#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fr0 s THR 655 N 0.00 3.28 0.24 4.28 2.01 -1.26 -5.04 115.64 119.15 1fr0 s THR 655 Ca 0.00 1.06 -0.06 0.00 0.31 0.00 0.00 61.69 63.00 1fr0 s THR 655 Cb 0.00 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 1fr0 s THR 655 CO 0.00 0.09 0.33 -0.70 -0.69 0.00 0.00 174.62 173.65 1fr0 s GLU 656 N -2.29 1.44 0.00 4.92 2.12 -1.26 -5.18 118.70 118.46 1fr0 s GLU 656 Ca 0.57 -1.48 0.00 0.00 0.36 0.00 0.00 54.97 54.42 1fr0 s GLU 656 Cb -0.29 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.48 1fr0 s GLU 656 CO 0.36 -0.55 0.00 -0.85 -0.54 0.00 0.00 175.26 173.68 1fr0 n GLU 657 N -0.36 2.27 -3.02 4.30 0.28 -1.26 -5.18 120.64 117.67 1fr0 n GLU 657 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 1fr0 n GLU 657 Cb 0.64 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.51 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1fr0 n ASN 658 N 0.00 0.00 -0.09 -1.84 0.23 -1.26 -5.04 115.26 107.26 1fr0 n ASN 658 Ca 0.00 0.00 -0.11 0.00 -0.53 0.00 0.00 54.58 53.94 1fr0 n ASN 658 Cb 0.00 0.00 -0.12 0.00 -2.08 0.00 0.00 39.78 37.58 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 0.00 1.48 -4.41 0.53 7.64 -1.26 -4.83 113.62 112.78 1fr0 n SER 659 Ca 0.00 -0.05 -0.35 0.00 1.01 0.00 0.00 58.87 59.48 1fr0 n SER 659 Cb 0.00 0.36 0.09 0.00 -1.01 0.00 0.00 64.21 63.65 1fr0 n SER 659 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fr0 n LYS 660 N -2.85 -0.01 0.00 1.43 5.02 -1.26 -0.62 118.16 119.88 1fr0 n LYS 660 Ca -0.32 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.01 1fr0 n LYS 660 Cb 0.99 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 1fr0 n LYS 660 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1fr0 n SER 661 N -0.49 0.00 -0.08 4.39 2.88 -1.26 -4.22 113.62 114.84 1fr0 n SER 661 Ca 0.08 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.75 1fr0 n SER 661 Cb 0.52 0.00 0.49 0.00 -0.75 0.00 0.00 64.21 64.47 1fr0 n SER 661 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1fr0 n GLU 662 N 0.00 0.39 -0.00 -1.46 2.13 -0.96 -3.21 120.64 117.53 1fr0 n GLU 662 Ca 0.00 -0.16 0.10 0.00 0.66 0.00 0.00 57.16 57.76 1fr0 n GLU 662 Cb 0.00 -1.50 -0.14 0.00 0.27 0.00 0.00 31.44 30.07 1fr0 n GLU 662 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1fr0 n ALA 663 N -1.16 3.83 -0.07 4.31 0.00 0.21 -4.39 120.51 123.24 1fr0 n ALA 663 Ca 0.10 -0.55 -0.02 0.00 0.00 0.00 0.00 53.44 52.97 1fr0 n ALA 663 Cb 0.31 -0.74 -0.16 0.00 0.00 0.00 0.00 19.45 18.86 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 -1.83 0.00 -3.69 0.00 4.77 -1.24 -3.98 117.00 111.03 1fr0 n LEU 664 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 1fr0 n LEU 664 Cb 0.43 0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 