1fr0 h LYS 718 CO 0.00 0.76 -0.04 0.82 -3.45 0.00 0.00 179.45 177.53 1fr0 h ILE 719 N -0.84 0.00 -1.12 2.00 5.03 -1.38 -2.75 117.51 118.46 1fr0 h ILE 719 Ca -0.00 -0.64 0.31 0.00 -0.12 0.00 0.00 64.86 64.41 1fr0 h ILE 719 Cb 0.78 0.00 -0.09 0.00 -3.03 0.00 0.00 36.82 34.48 1fr0 h ILE 719 CO 0.00 0.00 0.74 0.11 -0.68 0.00 0.00 178.15 178.32 1fr0 h LYS 720 N -0.76 0.25 0.11 2.37 6.56 -1.51 0.89 116.57 124.48 1fr0 h LYS 720 Ca -0.01 -0.01 -0.01 0.00 -1.06 0.00 0.00 60.65 59.56 1fr0 h LYS 720 Cb 0.10 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 1fr0 h LYS 720 CO 0.02 0.16 -0.05 0.78 -2.06 0.00 0.00 179.45 178.30 1fr0 h GLY 721 N 0.25 -0.16 0.23 3.86 0.00 -1.57 -1.89 103.07 103.80 1fr0 h GLY 721 Ca 0.62 0.06 0.01 0.00 0.00 0.00 0.00 47.33 48.02 1fr0 h GLY 721 CO -0.24 -0.06 -0.49 0.00 0.00 0.00 0.00 176.54 175.76 1fr0 h ALA 722 N 0.35 -0.92 -0.80 3.60 0.00 -0.53 -1.65 119.26 119.32 1fr0 h ALA 722 Ca -0.02 -0.11 0.16 0.00 0.00 0.00 0.00 54.91 54.95 1fr0 h ALA 722 Cb 0.39 0.81 -0.10 0.00 0.00 0.00 0.00 17.79 18.89 1fr0 h ALA 722 CO 0.03 -1.08 0.34 0.00 0.00 0.00 0.00 179.25 178.54 1fr0 h ALA 723 N -0.44 1.18 -0.79 0.00 0.00 -1.42 0.26 119.26 118.06 1fr0 h ALA 723 Ca -0.00 0.12 0.22 0.00 0.00 0.00 0.00 54.91 55.24 1fr0 h ALA 723 Cb 0.75 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1fr0 h ALA 723 CO -0.25 -0.21 0.56 0.78 0.00 0.00 0.00 179.25 180.13 1fr0 h GLY 724 N 0.47 0.16 1.70 0.00 0.00 -0.46 0.27 103.07 105.21 1fr0 h GLY 724 Ca 0.45 -0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.71 1fr0 h GLY 724 CO -0.42 0.00 -0.01 0.23 0.00 0.00 0.00 176.54 176.34 1fr0 h SER 725 N 0.08 0.35 -0.06 0.19 0.87 -0.13 -0.17 113.55 114.68 1fr0 h SER 725 Ca 0.38 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1fr0 h SER 725 Cb 1.40 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.27 1fr0 h SER 725 CO -0.03 0.42 0.00 0.52 -0.53 0.00 0.00 176.83 177.20 1fr0 n VAL 726 N -4.33 0.08 0.00 2.23 0.31 0.90 -4.79 118.33 112.74 1fr0 n VAL 726 Ca 0.01 -0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1fr0 n VAL 726 Cb 0.21 -0.05 0.00 0.00 -0.91 0.00 0.00 33.84 33.09 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 0.78 1.06 3.21 2.92 0.00 -0.09 -4.94 105.19 108.14 1fr0 n GLY 727 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1fr0 n GLY 727 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fr0 n LEU 728 N 0.00 5.82 0.16 0.99 0.00 -0.85 -2.03 117.00 121.08 1fr0 n LEU 728 Ca 0.00 -4.51 0.04 0.00 0.00 0.00 0.00 56.01 51.54 1fr0 n LEU 728 Cb 0.00 -1.57 0.18 0.00 0.00 0.00 0.00 43.42 42.03 1fr0 n LEU 728 CO 0.00 0.98 0.57 0.08 0.00 0.00 0.00 177.39 179.02 1fr0 h ARG 729 N 6.56 0.00 -0.29 1.96 0.11 -1.66 -2.71 