#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 0.90 -2.71 4.28 -1.04 -1.26 -3.73 114.28 110.72 1fr0 n THR 655 Ca 0.00 0.22 -0.08 0.00 -2.04 0.00 0.00 64.05 62.15 1fr0 n THR 655 Cb 0.00 -0.98 0.09 0.00 -1.82 0.00 0.00 70.33 67.62 1fr0 n THR 655 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 1fr0 n GLU 656 N -1.61 1.16 -1.51 -2.82 0.28 -1.26 -5.08 120.64 109.81 1fr0 n GLU 656 Ca 0.04 -2.23 -0.39 0.00 -0.16 0.00 0.00 57.16 54.41 1fr0 n GLU 656 Cb 0.19 -0.48 -0.13 0.00 1.43 0.00 0.00 31.44 32.45 1fr0 n GLU 656 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 1fr0 n GLU 657 N -0.35 0.18 -2.24 3.44 2.13 -1.24 -3.37 120.64 119.18 1fr0 n GLU 657 Ca 0.02 -0.01 -0.04 0.00 0.66 0.00 0.00 57.16 57.79 1fr0 n GLU 657 Cb 0.82 -1.82 -0.03 0.00 0.27 0.00 0.00 31.44 30.68 1fr0 n GLU 657 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1fr0 n ASN 658 N 11.25 -1.47 -1.25 4.31 2.85 -1.26 -4.92 115.26 124.76 1fr0 n ASN 658 Ca 0.61 1.00 0.08 0.00 -0.11 0.00 0.00 54.58 56.16 1fr0 n ASN 658 Cb 0.13 -4.04 0.30 0.00 1.24 0.00 0.00 39.78 37.40 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.54 -2.11 0.00 0.00 177.26 173.61 1fr0 n SER 659 N 1.23 4.40 -0.15 1.20 3.41 -1.22 -4.54 113.62 117.96 1fr0 n SER 659 Ca -0.28 -2.72 -0.11 0.00 -0.26 0.00 0.00 58.87 55.50 1fr0 n SER 659 Cb 0.43 -0.54 -0.01 0.00 -0.26 0.00 0.00 64.21 63.82 1fr0 n SER 659 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1fr0 h LYS 660 N 2.88 0.87 0.00 4.33 6.56 -1.92 -1.04 116.57 128.25 1fr0 h LYS 660 Ca 0.00 -0.36 0.00 0.00 -1.06 0.00 0.00 60.65 59.23 1fr0 h LYS 660 Cb 1.47 -0.03 0.00 0.00 -0.57 0.00 0.00 32.23 33.10 1fr0 h LYS 660 CO 0.26 1.01 0.15 1.03 -2.06 0.00 0.00 179.45 179.83 1fr0 h SER 661 N 0.70 0.00 0.00 0.86 0.87 -1.96 0.46 113.55 114.48 1fr0 h SER 661 Ca 0.10 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1fr0 h SER 661 Cb 0.72 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1fr0 h SER 661 CO 0.05 0.00 -0.78 1.21 -0.53 0.00 0.00 176.83 176.79 1fr0 n GLU 662 N -2.42 2.70 0.09 2.24 0.00 -0.94 -4.19 120.64 118.12 1fr0 n GLU 662 Ca -0.02 -0.03 0.12 0.00 0.00 0.00 0.00 57.16 57.23 1fr0 n GLU 662 Cb 0.18 -1.03 0.16 0.00 0.00 0.00 0.00 31.44 30.75 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1fr0 h ALA 663 N 1.16 0.66 0.00 4.31 0.00 0.40 -3.35 119.26 122.43 1fr0 h ALA 663 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 1fr0 h ALA 663 Cb 0.29 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.02 1fr0 h ALA 663 CO 0.00 0.00 -2.35 1.28 0.00 0.00 0.00 179.25 178.18 1fr0 n LEU 664 N -2.37 0.00 -4.08 0.00 4.77 -0.91 -4.05 117.00 110.36 1fr0 n LEU 664 Ca 0.03 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.92 1fr0 n LEU 664 Cb 0.47 0.45 -0.09 0.00 -2.33 0.00 0.00 43.42 41.92 1fr0 n LEU 664 CO 0.36 0.45 -0.28 -1.48 -1.33 0.00 0.00 177.39 175.12 1fr0 s LEU 665 N -5.40 1.97 -0.26 2.23 2.34 -1.26 -1.65 118.68 116.65 1fr0 s LEU 665 Ca -0.10 -1.04 -0.19 0.00 0.06 0.00 0.00 54.13 52.86 1fr0 s LEU 665 Cb 0.07 0.40 -0.02 0.00 -0.56 0.00 0.00 46.19 46.08 1fr0 s LEU 665 CO 0.83 -0.69 0.56 -0.62 -1.06 0.00 0.00 176.35 175.37 1fr0 s ASP 666 N -2.97 6.48 -0.03 1.48 -1.08 -0.88 -4.42 116.67 115.24 1fr0 s ASP 666 Ca 0.15 0.56 -0.26 0.00 -0.52 0.00 0.00 52.55 52.48 1fr0 s ASP 666 Cb 0.07 -2.30 -0.20 0.00 -1.46 0.00 0.00 42.92 39.03 1fr0 s ASP 666 CO -0.04 -0.33 1.23 0.40 0.52 0.00 0.00 175.17 176.95 1fr0 h ILE 667 N 5.42 1.37 -0.04 4.11 5.03 -1.87 -2.44 117.51 129.09 1fr0 h ILE 667 Ca -0.28 -1.19 -0.02 0.00 -0.12 0.00 0.00 64.86 63.25 1fr0 h ILE 667 Cb 1.13 2.17 0.00 0.00 -3.03 0.00 0.00 36.82 37.09 1fr0 h ILE 667 CO 0.74 0.30 -0.07 1.55 -0.68 0.00 0.00 178.15 179.99 1fr0 h PRO 668 N -0.53 0.12 -0.58 2.37 0.13 -1.99 -2.39 132.00 129.12 1fr0 h PRO 668 Ca -0.00 -0.07 0.09 0.00 -0.87 0.00 0.00 66.00 65.14 1fr0 h PRO 668 Cb 0.51 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 31.58 1fr0 h PRO 668 CO 0.00 0.65 0.21 1.98 -0.23 0.00 0.00 178.00 180.61 1fr0 h MET 669 N -0.40 0.37 -0.22 0.86 4.05 -1.98 0.31 114.93 117.91 1fr0 h MET 669 Ca 0.00 -0.02 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1fr0 h MET 669 Cb 0.65 -0.08 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 1fr0 h MET 669 CO 0.02 0.24 0.14 -0.07 0.23 0.00 0.00 176.91 177.47 1fr0 h LEU 670 N 0.38 0.24 -0.39 3.39 3.38 -1.45 -2.29 115.31 118.56 1fr0 h LEU 670 Ca 0.29 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.30 1fr0 h LEU 670 Cb 0.36 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.01 1fr0 h LEU 670 CO -0.30 0.17 0.15 -0.08 0.09 0.00 0.00 178.44 178.47 1fr0 h GLU 671 N 0.28 0.31 0.01 1.13 4.81 -0.74 -2.64 114.58 117.74 1fr0 h GLU 671 Ca 0.08 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1fr0 h GLU 671 Cb -0.02 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.23 1fr0 h GLU 671 CO -0.02 0.20 -0.36 0.37 -0.73 0.00 0.00 179.01 178.46 1fr0 h GLN 672 N 0.32 -0.51 -0.93 1.92 4.15 -0.62 -0.41 115.11 119.03 1fr0 h GLN 672 Ca 0.17 0.03 0.26 0.00 0.77 0.00 0.00 58.65 59.89 1fr0 h GLN 672 Cb 0.14 0.12 -0.14 0.00 0.21 0.00 0.00 27.48 27.81 1fr0 h GLN 672 CO -0.17 -0.34 0.41 1.88 -1.93 0.00 0.00 178.83 178.69 1fr0 h TYR 673 N -0.53 0.67 0.00 3.99 0.05 -1.08 1.99 116.97 122.06 1fr0 h TYR 673 Ca 0.05 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.88 1fr0 h TYR 673 Cb 0.61 -0.15 0.00 0.00 1.01 0.00 0.00 36.73 38.20 1fr0 h TYR 673 CO -0.38 -0.13 0.00 -0.07 -1.05 0.00 0.00 178.16 176.54 1fr0 h LEU 674 N 0.33 0.00 -0.06 3.88 4.07 -0.82 -0.29 115.31 122.43 1fr0 h LEU 674 Ca 0.62 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.58 1fr0 h LEU 674 Cb 1.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.02 1fr0 h LEU 674 CO -0.59 0.00 0.00 1.21 -1.08 0.00 0.00 178.44 177.98 1fr0 n GLU 675 N -2.87 1.04 0.07 1.13 0.00 0.67 -3.42 120.64 117.27 1fr0 n GLU 675 Ca 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 57.16 57.12 1fr0 n GLU 675 Cb 0.33 -1.10 0.00 0.00 0.00 0.00 0.00 31.44 30.67 1fr0 n GLU 675 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.13 178.60 1fr0 n LEU 676 N -0.54 -0.80 -0.01 4.31 -0.00 -0.99 -4.94 117.00 114.03 1fr0 n LEU 676 Ca 0.05 0.27 -0.03 0.00 -0.00 0.00 0.00 56.01 56.30 1fr0 n LEU 676 Cb 0.03 0.93 -0.12 0.00 -0.00 0.00 0.00 43.42 44.26 1fr0 n LEU 676 CO 0.03 -0.42 -0.59 1.33 -0.00 0.00 0.00 177.39 177.74 1fr0 n VAL 677 N -2.88 1.18 -2.21 1.47 0.24 -0.16 -5.08 118.33 110.89 1fr0 n VAL 677 Ca 0.00 -0.73 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 1fr0 n VAL 677 Cb 0.00 -0.64 0.00 0.00 -1.47 0.00 0.00 33.84 31.73 1fr0 n VAL 677 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fr0 n GLY 678 N 1.49 -1.87 0.00 7.63 0.00 -0.93 -4.10 105.19 107.41 1fr0 n GLY 678 Ca -0.16 -1.70 0.11 0.00 0.00 0.00 0.00 46.02 44.28 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 0.62 0.00 1.61 -0.04 -1.26 -3.98 135.00 131.96 1fr0 n PRO 679 Ca 0.00 0.02 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1fr0 n PRO 679 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -1.07 0.00 -0.06 0.54 5.02 -1.26 -0.70 118.16 120.63 1fr0 n LYS 680 Ca 0.16 0.22 0.25 0.00 -2.02 0.00 0.00 58.31 56.91 1fr0 n LYS 680 Cb 0.10 -0.91 0.64 0.00 -0.02 0.00 0.00 35.03 34.84 1fr0 n LYS 680 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1fr0 h LEU 681 N 0.00 0.00 0.00 -0.35 5.85 -1.77 0.91 115.31 119.95 1fr0 h LEU 681 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1fr0 h LEU 681 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1fr0 h LEU 681 CO 0.00 0.00 -0.16 0.40 -0.34 0.00 0.00 178.44 178.34 1fr0 h ILE 682 N 0.00 1.05 0.03 4.05 1.08 -1.69 -2.98 117.51 119.05 1fr0 h ILE 682 Ca 0.34 -1.84 -0.00 0.00 -0.39 0.00 0.00 64.86 62.97 1fr0 h ILE 682 Cb 1.89 2.04 0.00 0.00 -3.07 0.00 0.00 36.82 37.67 1fr0 h ILE 682 CO -0.00 0.36 -0.02 0.74 -0.69 0.00 0.00 178.15 178.54 1fr0 h THR 683 N -1.00 1.13 0.00 -0.27 2.02 0.32 -1.26 112.91 113.86 1fr0 h THR 683 Ca -0.04 -0.51 0.00 0.00 0.77 0.00 0.00 66.41 66.63 1fr0 h THR 683 Cb 0.70 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1fr0 h THR 683 CO -0.02 0.13 0.00 -0.67 0.37 0.00 0.00 175.52 175.33 1fr0 n ASP 684 N -5.00 0.00 -0.37 4.18 2.03 0.19 -0.93 116.55 116.65 1fr0 n ASP 684 Ca -0.08 0.94 0.29 0.00 0.52 0.00 0.00 54.79 56.46 1fr0 n ASP 684 Cb 0.14 -0.44 0.56 0.00 -0.72 0.00 0.00 41.12 40.66 1fr0 n ASP 684 CO 0.00 0.00 0.00 1.23 -1.92 0.00 0.00 177.20 176.51 1fr0 h GLY 685 N 0.00 1.65 0.94 0.27 0.00 -1.64 0.52 103.07 104.81 1fr0 h GLY 685 Ca 0.00 -0.18 -0.04 