41.77 1fr0 n LEU 664 CO 0.43 0.31 0.11 -1.48 -1.33 0.00 0.00 177.39 175.43 1fr0 s LEU 665 N -5.11 0.57 -0.54 2.23 2.34 -1.20 -2.96 118.68 114.02 1fr0 s LEU 665 Ca -0.09 -0.19 -0.28 0.00 0.06 0.00 0.00 54.13 53.63 1fr0 s LEU 665 Cb 0.09 1.64 0.03 0.00 -0.56 0.00 0.00 46.19 47.39 1fr0 s LEU 665 CO 0.85 -0.72 1.20 -0.62 -1.06 0.00 0.00 176.35 175.99 1fr0 s ASP 666 N -2.33 6.49 0.06 1.48 -1.08 -0.37 -4.41 116.67 116.50 1fr0 s ASP 666 Ca -0.02 0.27 -0.16 0.00 -0.52 0.00 0.00 52.55 52.12 1fr0 s ASP 666 Cb 0.00 -2.55 -0.19 0.00 -1.46 0.00 0.00 42.92 38.72 1fr0 s ASP 666 CO -0.06 -1.42 1.22 0.40 0.52 0.00 0.00 175.17 175.83 1fr0 h ILE 667 N 6.21 1.34 -0.00 4.11 1.08 -1.88 -2.11 117.51 126.26 1fr0 h ILE 667 Ca -0.24 -1.96 -0.00 0.00 -0.39 0.00 0.00 64.86 62.26 1fr0 h ILE 667 Cb 1.06 2.22 0.00 0.00 -3.07 0.00 0.00 36.82 37.03 1fr0 h ILE 667 CO 1.16 0.60 -0.01 1.55 -0.69 0.00 0.00 178.15 180.76 1fr0 h PRO 668 N 0.24 0.01 -0.79 2.37 0.13 -2.00 -2.66 132.00 129.30 1fr0 h PRO 668 Ca -0.06 -0.01 0.02 0.00 -0.87 0.00 0.00 66.00 65.08 1fr0 h PRO 668 Cb 1.32 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 1fr0 h PRO 668 CO 0.14 0.72 0.52 1.98 -0.23 0.00 0.00 178.00 181.12 1fr0 h MET 669 N -0.70 1.01 -0.67 0.86 4.05 -1.98 -1.43 114.93 116.08 1fr0 h MET 669 Ca -0.00 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.37 1fr0 h MET 669 Cb 0.72 -0.23 -0.03 0.00 -0.80 0.00 0.00 31.60 31.26 1fr0 h MET 669 CO 0.00 0.67 0.45 -0.07 0.23 0.00 0.00 176.91 178.19 1fr0 h LEU 670 N 1.04 0.77 0.16 3.39 3.38 -1.44 -1.37 115.31 121.24 1fr0 h LEU 670 Ca 0.30 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.24 1fr0 h LEU 670 Cb -0.07 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1fr0 h LEU 670 CO -0.08 0.56 -0.08 -0.08 0.09 0.00 0.00 178.44 178.85 1fr0 h GLU 671 N 0.91 -0.21 0.11 1.13 4.81 -1.02 -2.22 114.58 118.08 1fr0 h GLU 671 Ca 0.25 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1fr0 h GLU 671 Cb -0.10 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 29.28 1fr0 h GLU 671 CO -0.05 -0.09 -0.50 0.37 -0.73 0.00 0.00 179.01 178.01 1fr0 h GLN 672 N -0.28 -0.70 -0.98 1.92 4.15 -0.99 0.08 115.11 118.31 1fr0 h GLN 672 Ca -0.02 0.05 0.30 0.00 0.77 0.00 0.00 58.65 59.75 1fr0 h GLN 672 Cb 0.22 0.16 -0.15 0.00 0.21 0.00 0.00 27.48 27.92 1fr0 h GLN 672 CO 0.04 -0.47 0.51 1.88 -1.93 0.00 0.00 178.83 178.86 1fr0 h TYR 673 N -0.73 0.83 0.00 3.99 0.05 -1.17 1.88 116.97 121.82 1fr0 h TYR 673 Ca 0.00 0.04 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 1fr0 h TYR 673 Cb 0.74 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 38.27 1fr0 h TYR 673 CO -0.44 -0.17 -0.02 -0.07 -1.05 0.00 0.00 178.16 176.41 1fr0 h LEU 674 N 0.32 0.00 -0.02 3.88 4.07 -0.39 