114.38 118.35 1fr0 h ARG 729 Ca 0.36 0.00 0.03 0.00 0.10 0.00 0.00 59.98 60.47 1fr0 h ARG 729 Cb 0.77 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.82 1fr0 h ARG 729 CO 1.42 0.45 0.11 1.25 0.10 0.00 0.00 179.97 183.29 1fr0 h HIS 730 N 0.00 0.20 -0.05 4.08 2.76 -1.53 -1.70 115.15 118.91 1fr0 h HIS 730 Ca -0.00 0.01 -0.21 0.00 -2.20 0.00 0.00 60.37 57.97 1fr0 h HIS 730 Cb 1.15 -0.04 0.01 0.00 1.55 0.00 0.00 27.41 30.08 1fr0 h HIS 730 CO 0.00 0.09 -0.79 -0.07 -1.30 0.00 0.00 177.93 175.86 1fr0 h LEU 731 N 0.24 0.79 -1.80 0.26 -0.00 -1.78 -2.80 115.31 110.22 1fr0 h LEU 731 Ca 0.13 -0.70 0.24 0.00 -0.00 0.00 0.00 57.88 57.55 1fr0 h LEU 731 Cb 0.09 -0.24 -0.05 0.00 -0.00 0.00 0.00 40.66 40.46 1fr0 h LEU 731 CO -0.13 1.38 0.64 -0.61 -0.00 0.00 0.00 178.44 179.72 1fr0 h GLN 732 N 0.27 0.15 0.00 1.13 -0.00 -1.22 -1.40 115.11 114.04 1fr0 h GLN 732 Ca -0.08 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.56 1fr0 h GLN 732 Cb 1.45 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 28.90 1fr0 h GLN 732 CO 0.16 0.10 -0.00 1.96 0.00 0.00 0.00 178.83 181.05 1fr0 h GLN 733 N 0.16 -0.00 -0.86 1.69 4.20 -1.24 -2.48 115.11 116.57 1fr0 h GLN 733 Ca 0.46 0.00 0.20 0.00 0.06 0.00 0.00 58.65 59.36 1fr0 h GLN 733 Cb 1.54 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 29.16 1fr0 h GLN 733 CO -0.08 0.91 -0.07 -0.07 -0.67 0.00 0.00 178.83 178.84 1fr0 h LEU 734 N -0.96 -0.55 -0.08 1.46 4.07 -1.00 0.14 115.31 118.38 1fr0 h LEU 734 Ca -0.00 0.24 -0.04 0.00 0.08 0.00 0.00 57.88 58.17 1fr0 h LEU 734 Cb 0.91 0.45 -0.00 0.00 1.08 0.00 0.00 40.66 43.11 1fr0 h LEU 734 CO 0.00 -0.26 -0.08 1.23 -1.08 0.00 0.00 178.44 178.24 1fr0 h GLY 735 N 0.04 0.22 -1.23 0.83 0.00 -1.55 -1.49 103.07 99.90 1fr0 h GLY 735 Ca 0.46 -0.23 0.46 0.00 0.00 0.00 0.00 47.33 48.02 1fr0 h GLY 735 CO -0.82 0.21 1.11 1.46 0.00 0.00 0.00 176.54 178.51 1fr0 h GLN 736 N -0.22 0.03 0.07 4.80 4.20 -0.28 0.74 115.11 124.44 1fr0 h GLN 736 Ca 0.01 -0.00 -0.33 0.00 0.06 0.00 0.00 58.65 58.39 1fr0 h GLN 736 Cb 0.60 -0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.34 1fr0 h GLN 736 CO 0.02 0.02 -1.87 1.04 -0.67 0.00 0.00 178.83 177.37 1fr0 n GLN 737 N -4.17 0.70 0.17 1.46 3.00 -0.59 -3.82 117.38 114.13 1fr0 n GLN 737 Ca 0.36 0.28 0.11 0.00 -0.01 0.00 0.00 57.00 57.74 1fr0 n GLN 737 Cb 1.63 -1.75 0.58 0.00 0.00 0.00 0.00 30.24 30.70 1fr0 n GLN 737 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1fr0 n ILE 738 N -3.27 0.99 1.72 5.09 5.41 0.25 -1.08 119.36 128.46 1fr0 n ILE 738 Ca -0.25 0.74 0.05 0.00 1.00 0.00 0.00 62.75 64.29 1fr0 n ILE 738 Cb 1.05 -1.74 0.29 0.00 -0.71 0.00 0.00 39.64 38.53 1fr0 n ILE 738 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 