0.00 0.00 0.00 0.00 47.33 47.11 1fr0 h GLY 685 CO 0.00 -0.42 0.09 -2.00 0.00 0.00 0.00 176.54 174.21 1fr0 h LEU 686 N 0.22 0.64 0.38 3.11 5.85 -0.98 -2.30 115.31 122.24 1fr0 h LEU 686 Ca 0.75 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 59.22 1fr0 h LEU 686 Cb 2.03 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 42.87 1fr0 h LEU 686 CO -0.49 0.72 -0.36 0.00 -0.34 0.00 0.00 178.44 177.97 1fr0 h ALA 687 N 0.95 -0.78 -0.51 1.25 0.00 0.19 0.17 119.26 120.52 1fr0 h ALA 687 Ca 0.13 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1fr0 h ALA 687 Cb 0.34 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.55 1fr0 h ALA 687 CO 0.00 -0.97 0.07 0.28 0.00 0.00 0.00 179.25 178.63 1fr0 h VAL 688 N -0.75 0.67 0.00 0.00 2.07 -1.46 0.33 116.25 117.11 1fr0 h VAL 688 Ca -0.03 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1fr0 h VAL 688 Cb 0.67 0.46 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1fr0 h VAL 688 CO -0.05 0.04 0.00 0.15 0.02 0.00 0.00 177.57 177.73 1fr0 h PHE 689 N 0.19 0.00 0.04 1.57 3.04 -1.03 -2.49 116.94 118.27 1fr0 h PHE 689 Ca 0.26 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 62.21 1fr0 h PHE 689 Cb 0.37 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.88 1fr0 h PHE 689 CO -0.26 0.00 -0.02 0.93 -2.02 0.00 0.00 178.31 176.94 1fr0 h GLU 690 N 0.00 -0.05 0.00 1.11 4.39 0.27 0.12 114.58 120.42 1fr0 h GLU 690 Ca 0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1fr0 h GLU 690 Cb 0.32 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1fr0 h GLU 690 CO 0.00 0.51 -0.38 -0.22 -1.16 0.00 0.00 179.01 177.76 1fr0 h LYS 691 N -0.67 0.00 -0.00 2.33 3.11 -1.36 -2.84 116.57 117.13 1fr0 h LYS 691 Ca -0.01 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.83 1fr0 h LYS 691 Cb 0.59 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.82 1fr0 h LYS 691 CO 0.01 0.38 -0.49 -1.33 -2.81 0.00 0.00 179.45 175.21 1fr0 n MET 692 N -3.60 0.33 0.11 1.90 2.81 -0.95 -4.04 117.12 113.69 1fr0 n MET 692 Ca -0.00 -0.21 -0.13 0.00 -1.81 0.00 0.00 57.70 55.54 1fr0 n MET 692 Cb 0.50 -1.50 -0.08 0.00 -0.71 0.00 0.00 33.22 31.43 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 0.52 -0.23 -0.30 0.03 4.05 -0.49 -1.02 114.93 117.49 1fr0 h MET 693 Ca 0.00 0.02 -0.16 0.00 -0.28 0.00 0.00 59.70 59.28 1fr0 h MET 693 Cb 0.52 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.37 1fr0 h MET 693 CO 0.00 -0.02 -0.44 -1.00 0.23 0.00 0.00 176.91 175.68 1fr0 h PRO 694 N -0.41 0.76 0.00 0.39 0.13 -1.74 -2.37 132.00 128.76 1fr0 h PRO 694 Ca -0.02 -0.42 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 1fr0 h PRO 694 Cb 0.32 0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.47 1fr0 h PRO 694 CO 0.04 1.05 -0.19 0.78 -0.23 0.00 0.00 178.00 179.45 1fr0 h GLY 695 N 0.89 0.00 0.12 1.56 0.00 -1.68 -2.11 103.07 101.86 1fr0 h GLY 695 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1fr0 h GLY 695 CO 0.10 0.00 -0.06 -0.97 0.00 0.00 0.00 176.54 175.61 1fr0 h TYR 696 N 0.00 -0.15 -1.18 5.60 0.05 -0.89 -2.70 116.97 117.70 1fr0 h TYR 696 Ca -0.00 -0.00 0.39 0.00 0.05 0.00 0.00 58.73 59.17 1fr0 h TYR 696 Cb 0.35 0.05 -0.14 0.00 1.01 0.00 0.00 36.73 38.00 1fr0 h TYR 696 CO 0.00 -0.10 0.73 -0.39 -1.05 0.00 0.00 178.16 177.35 1fr0 h VAL 697 N -0.41 0.18 0.06 -2.88 -1.51 -1.44 0.64 116.25 110.89 1fr0 h VAL 697 Ca -0.02 -0.05 -0.00 0.00 -1.23 0.00 0.00 66.70 65.40 1fr0 h VAL 697 Cb 0.13 0.01 0.00 0.00 -2.13 0.00 0.00 31.29 29.30 1fr0 h VAL 697 CO 0.03 0.03 -0.03 -1.28 -1.23 0.00 0.00 177.57 175.09 1fr0 h SER 698 N 0.15 -0.07 -0.88 4.19 0.87 -1.41 -1.91 113.55 114.50 1fr0 h SER 698 Ca 0.79 -0.06 0.20 0.00 -1.23 0.00 0.00 61.79 61.48 1fr0 h SER 698 Cb 2.23 0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 64.14 1fr0 h SER 698 CO -0.50 0.02 0.59 0.58 -0.53 0.00 0.00 176.83 176.99 1fr0 h VAL 699 N -0.15 0.68 -0.07 2.23 2.07 0.62 -0.69 116.25 120.94 1fr0 h VAL 699 Ca -0.01 -0.13 -0.01 0.00 0.82 0.00 0.00 66.70 67.38 1fr0 h VAL 699 Cb 0.13 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1fr0 h VAL 699 CO 0.01 0.07 0.02 0.25 0.02 0.00 0.00 177.57 177.94 1fr0 h LEU 700 N 0.37 0.11 -0.29 2.57 5.85 -0.80 -1.68 115.31 121.44 1fr0 h LEU 700 Ca 0.45 -0.23 0.07 0.00 0.84 0.00 0.00 57.88 59.01 1fr0 h LEU 