0.11 115.31 123.28 1fr0 h LEU 674 Ca 0.70 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.66 1fr0 h LEU 674 Cb 1.56 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.30 1fr0 h LEU 674 CO -0.61 0.02 0.00 -0.62 -1.08 0.00 0.00 178.44 176.15 1fr0 n GLU 675 N -3.12 1.01 0.08 1.13 1.02 0.64 -3.33 120.64 118.07 1fr0 n GLU 675 Ca 0.00 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 1fr0 n GLU 675 Cb 0.30 -1.01 0.00 0.00 -0.02 0.00 0.00 31.44 30.71 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 -0.48 -1.10 0.04 -4.62 -0.00 -0.94 -4.93 117.00 104.96 1fr0 n LEU 676 Ca 0.00 0.30 0.11 0.00 -0.00 0.00 0.00 56.01 56.43 1fr0 n LEU 676 Cb 0.01 1.25 -0.07 0.00 -0.00 0.00 0.00 43.42 44.60 1fr0 n LEU 676 CO 0.00 -0.34 -0.32 1.33 -0.00 0.00 0.00 177.39 178.06 1fr0 n VAL 677 N -2.88 0.25 -4.12 1.47 0.24 0.31 -5.05 118.33 108.56 1fr0 n VAL 677 Ca 0.00 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.84 1fr0 n VAL 677 Cb 0.00 -0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.32 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 1.26 0.89 0.00 7.63 0.00 -0.77 -2.25 105.19 111.95 1fr0 n GLY 678 Ca -0.01 -0.80 0.09 0.00 0.00 0.00 0.00 46.02 45.29 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 0.80 0.00 1.61 -0.04 -1.26 -3.98 135.00 132.13 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 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 32.12 1fr0 n PRO 679 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1fr0 n LYS 680 N -0.84 0.00 0.20 0.54 4.81 -0.95 -0.35 118.16 121.56 1fr0 n LYS 680 Ca 0.13 0.37 0.11 0.00 -0.87 0.00 0.00 58.31 58.05 1fr0 n LYS 680 Cb 0.06 -1.18 0.14 0.00 0.02 0.00 0.00 35.03 34.07 1fr0 n LYS 680 CO 0.00 0.00 0.00 1.37 1.17 0.00 0.00 177.40 179.94 1fr0 h LEU 681 N 0.00 0.00 -0.10 3.14 8.10 -1.75 -3.03 115.31 121.68 1fr0 h LEU 681 Ca 0.00 0.00 -0.22 0.00 0.11 0.00 0.00 57.88 57.77 1fr0 h LEU 681 Cb 0.00 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.23 1fr0 h LEU 681 CO 0.00 0.06 -0.78 0.40 -4.11 0.00 0.00 178.44 174.01 1fr0 h ILE 682 N 0.00 1.30 -0.02 0.15 2.04 -1.68 0.21 117.51 119.51 1fr0 h ILE 682 Ca -0.00 -2.01 -0.19 0.00 1.00 0.00 0.00 64.86 63.66 1fr0 h ILE 682 Cb 1.05 2.14 0.01 0.00 -0.74 0.00 0.00 36.82 39.29 1fr0 h ILE 682 CO 0.01 0.63 -0.73 0.74 0.00 0.00 0.00 178.15 178.80 1fr0 h THR 683 N 0.40 1.37 0.01 -0.27 2.02 -0.78 -1.67 112.91 113.99 1fr0 h THR 683 Ca -0.07 -2.09 -0.00 0.00 0.77 0.00 0.00 66.41 65.02 1fr0 h THR 683 Cb 1.42 2.46 0.00 0.00 -1.74 0.00 0.00 68.15 70.30 1fr0 h THR 683 CO 0.16 0.63 -0.01 -0.78 0.37 0.00 0.00 175.52 175.89 1fr0 h ASP 684 N 0.09 -0.01 -0.87 4.18 3.58 -1.62 -2.06 116.42 119.71 1fr0 h ASP 684 Ca -0.09 -0.68 0.04 0.00 0.42 0.00 0.00 57.03 56.72 1fr0 h