176.55 178.22 1fr0 n GLN 739 N -2.25 0.86 -2.63 0.38 0.00 -0.72 -3.70 117.38 109.32 1fr0 n GLN 739 Ca -0.01 0.00 -0.23 0.00 -0.00 0.00 0.00 57.00 56.75 1fr0 n GLN 739 Cb 0.06 -1.18 -0.00 0.00 0.00 0.00 0.00 30.24 29.12 1fr0 n GLN 739 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.06 175.93 1fr0 n SER 740 N -0.68 3.89 -2.76 1.69 3.41 -0.24 -4.93 113.62 114.00 1fr0 n SER 740 Ca 0.07 -3.50 -0.09 0.00 -0.26 0.00 0.00 58.87 55.09 1fr0 n SER 740 Cb 0.03 -0.50 -0.03 0.00 -0.26 0.00 0.00 64.21 63.46 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 -0.33 1.00 0.00 4.33 -0.04 -1.24 -2.75 135.00 135.97 1fr0 n PRO 741 Ca 0.32 -0.75 0.00 0.00 -0.04 0.00 0.00 63.50 63.03 1fr0 n PRO 741 Cb 0.64 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.10 1fr0 n PRO 741 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1fr0 n ASP 742 N 3.77 0.14 -4.78 3.54 2.03 -1.26 -4.96 116.55 115.04 1fr0 n ASP 742 Ca 0.21 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 55.12 1fr0 n ASP 742 Cb 0.18 0.02 0.00 0.00 -0.72 0.00 0.00 41.12 40.61 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1fr0 s LEU 743 N -0.28 4.26 0.55 -2.67 1.02 -1.11 -4.85 118.68 115.61 1fr0 s LEU 743 Ca 0.00 3.03 0.36 0.00 0.02 0.00 0.00 54.13 57.55 1fr0 s LEU 743 Cb 0.00 -3.74 1.75 0.00 0.02 0.00 0.00 46.19 44.23 1fr0 s LEU 743 CO 0.00 -0.97 2.09 1.55 0.02 0.00 0.00 176.35 179.05 1fr0 h PRO 744 N 2.81 0.00 0.00 1.29 0.13 -1.98 -2.18 132.00 132.07 1fr0 h PRO 744 Ca -0.51 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 1fr0 h PRO 744 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1fr0 h PRO 744 CO 0.63 0.00 -1.81 0.00 -0.23 0.00 0.00 178.00 176.59 1fr0 n ALA 745 N -2.03 3.01 -0.04 -0.56 0.00 -1.26 -4.40 120.51 115.22 1fr0 n ALA 745 Ca -0.01 -0.50 -0.15 0.00 0.00 0.00 0.00 53.44 52.78 1fr0 n ALA 745 Cb 0.18 -0.71 -0.08 0.00 0.00 0.00 0.00 19.45 18.85 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 0.68 0.00 0.00 7.01 -1.75 0.34 115.95 122.22 1fr0 h TRP 746 Ca 0.00 -0.27 0.00 0.00 2.11 0.00 0.00 58.89 60.73 1fr0 h TRP 746 Cb 0.88 -0.12 0.00 0.00 -2.10 0.00 0.00 29.16 27.82 1fr0 h TRP 746 CO 0.00 1.02 0.00 -1.91 -2.79 0.00 0.00 178.44 174.76 1fr0 n GLU 747 N -4.29 0.14 0.00 2.65 2.13 -1.13 -0.20 120.64 119.94 1fr0 n GLU 747 Ca -0.07 0.62 0.05 0.00 0.66 0.00 0.00 57.16 58.42 1fr0 n GLU 747 Cb 0.54 -1.94 -0.04 0.00 0.27 0.00 0.00 31.44 30.28 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 -2.23 0.83 -0.01 4.31 -0.08 -1.01 -4.48 116.55 113.87 1fr0 n ASP 748 Ca -0.01 -0.91 0.07 0.00 -1.51 0.00 0.00 54.79 52.43 1fr0 n ASP 748 Cb 0.05 0.78 -0.11 0.00 2.34 0.00 0.00 41.12 44.17 1fr0 n ASP 748 CO 0.00 0.00 0.00 0.59 0.12 0.00 0.00 177.20 177.91 