700 Cb 1.17 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 42.10 1fr0 h LEU 700 CO -0.16 0.32 -0.21 -0.33 -0.34 0.00 0.00 178.44 177.73 1fr0 h GLU 701 N -0.10 -0.18 -0.56 1.25 5.08 -0.72 0.22 114.58 119.58 1fr0 h GLU 701 Ca 0.02 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1fr0 h GLU 701 Cb 0.25 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 1fr0 h GLU 701 CO 0.00 -0.12 0.34 1.03 -1.00 0.00 0.00 179.01 179.26 1fr0 h SER 702 N -0.18 0.55 -0.25 1.42 0.87 -1.41 -2.62 113.55 111.92 1fr0 h SER 702 Ca 0.15 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1fr0 h SER 702 Cb 0.42 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.26 1fr0 h SER 702 CO -0.40 0.38 0.13 -1.13 -0.53 0.00 0.00 176.83 175.29 1fr0 h ASN 703 N 0.67 0.31 -0.36 6.23 -1.24 -0.30 -2.21 115.58 118.69 1fr0 h ASN 703 Ca 0.23 -0.09 0.07 0.00 0.71 0.00 0.00 56.30 57.21 1fr0 h ASN 703 Cb 0.03 -0.08 -0.09 0.00 0.73 0.00 0.00 38.32 38.91 1fr0 h ASN 703 CO -0.10 0.32 -0.37 0.25 -1.29 0.00 0.00 177.43 176.23 1fr0 h LEU 704 N 0.28 -1.23 -1.94 0.34 7.12 -0.25 0.39 115.31 120.03 1fr0 h LEU 704 Ca 0.09 0.20 0.02 0.00 0.13 0.00 0.00 57.88 58.32 1fr0 h LEU 704 Cb 0.08 0.55 -0.01 0.00 -0.53 0.00 0.00 40.66 40.75 1fr0 h LEU 704 CO -0.01 -0.35 0.10 0.74 -0.13 0.00 0.00 178.44 178.78 1fr0 h THR 705 N -0.32 0.97 -0.14 1.05 2.02 -1.37 0.14 112.91 115.27 1fr0 h THR 705 Ca 0.14 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1fr0 h THR 705 Cb 0.57 0.89 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1fr0 h THR 705 CO -0.53 0.01 0.00 0.00 0.37 0.00 0.00 175.52 175.38 1fr0 n ALA 706 N -2.54 2.49 -2.42 6.16 0.00 0.12 -4.86 120.51 119.45 1fr0 n ALA 706 Ca -0.00 -0.26 -0.18 0.00 0.00 0.00 0.00 53.44 53.00 1fr0 n ALA 706 Cb 0.16 -1.01 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.10 -1.89 -1.55 0.00 1.13 0.50 -4.84 117.38 110.63 1fr0 n GLN 707 Ca 0.06 0.88 -0.32 0.00 -1.94 0.00 0.00 57.00 55.67 1fr0 n GLN 707 Cb 0.13 -5.52 -0.05 0.00 0.11 0.00 0.00 30.24 24.91 1fr0 n GLN 707 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1fr0 n ASP 708 N -1.95 7.42 -0.30 1.08 9.92 -0.56 -4.69 116.55 127.47 1fr0 n ASP 708 Ca -0.21 -2.91 0.11 0.00 -0.53 0.00 0.00 54.79 51.24 1fr0 n ASP 708 Cb 0.66 -1.39 0.27 0.00 -0.64 0.00 0.00 41.12 40.03 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 4.07 0.48 -0.03 -1.24 6.56 -1.88 -1.25 116.57 123.29 1fr0 h LYS 709 Ca 0.59 -0.03 0.02 0.00 -1.06 0.00 0.00 60.65 60.18 1fr0 h LYS 709 Cb 0.59 -0.11 -0.05 0.00 -0.57 0.00 0.00 32.23 32.09 1fr0 h LYS 709 CO 1.21 0.32 -0.51 0.87 -2.06 0.00 0.00 179.45 179.29 1fr0 h LYS 710 N 0.49 -0.59 -0.05 3.15 1.57 -1.99 -0.55 116.57 118.60 1fr0 h LYS 710 Ca 0.52 0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.36 1fr0 h LYS 710 Cb 0.89 0.13 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 1fr0 h LYS 710 CO -0.46 -0.40 -0.10 0.78 -0.57 0.00 0.00 179.45 178.71 1fr0 h GLY 711 N -0.62 -0.07 -0.63 3.86 0.00 -1.74 -2.19 103.07 101.68 1fr0 h GLY 711 Ca 0.01 0.12 0.19 0.00 0.00 0.00 0.00 47.33 47.65 1fr0 h GLY 711 CO -0.35 -0.11 -0.10 -2.22 0.00 0.00 0.00 176.54 173.76 1fr0 h ILE 712 N -0.15 0.19 -0.07 2.60 2.04 -0.61 0.91 117.51 122.42 1fr0 h ILE 712 Ca 0.06 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 1fr0 h ILE 712 Cb 0.23 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1fr0 h ILE 712 CO -0.14 0.01 -0.20 0.58 0.00 0.00 0.00 178.15 178.40 1fr0 h VAL 713 N 0.03 1.18 0.04 1.67 2.07 -0.53 0.77 116.25 121.49 1fr0 h VAL 713 Ca 0.44 -0.83 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1fr0 h VAL 713 Cb 0.76 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1fr0 h VAL 713 CO -0.81 0.25 -0.02 -0.33 0.02 0.00 0.00 177.57 176.67 1fr0 h GLU 714 N 0.11 -0.06 0.00 1.57 4.39 0.12 -3.17 114.58 117.54 1fr0 h GLU 714 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1fr0 h GLU 714 Cb 0.42 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1fr0 h GLU 714 CO 0.03 -0.04 0.00 0.39 -1.16 0.00 0.00 179.01 178.23 1fr0 n GLU 715 N -4.74 0.13 0.07 2.33 1.02 0.72 -0.74 120.64 119.42 1fr0 n GLU 715 Ca -0.01 0.57 -0.03 0.00 -0.02 0.00 0.00 57.16 57.67 1fr0 n GLU 715 Cb 0.02 -1.87 -0.01 0.00 -0.02 0.00 0.00 31.44 29.56 1fr0 n GLU 715 