ASP 684 Cb 1.41 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 42.41 1fr0 h ASP 684 CO 0.14 0.69 0.57 1.23 -2.88 0.00 0.00 179.24 179.00 1fr0 h GLY 685 N -0.72 1.25 1.44 -0.78 0.00 -0.70 -1.59 103.07 101.97 1fr0 h GLY 685 Ca -0.00 -0.43 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 1fr0 h GLY 685 CO 0.00 0.37 -0.30 -2.00 0.00 0.00 0.00 176.54 174.61 1fr0 h LEU 686 N 1.08 0.65 0.45 3.11 5.85 -1.32 -2.77 115.31 122.36 1fr0 h LEU 686 Ca 0.35 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1fr0 h LEU 686 Cb 0.04 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 1fr0 h LEU 686 CO -0.11 0.91 -0.26 0.00 -0.34 0.00 0.00 178.44 178.65 1fr0 h ALA 687 N 1.13 -0.67 -0.34 1.25 0.00 -0.54 0.19 119.26 120.28 1fr0 h ALA 687 Ca 0.07 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1fr0 h ALA 687 Cb 0.79 0.31 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 1fr0 h ALA 687 CO 0.06 -0.89 -0.09 0.28 0.00 0.00 0.00 179.25 178.62 1fr0 h VAL 688 N -0.67 0.66 -0.25 0.00 2.07 -1.47 -0.27 116.25 116.31 1fr0 h VAL 688 Ca -0.05 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1fr0 h VAL 688 Cb 0.54 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 1fr0 h VAL 688 CO 0.06 0.00 0.05 0.15 0.02 0.00 0.00 177.57 177.86 1fr0 h PHE 689 N -0.00 0.36 0.00 1.57 3.57 -1.26 -0.97 116.94 120.21 1fr0 h PHE 689 Ca 0.16 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1fr0 h PHE 689 Cb 0.25 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1fr0 h PHE 689 CO -0.31 0.33 -0.17 0.93 -2.23 0.00 0.00 178.31 176.86 1fr0 h GLU 690 N 0.36 0.00 0.17 1.11 4.39 0.12 0.28 114.58 121.00 1fr0 h GLU 690 Ca 0.09 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.45 1fr0 h GLU 690 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 1fr0 h GLU 690 CO -0.00 0.17 -1.68 0.87 -1.16 0.00 0.00 179.01 177.20 1fr0 h LYS 691 N 0.00 0.35 -0.56 2.33 1.57 -0.58 -3.34 116.57 116.34 1fr0 h LYS 691 Ca -0.00 -0.60 0.00 0.00 -1.87 0.00 0.00 60.65 58.18 1fr0 h LYS 691 Cb 0.37 0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1fr0 h LYS 691 CO 0.02 1.29 0.00 -1.33 -0.57 0.00 0.00 179.45 178.86 1fr0 n MET 692 N -3.67 2.46 0.19 3.15 2.81 -0.71 -4.38 117.12 116.96 1fr0 n MET 692 Ca -0.25 -1.95 -0.13 0.00 -1.81 0.00 0.00 57.70 53.56 1fr0 n MET 692 Cb 1.03 -1.51 -0.08 0.00 -0.71 0.00 0.00 33.22 31.96 1fr0 n MET 692 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 1fr0 h MET 693 N 3.04 -0.49 0.00 0.03 2.86 -0.56 -2.14 114.93 117.67 1fr0 h MET 693 Ca 0.00 0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1fr0 h MET 693 Cb 0.84 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1fr0 h MET 693 CO 0.05 -0.18 0.00 -1.00 1.06 0.00 0.00 176.91 176.84 1fr0 h PRO 694 N -0.87 0.00 -0.02 -0.22 0.13 -1.82 -2.72 132.00 126.48 1fr0 h PRO 694 Ca -0.05 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.90 1fr0 h PRO 694 Cb 0.54 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.69 1fr0 h PRO 694 CO 0.09 0.00 -0.69 0.78 -0.23 0.00 0.00 178.00 177.94 1fr0 h GLY 695 N 2.08 0.56 1.14 1.56 0.00 -1.75 -1.99 103.07 104.67 1fr0 h GLY 695 Ca 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 47.33 46.27 1fr0 h GLY 695 CO 0.00 0.84 -0.12 -0.97 0.00 0.00 0.00 176.54 176.29 1fr0 h TYR 696 N 0.06 1.12 -0.39 5.60 0.05 -1.19 -2.74 116.97 119.48 1fr0 h TYR 696 Ca -0.08 -0.23 -0.05 0.00 0.05 0.00 0.00 58.73 58.42 1fr0 h TYR 696 Cb 1.38 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 38.83 1fr0 h TYR 696 CO 0.13 1.05 0.06 0.28 -1.05 0.00 0.00 178.16 178.63 1fr0 h VAL 697 N 0.89 1.24 -0.18 -2.88 2.07 -1.53 -2.64 116.25 113.23 1fr0 h VAL 697 Ca 0.14 -0.87 0.05 0.00 0.82 0.00 0.00 66.70 66.84 1fr0 h VAL 697 Cb 0.68 1.05 -0.06 0.00 -1.52 0.00 0.00 31.29 31.45 1fr0 h VAL 697 CO 0.05 0.30 -0.17 -1.28 0.02 0.00 0.00 177.57 176.48 1fr0 h SER 698 N 0.50 -0.55 -0.72 0.57 0.87 -1.23 -1.08 113.55 111.91 1fr0 h SER 698 Ca 0.12 0.10 0.12 0.00 -1.23 0.00 0.00 61.79 60.90 1fr0 h SER 698 Cb 0.37 0.27 -0.08 0.00 -0.44 0.00 0.00 62.40 62.52 1fr0 h SER 698 CO 0.01 -0.22 0.32 0.58 -0.53 0.00 0.00 176.83 176.99 1fr0 h VAL 699 N -0.19 0.75 -0.66 2.23 2.07 -1.37 -0.61 116.25 118.47 1fr0 h VAL 699 Ca 0.11 -0.17 0.14 0.00 0.82 0.00 0.00 66.70 67.60 1fr0 h VAL 699 Cb 0.36 0.20 -0.10 0.00 -1.52 0.00 0.00 31.29 30.23 1fr0 h VAL 699 CO -0.29 0.09 0.09 0.25 0.02 0.00 0.00 177.57 177.73 1fr0 h LEU 700 N 0.51 -0.11 -0.32 2.57 5.85 -0.83 0.43 115.31 123.40 1fr0 h LEU 700 Ca 0.37 0.14 0.03 0.00 0.84 0.00 0.00 57.88 59.27 1fr0 h LEU 700 Cb 0.49 0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 1fr0 h LEU 700 CO -0.33 -0.06 0.12 -0.08 -0.34 0.00 0.00 178.44 177.75 1fr0 h GLU 701 N 0.20 0.26 0.31 1.25 4.81 -0.73 -1.14 114.58 119.54 1fr0 h GLU 701 Ca 0.35 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.56 1fr0 h GLU 701 Cb 0.58 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.87 1fr0 h GLU 701 CO -0.49 0.17 -0.45 1.03 -0.73 0.00 0.00 179.01 178.54 1fr0 h SER 702 N 0.27 -1.27 -1.08 1.04 0.87 -0.60 -0.24 113.55 112.54 1fr0 h SER 702 Ca 0.14 0.11 0.29 0.00 -1.23 0.00 0.00 61.79 61.11 1fr0 h SER 702 Cb 0.10 0.44 -0.10 0.00 -0.44 0.00 0.00 62.40 62.40 1fr0 h SER 702 CO -0.14 -0.54 0.70 0.78 -0.53 0.00 0.00 176.83 177.10 1fr0 h ASN 703 N -0.79 0.40 -0.84 6.23 2.35 -1.04 0.50 115.58 122.39 1fr0 h ASN 703 Ca -0.04 0.09 0.07 0.00 -0.55 0.00 0.00 56.30 55.87 1fr0 h ASN 703 Cb 0.72 0.03 -0.06 0.00 0.05 0.00 0.00 38.32 39.05 1fr0 h ASN 703 CO -0.13 0.04 0.51 0.25 -1.65 