1fr0 n ASN 749 N -0.82 1.63 -0.22 1.67 3.02 0.08 -4.57 115.26 116.05 1fr0 n ASN 749 Ca 0.03 -0.05 -0.03 0.00 -0.03 0.00 0.00 54.58 54.50 1fr0 n ASN 749 Cb 0.19 1.63 0.03 0.00 -0.61 0.00 0.00 39.78 41.02 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 1fr0 h VAL 750 N 0.00 0.20 -0.81 2.41 2.07 -0.81 0.16 116.25 119.48 1fr0 h VAL 750 Ca 0.00 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.69 1fr0 h VAL 750 Cb 0.64 0.20 -0.15 0.00 -1.52 0.00 0.00 31.29 30.46 1fr0 h VAL 750 CO 0.00 0.00 -0.17 1.23 0.02 0.00 0.00 177.57 178.65 1fr0 h GLY 751 N -0.11 0.65 2.00 2.17 0.00 -1.85 1.20 103.07 107.13 1fr0 h GLY 751 Ca 0.27 0.24 -0.06 0.00 0.00 0.00 0.00 47.33 47.78 1fr0 h GLY 751 CO -0.70 -0.32 -0.29 0.83 0.00 0.00 0.00 176.54 176.07 1fr0 h GLU 752 N 0.01 0.00 0.35 4.80 5.08 -1.06 -2.69 114.58 121.08 1fr0 h GLU 752 Ca 0.40 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.75 1fr0 h GLU 752 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1fr0 h GLU 752 CO -0.82 0.29 -0.17 2.35 -1.00 0.00 0.00 179.01 179.66 1fr0 h TRP 753 N 0.00 -0.44 -0.54 4.33 2.91 0.33 -1.82 115.95 120.72 1fr0 h TRP 753 Ca -0.00 -0.01 0.01 0.00 1.13 0.00 0.00 58.89 60.02 1fr0 h TRP 753 Cb 0.75 0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 29.52 1fr0 h TRP 753 CO 0.00 -0.10 0.35 0.82 -1.03 0.00 0.00 178.44 178.48 1fr0 h ILE 754 N -0.90 1.12 0.29 2.65 2.04 -1.14 -0.38 117.51 121.19 1fr0 h ILE 754 Ca -0.05 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.56 1fr0 h ILE 754 Cb 0.53 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1fr0 h ILE 754 CO 0.08 0.13 -0.23 -0.33 0.00 0.00 0.00 178.15 177.80 1fr0 h GLU 755 N 0.71 -0.51 -0.61 2.37 5.08 -1.52 -2.28 114.58 117.83 1fr0 h GLU 755 Ca 0.20 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 1fr0 h GLU 755 Cb -0.06 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1fr0 h GLU 755 CO -0.05 -0.34 0.40 1.49 -1.00 0.00 0.00 179.01 179.50 1fr0 h GLU 756 N -0.53 0.80 -0.37 2.33 4.81 -1.17 -2.41 114.58 118.05 1fr0 h GLU 756 Ca -0.02 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.24 1fr0 h GLU 756 Cb 0.47 -0.18 -0.07 0.00 0.63 0.00 0.00 28.75 29.59 1fr0 h GLU 756 CO -0.02 0.54 -0.12 1.98 -0.73 0.00 0.00 179.01 180.66 1fr0 h MET 757 N 0.82 -0.04 0.65 1.92 4.05 -0.81 -2.72 114.93 118.80 1fr0 h MET 757 Ca 0.22 0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.61 1fr0 h MET 757 Cb -0.08 0.01 0.01 0.00 -0.80 0.00 0.00 31.60 30.73 1fr0 h MET 757 CO -0.05 -0.03 -0.31 -0.22 0.23 0.00 0.00 176.91 176.53 1fr0 h LYS 758 N -0.04 -0.85 -2.36 0.39 3.64 -1.17 -0.24 116.57 115.95 1fr0 h LYS 758 Ca 0.18 0.06 -0.39 0.00 -1.27 0.00 0.00 60.65 59.23 1fr0 h LYS 758 Cb 0.32 0.19 -0.05 0.00 -0.41 