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 1fr0 h GLY 716 N 0.54 -0.20 1.90 0.62 0.00 -0.88 -2.78 103.07 102.25 1fr0 h GLY 716 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1fr0 h GLY 716 CO 0.00 -0.07 0.00 -2.39 0.00 0.00 0.00 176.54 174.08 1fr0 n HIS 717 N -3.05 0.00 -0.02 5.60 1.44 -1.17 -2.25 115.22 115.77 1fr0 n HIS 717 Ca -0.02 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.60 1fr0 n HIS 717 Cb 0.08 -0.45 -0.08 0.00 0.12 0.00 0.00 29.99 29.66 1fr0 n HIS 717 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 1fr0 h LYS 718 N 0.00 -0.07 0.00 -1.40 3.11 -1.02 0.31 116.57 117.51 1fr0 h LYS 718 Ca 0.00 0.00 -0.25 0.00 -2.81 0.00 0.00 60.65 57.60 1fr0 h LYS 718 Cb 0.42 0.02 0.01 0.00 -1.00 0.00 0.00 32.23 31.68 1fr0 h LYS 718 CO 0.00 0.46 -0.99 -0.84 -2.81 0.00 0.00 179.45 175.26 1fr0 h ILE 719 N -0.95 1.34 0.17 2.00 3.07 -1.57 -2.64 117.51 118.93 1fr0 h ILE 719 Ca -0.01 -2.35 -0.27 0.00 1.55 0.00 0.00 64.86 63.78 1fr0 h ILE 719 Cb 0.56 2.40 0.02 0.00 -0.27 0.00 0.00 36.82 39.53 1fr0 h ILE 719 CO 0.01 0.71 -1.24 0.11 -1.05 0.00 0.00 178.15 176.70 1fr0 h LYS 720 N 0.31 0.37 -0.93 0.16 1.57 -1.60 -2.65 116.57 113.80 1fr0 h LYS 720 Ca -0.10 -0.63 0.05 0.00 -1.87 0.00 0.00 60.65 58.10 1fr0 h LYS 720 Cb 1.64 0.23 -0.06 0.00 0.08 0.00 0.00 32.23 34.12 1fr0 h LYS 720 CO 0.18 1.30 0.60 0.78 -0.57 0.00 0.00 179.45 181.74 1fr0 h GLY 721 N -0.02 1.40 0.43 3.86 0.00 -0.47 -1.06 103.07 107.20 1fr0 h GLY 721 Ca -0.23 -0.44 -0.01 0.00 0.00 0.00 0.00 47.33 46.65 1fr0 h GLY 721 CO 0.17 0.33 -0.06 0.00 0.00 0.00 0.00 176.54 176.98 1fr0 h ALA 722 N 1.41 -0.17 -0.94 3.60 0.00 -1.55 -3.11 119.26 118.50 1fr0 h ALA 722 Ca 0.39 -0.24 0.25 0.00 0.00 0.00 0.00 54.91 55.31 1fr0 h ALA 722 Cb 0.11 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1fr0 h ALA 722 CO -0.15 -0.31 0.65 0.00 0.00 0.00 0.00 179.25 179.44 1fr0 h ALA 723 N -0.04 2.59 -0.34 0.00 0.00 -1.25 0.47 119.26 120.70 1fr0 h ALA 723 Ca -0.02 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 54.99 1fr0 h ALA 723 Cb 0.54 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1fr0 h ALA 723 CO 0.03 -0.88 0.37 0.78 0.00 0.00 0.00 179.25 179.55 1fr0 h GLY 724 N 0.18 0.00 2.00 0.00 0.00 -1.12 0.56 103.07 104.69 1fr0 h GLY 724 Ca 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.75 1fr0 h GLY 724 CO -0.10 0.00 -0.25 1.48 0.00 0.00 0.00 176.54 177.67 1fr0 h SER 725 N 0.00 0.00 -0.25 0.19 4.64 -0.17 -2.45 113.55 115.52 1fr0 h SER 725 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1fr0 h SER 725 Cb 0.90 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.99 1fr0 h SER 725 CO -0.00 0.25 0.00 0.52 -0.87 0.00 0.00 176.83 176.73 1fr0 n VAL 726 N -3.35 0.35 -0.04 0.95 0.31 0.19 -4.80 118.33 111.94 1fr0 n VAL 726 Ca 0.01 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1fr0 n VAL 726 Cb 0.47 0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.55 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 0.87 0.83 3.31 2.92 0.00 -0.92 -4.98 105.19 107.22 1fr0 n GLY 727 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.67 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 5.59 -0.04 0.99 4.77 -0.43 -2.08 117.00 125.79 1fr0 n LEU 728 Ca 0.00 -4.47 -0.16 0.00 -0.03 0.00 0.00 56.01 51.35 1fr0 n LEU 728 Cb 0.00 -1.59 -0.07 0.00 -2.33 0.00 0.00 43.42 39.43 1fr0 n LEU 728 CO 0.00 0.86 0.38 0.08 -1.33 0.00 0.00 177.39 177.38 1fr0 h ARG 729 N 6.79 0.66 -0.35 3.23 0.11 -1.64 -2.57 114.38 120.61 1fr0 h ARG 729 Ca 0.35 -0.49 0.04 0.00 0.10 0.00 0.00 59.98 59.98 1fr0 h ARG 729 Cb 0.81 0.09 -0.07 0.00 1.11 0.00 0.00 29.97 31.91 1fr0 h ARG 729 CO 1.36 1.11 -0.44 1.25 0.10 0.00 0.00 179.97 183.36 1fr0 h HIS 730 N 0.34 -1.34 -0.01 4.08 -0.00 -1.46 -1.17 115.15 115.60 1fr0 h HIS 730 Ca -0.02 0.07 -0.00 0.00 -0.00 0.00 0.00 60.37 60.41 1fr0 h HIS 730 Cb 1.17 0.63 -0.00 0.00 -0.00 0.00 0.00 27.41 29.21 1fr0 h HIS 730 CO 0.10 -0.38 0.00 -0.07 -0.00 0.00 0.00 177.93 177.58 1fr0 h LEU 731 N -0.29 0.01 -0.91 0.26 3.38 -1.82 -2.75 115.31 113.19 1fr0 h LEU 731 Ca 0.06 -0.16 0.17 0.00 0.09 0.00 0.00 57.88 58.04 1fr0 h LEU 731 Cb 0.45 -0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.03 1fr0 h LEU 731 CO -0.48 0.17 -0.26 -0.61 0.09 0.00 0.00 178.44 177.35 1fr0 h GLN 732 N -0.15 -0.01 0.34 1.13 4.15 -1.00 0.57 115.11 120.15 1fr0 h GLN 732 Ca 0.00 0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.41 1fr0 h GLN 732 Cb 0.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.86 1fr0 h GLN 732 CO -0.00 -0.01 -0.17 1.96 -1.93 0.00 0.00 178.83 178.69 1fr0 h GLN 733 N -0.01 -0.44 -0.85 1.69 1.08 -1.12 -2.27 115.11 113.18 1fr0 h GLN 733 Ca 0.41 0.03 0.08 0.00 -1.45 0.00 0.00 58.65 57.72 1fr0 h GLN 733 Cb 0.65 0.10 -0.11 0.00 -0.05 0.00 0.00 27.48 28.07 1fr0 h GLN 733 CO -0.93 -0.24 -0.57 -0.07 -0.95 0.00 0.00 178.83 176.06 1fr0 h LEU 734 N -0.55 -2.04 -0.51 1.46 4.07 -0.62 0.43 115.31 117.56 1fr0 h LEU 734 Ca -0.05 0.31 0.09 0.00 0.08 0.00 0.00 57.88 58.31 1fr0 h LEU 734 Cb 0.41 0.90 -0.08 0.00 1.08 0.00 0.00 40.66 42.97 1fr0 h LEU 734 CO 0.08 -0.28 0.06 1.23 -1.08 0.00 0.00 178.44 178.45 1fr0 h GLY 735 N -0.10 0.58 -0.34 0.83 0.00 -1.29 0.31 103.07 103.06 1fr0 h GLY 735 Ca 0.15 0.01 0.31 0.00 0.00 0.00 0.00 47.33 47.80 1fr0 h GLY 735 CO -0.85 -0.11 0.73 -1.61 0.00 0.00 0.00 176.54 174.70 1fr0 h GLN 736 N 0.18 0.26 0.05 4.80 4.15 0.43 0.36 115.11 125.33 1fr0 h GLN 736 Ca 0.26 -0.02 -0.28 0.00 0.77 0.00 0.00 58.65 59.39 1fr0 h GLN 736 Cb 0.37 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.98 1fr0 h GLN 736 CO -0.38 0.17 -1.47 1.96 -1.93 0.00 0.00 178.83 177.19 1fr0 h GLN 737 N 0.27 0.10 0.00 1.69 1.08 0.63 -3.28 115.11 115.60 1fr0 h GLN 737 Ca 0.62 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.66 1fr0 h GLN 737 Cb 1.83 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 29.32 1fr0 h GLN 737 CO -0.26 0.88 -0.00 0.82 -0.95 0.00 0.00 178.83 179.32 1fr0 h ILE 738 N 0.03 0.16 -0.05 2.54 1.08 0.23 0.14 117.51 121.63 1fr0 h ILE 738 Ca -0.20 -0.01 0.00 0.00 -0.39 0.00 0.00 64.86 64.26 1fr0 h ILE 738 Cb 1.95 1.01 0.00 0.00 -3.07 0.00 0.00 36.82 36.71 1fr0 h ILE 738 CO 0.12 0.00 0.00 1.67 -0.69 0.00 0.00 178.15 179.25 1fr0 n GLN 739 N -3.31 1.16 -2.40 2.37 0.00 -0.77 -3.85 117.38 110.58 1fr0 n GLN 739 Ca -0.03 -0.24 -0.29 0.00 -0.00 0.00 0.00 57.00 56.44 1fr0 n GLN 739 Cb 0.08 -1.19 0.01 0.00 0.00 0.00 0.00 30.24 29.13 1fr0 n GLN 739 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 1fr0 n SER 740 N -0.44 5.17 -2.78 1.69 7.64 0.47 -4.91 113.62 120.47 1fr0 n SER 740 Ca 0.09 -3.74 -0.09 0.00 1.01 0.00 0.00 58.87 56.14 1fr0 n SER 740 Cb 0.09 -0.56 -0.03 0.00 -1.01 0.00 0.00 64.21 62.70 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 -0.49 0.94 0.00 1.43 -0.04 -1.25 -2.78 135.00 132.81 1fr0 n PRO 741 Ca 0.41 -0.73 0.00 0.00 -0.04 0.00 0.00 63.50 63.14 1fr0 n PRO 741 Cb 0.59 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 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 3.83 0.33 -4.77 3.54 9.92 -1.26 -4.96 116.55 123.18 1fr0 n ASP 742 Ca 0.20 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 54.05 1fr0 n ASP 742 Cb 0.16 0.06 -0.01 0.00 -0.64 0.00 0.00 41.12 40.69 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 1fr0 s LEU 743 N -0.46 4.36 0.38 0.64 1.02 -1.12 -4.86 118.68 118.64 1fr0 s LEU 743 Ca 0.00 2.80 0.27 0.00 0.02 0.00 0.00 54.13 57.23 1fr0 s LEU 743 Cb 0.00 -3.69 1.26 0.00 0.02 0.00 0.00 46.19 43.78 1fr0 s LEU 743 CO 0.00 -0.69 1.83 1.55 0.02 0.00 0.00 176.35 179.06 1fr0 h PRO 744 N 3.15 0.00 0.00 1.29 0.13 -1.98 -2.06 132.00 132.54 1fr0 h PRO 744 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 1fr0 h PRO 744 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 1fr0 h PRO 744 CO 0.65 0.00 -1.97 0.00 -0.23 0.00 0.00 178.00 176.45 1fr0 n ALA 745 N -1.87 2.75 0.04 -0.56 0.00 -1.26 -4.36 120.51 115.25 1fr0 n ALA 745 Ca 0.00 -0.52 -0.20 0.00 0.00 0.00 0.00 53.44 52.72 1fr0 n ALA 745 Cb 0.18 -0.71 -0.11 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 1.03 -0.07 0.00 7.01 -1.74 0.13 115.95 122.31 1fr0 h TRP 746 Ca -0.01 -0.57 0.02 0.00 2.11 0.00 0.00 58.89 60.44 1fr0 h TRP 746 Cb 0.99 -0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 27.93 1fr0 h TRP 746 CO 0.00 1.41 0.16 0.93 -2.79 0.00 0.00 178.44 178.14 1fr0 h GLU 747 N 0.36 0.00 -0.01 2.65 5.08 -1.67 0.32 114.58 121.32 1fr0 h GLU 747 Ca -0.13 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1fr0 h GLU 747 Cb 1.