0.00 0.00 32.23 32.29 1fr0 h LYS 758 CO -0.40 -0.54 1.18 -1.91 -2.27 0.00 0.00 179.45 175.51 1fr0 n GLU 759 N -5.44 2.69 0.00 1.90 2.13 -0.93 -3.63 120.64 117.36 1fr0 n GLU 759 Ca -0.13 -1.57 0.00 0.00 0.66 0.00 0.00 57.16 56.12 1fr0 n GLU 759 Cb 0.37 -2.30 0.00 0.00 0.27 0.00 0.00 31.44 29.78 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 2.73 0.00 -0.07 5.31 4.07 -1.07 -4.90 120.64 126.72 1fr0 n GLU 760 Ca 0.56 0.00 -0.08 0.00 -0.06 0.00 0.00 57.16 57.58 1fr0 n GLU 760 Cb 0.64 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 32.01 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 0.24 -0.19 4.31 5.08 -1.10 -2.65 115.95 121.63 1fr0 h TRP 761 Ca 0.00 0.01 0.05 0.00 1.08 0.00 0.00 58.89 60.04 1fr0 h TRP 761 Cb 0.00 -0.07 -0.06 0.00 -3.00 0.00 0.00 29.16 26.03 1fr0 h TRP 761 CO 0.00 0.13 -0.24 -0.09 -1.28 0.00 0.00 178.44 176.96 1fr0 h ARG 762 N 0.28 -0.26 -0.49 0.12 2.43 -1.82 -1.83 114.38 112.80 1fr0 h ARG 762 Ca 0.11 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.39 1fr0 h ARG 762 Cb 0.04 0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 29.55 1fr0 h ARG 762 CO -0.08 -0.17 -0.32 1.25 -1.51 0.00 0.00 179.97 179.14 1fr0 h HIS 763 N -0.27 -0.88 -1.00 2.20 2.76 -1.85 0.22 115.15 116.33 1fr0 h HIS 763 Ca 0.12 0.06 0.19 0.00 -2.20 0.00 0.00 60.37 58.55 1fr0 h HIS 763 Cb 0.45 0.46 -0.11 0.00 1.55 0.00 0.00 27.41 29.77 1fr0 h HIS 763 CO -0.37 -0.37 0.61 0.22 -1.30 0.00 0.00 177.93 176.72 1fr0 h ASP 764 N -0.20 0.77 0.13 3.26 3.58 -1.02 -1.52 116.42 121.43 1fr0 h ASP 764 Ca 0.20 0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.75 1fr0 h ASP 764 Cb 0.54 -0.04 0.00 0.00 1.72 0.00 0.00 39.33 41.55 1fr0 h ASP 764 CO -0.60 0.26 -0.06 0.58 -2.88 0.00 0.00 179.24 176.54 1fr0 h VAL 765 N 0.75 0.00 -1.35 2.25 2.07 -0.04 -2.37 116.25 117.55 1fr0 h VAL 765 Ca 0.58 -0.07 0.39 0.00 0.82 0.00 0.00 66.70 68.42 1fr0 h VAL 765 Cb 0.93 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.64 1fr0 h VAL 765 CO -0.38 0.00 1.17 -0.33 0.02 0.00 0.00 177.57 178.05 1fr0 h GLU 766 N -0.25 0.00 0.36 1.57 3.07 -1.09 0.40 114.58 118.64 1fr0 h GLU 766 Ca -0.02 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.82 1fr0 h GLU 766 Cb 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.05 1fr0 h GLU 766 CO 0.03 0.00 -0.17 0.28 -1.40 0.00 0.00 179.01 177.75 1fr0 h VAL 767 N 0.00 0.00 -0.82 3.13 2.07 -1.13 -2.55 116.25 116.94 1fr0 h VAL 767 Ca 0.64 -0.57 0.22 0.00 0.82 0.00 0.00 66.70 67.81 1fr0 h VAL 767 Cb 2.98 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.71 1fr0 h VAL 767 CO -0.01 0.00 0.58 0.17 0.02 0.00 0.00 177.57 178.33 1fr0 h LEU 768 N -1.05 0.10 0.76 2.57 8.10 -0.43 -1.71 115.31 123.64 1fr0 h LEU 768 Ca -0.05 0.01 -0.04 0.00 0.11 0.00 0.00 57.88 57.91 1fr0 h LEU 768 Cb 0.37 -0.01 0.01 0.00 -0.44 0.00 0.00 40.66 40.59 1fr0 h LEU 768 CO 0.08 0.04 -0.36 0.50 -4.11 0.00 0.00 178.44 174.58 1fr0 h LYS 769 N 0.10 -0.98 -0.89 0.17 3.64 -1.24 -2.63 116.57 114.73 1fr0 h LYS 769 Ca 0.40 0.07 0.17 0.00 -1.27 0.00 0.00 60.65 60.02 1fr0 h LYS 769 Cb 1.44 0.22 -0.10 0.00 -0.41 0.00 0.00 32.23 33.38 1fr0 h LYS 769 CO -0.04 -0.64 0.47 0.00 -2.27 0.00 0.00 179.45 176.96 1fr0 h ALA 770 N -1.20 1.40 -0.08 5.00 0.00 -0.91 -1.37 119.26 122.11 1fr0 h ALA 770 Ca -0.10 0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.94 1fr0 h ALA 770 Cb 0.79 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.52 1fr0 h ALA 770 CO 0.17 -0.13 -0.37 2.35 0.00 0.00 0.00 179.25 181.28 1fr0 h TRP 771 N 0.62 -1.03 -0.56 0.00 7.01 -1.22 0.14 115.95 120.90 1fr0 h TRP 771 Ca 0.51 0.04 0.09 0.00 2.11 0.00 0.00 58.89 61.64 1fr0 h TRP 771 Cb 0.79 0.46 -0.07 0.00 -2.10 0.00 0.00 29.16 28.24 1fr0 h TRP 771 CO -0.08 -0.44 0.17 0.28 -2.79 0.00 0.00 178.44 175.58 1fr0 h VAL 772 N -0.47 0.74 0.00 2.65 2.07 -0.89 1.42 116.25 121.76 1fr0 h VAL 772 Ca 0.07 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1fr0 h VAL 772 Cb 0.59 0.39 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1fr0 h VAL 772 CO -0.34 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.31 1fr0 n ALA 773 N -2.50 1.92 -0.03 1.67 0.00 -0.63 -2.77 120.51 118.16 1fr0 n ALA 773 Ca 0.07 -0.08 -0.05 0.00 0.00 0.00 0.00 53.44 53.38 1fr0 n ALA 773 Cb 0.27 -1.26 -0.03 0.00 0.00 0.00 0.00 19.45 18.43 1fr0 n ALA 773 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1fr0 n LYS 774 N -1.23 0.17 0.08 0.00 4.81 0.12 -4.56 118.16 117.55 1fr0 n LYS 774 Ca 0.08 0.04 0.09 0.00 -0.87 0.00 0.00 58.31 57.66 1fr0 n LYS 774 Cb 0.11 -1.08 0.40 0.00 0.02 0.00 0.00 35.03 34.48 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fr0 n ALA 775 N -2.80 1.50 -0.33 3.14 0.00 0.44 -3.17 120.51 119.30 1fr0 n ALA 775 Ca -0.12 0.05 0.19 0.00 0.00 0.00 0.00 53.44 53.56 1fr0 n ALA 775 Cb 0.62 -1.29 0.40 0.00 0.00 0.00 0.00 19.45 19.18 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 0.40 -2.24 0.00 2.02 -1.72 -3.42 112.91 107.96 1fr0 h THR 776 Ca 0.00 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1fr0 h THR 776 Cb 0.24 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 1fr0 h THR 776 CO 0.00 0.07 0.00 0.29 0.37 0.00 0.00 175.52 176.25 1fr0 n LYS 777 N -5.02 3.78 0.00 6.66 5.02 -1.19 -5.17 118.16 122.24 1fr0 n LYS 777 Ca 0.27 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.56 1fr0 n LYS 777 Cb 0.82 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.83 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51