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.95 1fr0 h GLU 747 CO 0.21 0.00 -0.14 -0.25 -1.00 0.00 0.00 179.01 177.82 1fr0 n ASP 748 N -3.34 1.09 -0.05 1.42 9.92 -1.15 -4.52 116.55 119.92 1fr0 n ASP 748 Ca -0.01 -1.04 -0.02 0.00 -0.53 0.00 0.00 54.79 53.18 1fr0 n ASP 748 Cb 0.24 0.43 -0.15 0.00 -0.64 0.00 0.00 41.12 41.00 1fr0 n ASP 748 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1fr0 n ASN 749 N -0.24 0.21 -0.27 -2.24 3.02 0.43 -4.40 115.26 111.77 1fr0 n ASN 749 Ca 0.03 0.09 -0.02 0.00 -0.03 0.00 0.00 54.58 54.66 1fr0 n ASN 749 Cb 0.16 1.05 0.04 0.00 -0.61 0.00 0.00 39.78 40.42 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 0.14 -0.42 2.41 2.07 -1.24 0.20 116.25 119.41 1fr0 h VAL 750 Ca -0.32 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.24 1fr0 h VAL 750 Cb 1.78 0.14 -0.06 0.00 -1.52 0.00 0.00 31.29 31.63 1fr0 h VAL 750 CO 0.03 0.00 -0.33 1.23 0.02 0.00 0.00 177.57 178.52 1fr0 h GLY 751 N -0.07 -1.55 2.00 2.17 0.00 -1.85 0.31 103.07 104.08 1fr0 h GLY 751 Ca 0.31 0.88 -0.04 0.00 0.00 0.00 0.00 47.33 48.48 1fr0 h GLY 751 CO -0.80 -0.41 -0.18 0.83 0.00 0.00 0.00 176.54 175.99 1fr0 h GLU 752 N -0.10 0.00 0.46 4.80 3.07 -1.58 -2.69 114.58 118.55 1fr0 h GLU 752 Ca 0.07 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.91 1fr0 h GLU 752 Cb 0.28 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1fr0 h GLU 752 CO -0.45 0.18 -0.23 2.35 -1.40 0.00 0.00 179.01 179.46 1fr0 h TRP 753 N 0.00 -0.60 -0.66 4.33 2.91 0.27 0.14 115.95 122.34 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 0.34 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.16 1fr0 h TRP 753 CO 0.00 -0.37 0.26 0.82 -1.03 0.00 0.00 178.44 178.12 1fr0 h ILE 754 N -0.63 1.24 -0.42 2.65 2.04 -0.94 -1.36 117.51 120.09 1fr0 h ILE 754 Ca -0.06 -0.77 -0.03 0.00 1.00 0.00 0.00 64.86 65.00 1fr0 h ILE 754 Cb 0.49 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1fr0 h ILE 754 CO 0.10 0.30 0.13 -0.08 0.00 0.00 0.00 178.15 178.60 1fr0 h GLU 755 N 0.94 0.66 0.59 2.37 4.81 -1.32 -1.93 114.58 120.70 1fr0 h GLU 755 Ca 0.22 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.28 1fr0 h GLU 755 Cb 0.22 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.51 1fr0 h GLU 755 CO -0.02 0.65 -0.28 1.49 -0.73 0.00 0.00 179.01 180.12 1fr0 h GLU 756 N 0.54 -0.77 -0.96 1.92 4.81 -0.55 -2.76 114.58 116.80 1fr0 h GLU 756 Ca 0.14 0.05 0.22 0.00 -0.13 0.00 0.00 59.36 59.64 1fr0 h GLU 756 Cb 0.27 0.17 -0.08 0.00 0.63 0.00 0.00 28.75 29.74 1fr0 h GLU 756 CO -0.00 -0.46 0.63 0.00 -0.73 0.00 0.00 179.01 178.44 1fr0 h MET 757 N -1.08 0.44 0.78 1.92 -0.00 -1.29 -2.27 114.93 113.43 1fr0 h MET 757 Ca -0.08 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.70 59.55 1fr0 h MET 757 Cb 0.66 -0.10 0.01 0.00 -0.00 0.00 0.00 31.60 32.17 1fr0 h MET 757 CO 0.13 0.29 -0.38 -0.22 -0.00 0.00 0.00 176.91 176.74 1fr0 h LYS 758 N 0.45 -1.01 -2.85 -0.10 3.64 -1.22 0.11 116.57 115.60 1fr0 h LYS 758 Ca 0.52 0.07 -0.61 0.00 -1.27 0.00 0.00 60.65 59.36 1fr0 h LYS 758 Cb 1.24 0.23 0.01 0.00 -0.41 0.00 0.00 32.23 33.30 1fr0 h LYS 758 CO -0.24 -0.68 3.24 0.39 -2.27 0.00 0.00 179.45 179.90 1fr0 n GLU 759 N -4.91 3.54 0.00 1.90 1.02 -0.86 -3.77 120.64 117.56 1fr0 n GLU 759 Ca -0.13 -2.12 0.00 0.00 -0.02 0.00 0.00 57.16 54.89 1fr0 n GLU 759 Cb 0.41 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.15 1fr0 n GLU 759 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1fr0 n GLU 760 N 3.32 0.00 -0.28 3.49 1.02 -1.17 -4.96 120.64 122.06 1fr0 n GLU 760 Ca 0.73 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.93 1fr0 n GLU 760 Cb 0.32 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 31.89 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 1.18 0.00 0.00 177.13 178.42 1fr0 h TRP 761 N 0.00 -0.17 -0.52 -0.32 5.08 -0.86 0.19 115.95 119.35 1fr0 h TRP 761 Ca 0.00 0.06 0.10 0.00 1.08 0.00 0.00 58.89 60.14 1fr0 h TRP 761 Cb 0.00 0.20 -0.10 0.00 -3.00 0.00 0.00 29.16 26.26 1fr0 h TRP 761 CO 0.00 -0.30 -0.15 -0.09 -1.28 0.00 0.00 178.44 176.62 1fr0 h ARG 762 N 0.06 -0.02 -0.78 0.12 2.43 -1.81 0.16 114.38 114.55 1fr0 h ARG 762 Ca 0.43 0.00 0.16 0.00 -0.81 0.00 0.00 59.98 59.76 1fr0 h ARG 762 Cb 0.74 0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.19 1fr0 h ARG 762 CO -0.75 -0.01 0.29 1.25 -1.51 0.00 0.00 179.97 179.23 1fr0 h HIS 763 N -0.02 0.48 -0.96 2.20 2.76 -1.00 0.34 115.15 118.95 1fr0 h HIS 763 Ca 0.25 0.04 0.08 0.00 -2.20 0.00 0.00 60.37 58.54 1fr0 h HIS 763 Cb 0.40 -0.09 -0.07 0.00 1.55 0.00 0.00 27.41 29.20 1fr0 h HIS 763 CO -0.45 0.01 0.62 -0.44 -1.30 0.00 0.00 177.93 176.37 1fr0 h ASP 764 N 0.40 0.94 -0.07 3.26 5.19 -0.40 -1.69 116.42 124.05 1fr0 h ASP 764 Ca 0.44 0.02 -0.18 0.00 -0.62 0.00 0.00 57.03 56.69 1fr0 h ASP 764 Cb 0.72 -0.18 0.01 0.00 0.18 0.00 0.00 39.33 40.06 1fr0 h ASP 764 CO -0.45 0.57 -0.64 0.58 -3.12 0.00 0.00 179.24 176.18 1fr0 h VAL 765 N 1.05 1.36 0.00 -1.35 2.07 0.05 -2.22 116.25 117.21 1fr0 h VAL 765 Ca 0.43 -1.98 0.00 0.00 0.82 0.00 0.00 66.70 65.97 1fr0 h VAL 765 Cb 0.29 2.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1fr0 h VAL 765 CO -0.19 0.60 0.00 1.21 0.02 0.00 0.00 177.57 179.21 1fr0 n GLU 766 N -4.14 0.00 -0.32 1.57 4.07 0.50 -1.17 120.64 121.15 1fr0 n GLU 766 Ca -0.09 0.57 0.16 0.00 -0.06 0.00 0.00 57.16 57.73 1fr0 n GLU 766 Cb 0.68 -1.46 0.35 0.00 -0.06 0.00 0.00 31.44 30.95 1fr0 n GLU 766 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1fr0 h VAL 767 N 0.00 0.48 -0.59 6.31 2.07 -1.48 0.28 116.25 123.32 1fr0 h VAL 767 Ca 0.00 -0.16 0.12 0.00 0.82 0.00 0.00 66.70 67.48 1fr0 h VAL 767 Cb 0.00 -0.02 -0.09 0.00 -1.52 0.00 0.00 31.29 29.66 1fr0 h VAL 767 CO 0.00 0.08 0.05 0.25 0.02 0.00 0.00 177.57 177.97 1fr0 h LEU 768 N 0.46 -0.16 -0.03 2.57 5.85 -0.92 0.17 115.31 123.25 1fr0 h LEU 768 Ca 0.60 0.13 0.01 0.00 0.84 0.00 0.00 57.88 59.47 1fr0 h LEU 768 Cb 1.17 0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.40 1fr0 h LEU 768 CO -0.52 -0.07 -0.05 0.11 -0.34 0.00 0.00 178.44 177.57 1fr0 h LYS 769 N 0.17 -0.08 -0.05 1.25 1.57 0.11 -0.56 116.57 118.97 1fr0 h LYS 769 Ca 0.31 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.11 1fr0 h LYS 769 Cb 0.49 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.82 1fr0 h LYS 769 CO -0.47 -0.05 0.05 0.00 -0.57 0.00 0.00 179.45 178.41 1fr0 h ALA 770 N 0.94 1.77 0.66 3.86 0.00 -0.86 -2.11 119.26 123.51 1fr0 h ALA 770 Ca 0.03 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1fr0 h ALA 770 Cb 0.13 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.93 1fr0 h ALA 770 CO -0.08 -0.08 -0.32 2.35 0.00 0.00 0.00 179.25 181.13 1fr0 h TRP 771 N 0.00 -0.82 0.10 0.00 7.01 0.91 -1.65 115.95 121.50 1fr0 h TRP 771 Ca 0.02 -0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 1fr0 h TRP 771 Cb 0.12 0.27 0.00 0.00 -2.10 0.00 0.00 29.16 27.45 1fr0 h TRP 771 CO 0.00 -0.47 -0.05 0.28 -2.79 0.00 0.00 178.44 175.41 1fr0 h VAL 772 N -1.05 0.91 -0.81 2.65 2.07 -1.12 2.18 116.25 121.09 1fr0 h VAL 772 Ca -0.09 -0.04 0.17 0.00 0.82 0.00 0.00 66.70 67.55 1fr0 h VAL 772 Cb 0.72 0.94 -0.10 0.00 -1.52 0.00 0.00 31.29 31.32 1fr0 h VAL 772 CO 0.15 0.01 0.34 0.00 0.02 0.00 0.00 177.57 178.09 1fr0 h ALA 773 N 0.74 1.19 0.00 1.67 0.00 -1.42 0.36 119.26 121.81 1fr0 h ALA 773 Ca -0.01 0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.82 1fr0 h ALA 773 Cb 0.12 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 1fr0 h ALA 773 CO 0.02 -0.23 -1.56 1.63 0.00 0.00 0.00 179.25 179.11 1fr0 n LYS 774 N -5.00 0.63 0.19 0.00 5.02 -0.62 -3.95 118.16 114.42 1fr0 n LYS 774 Ca 0.17 0.21 0.13 0.00 -2.02 0.00 0.00 58.31 56.80 1fr0 n LYS 774 Cb 0.49 -1.77 0.37 0.00 -0.02 0.00 0.00 35.03 34.09 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fr0 h ALA 775 N 1.33 1.00 -0.00 7.82 0.00 0.44 -2.97 119.26 126.89 1fr0 h ALA 775 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1fr0 h ALA 775 Cb 1.70 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1fr0 h ALA 775 CO 0.05 0.00 -0.12 -2.37 0.00 0.00 0.00 179.25 176.81 1fr0 n THR 776 N -2.79 0.00 -2.37 0.00 5.66 0.12 -4.82 114.28 110.08 1fr0 n THR 776 Ca 0.04 -0.01 -0.42 0.00 -3.05 0.00 0.00 64.05 60.60 1fr0 n THR 776 Cb 0.43 -0.27 -0.03 0.00 -1.55 0.00 0.00 70.33 68.91 1fr0 n THR 776 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1fr0 s LYS 777 N -2.82 4.42 0.00 1.09 3.01 -1.12 -5.10 119.74 119.21 1fr0 s LYS 777 Ca 0.19 1.84 0.00 0.00 -1.01 0.00 0.00 55.97 56.99 1fr0 s LYS 777 Cb 0.19 -3.31 0.00 0.00 -1.01 0.00 0.00 37.83 33.70 1fr0 s LYS 777 CO 0.54 -0.26 0.00 1.17 0.51 0.00 0.00 175.35 177.31