0.00 0.00 177.43 176.46 1fr0 h LEU 704 N 0.33 0.79 -1.33 1.61 7.12 0.25 0.17 115.31 124.24 1fr0 h LEU 704 Ca 0.63 0.02 -0.04 0.00 0.13 0.00 0.00 57.88 58.62 1fr0 h LEU 704 Cb 1.69 -0.14 -0.01 0.00 -0.53 0.00 0.00 40.66 41.68 1fr0 h LEU 704 CO -0.30 0.49 -0.18 0.74 -0.13 0.00 0.00 178.44 179.06 1fr0 h THR 705 N 0.92 0.51 -0.20 1.05 2.02 0.50 -2.45 112.91 115.25 1fr0 h THR 705 Ca 0.38 -0.94 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1fr0 h THR 705 Cb 0.21 1.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.27 1fr0 h THR 705 CO -0.19 0.18 0.00 0.00 0.37 0.00 0.00 175.52 175.88 1fr0 n ALA 706 N -2.22 2.47 -3.67 6.16 0.00 0.12 -4.95 120.51 118.41 1fr0 n ALA 706 Ca -0.00 -0.76 -0.25 0.00 0.00 0.00 0.00 53.44 52.43 1fr0 n ALA 706 Cb 0.38 -0.93 0.06 0.00 0.00 0.00 0.00 19.45 18.96 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 1.10 -6.99 -2.21 0.00 6.02 0.35 -4.87 117.38 110.78 1fr0 n GLN 707 Ca 0.17 0.76 -0.41 0.00 -0.01 0.00 0.00 57.00 57.50 1fr0 n GLN 707 Cb 0.53 -5.73 0.00 0.00 1.02 0.00 0.00 30.24 26.06 1fr0 n GLN 707 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1fr0 n ASP 708 N -2.98 6.51 -0.27 1.08 -0.08 -0.78 -4.76 116.55 115.26 1fr0 n ASP 708 Ca -0.03 -3.14 0.05 0.00 -1.51 0.00 0.00 54.79 50.16 1fr0 n ASP 708 Cb 0.57 -1.41 0.19 0.00 2.34 0.00 0.00 41.12 42.81 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1fr0 h LYS 709 N 5.19 0.50 0.05 -0.67 3.64 -1.89 -0.48 116.57 122.91 1fr0 h LYS 709 Ca 0.53 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.88 1fr0 h LYS 709 Cb 0.48 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1fr0 h LYS 709 CO 1.55 0.33 -0.10 -0.22 -2.27 0.00 0.00 179.45 178.74 1fr0 h LYS 710 N 0.51 -0.15 -0.34 1.90 3.64 -2.00 -0.43 116.57 119.70 1fr0 h LYS 710 Ca 0.42 0.01 0.08 0.00 -1.27 0.00 0.00 60.65 59.89 1fr0 h LYS 710 Cb 0.61 0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.39 1fr0 h LYS 710 CO -0.38 -0.10 -0.19 0.78 -2.27 0.00 0.00 179.45 177.29 1fr0 h GLY 711 N -0.16 0.05 -0.51 5.01 0.00 -1.91 -0.66 103.07 104.89 1fr0 h GLY 711 Ca -0.00 0.24 0.22 0.00 0.00 0.00 0.00 47.33 47.79 1fr0 h GLY 711 CO -0.04 -0.19 0.12 -2.22 0.00 0.00 0.00 176.54 174.21 1fr0 h ILE 712 N -0.14 0.27 -0.30 2.60 2.04 -0.83 0.15 117.51 121.29 1fr0 h ILE 712 Ca 0.17 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1fr0 h ILE 712 Cb 0.41 0.12 -0.01 0.00 -0.74 0.00 0.00 36.82 36.59 1fr0 h ILE 712 CO -0.43 0.02 0.20 0.58 0.00 0.00 0.00 178.15 178.52 1fr0 h VAL 713 N 0.14 1.08 0.70 1.67 2.07 0.50 0.71 116.25 123.13 1fr0 h VAL 713 Ca 0.52 -0.17 -0.03 0.00 0.82 0.00 0.00 66.70 67.83 1fr0 h VAL 713 Cb 1.01 0.66 0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1fr0 h VAL 713 CO -0.71 0.08 -0.34 -0.33 0.02 0.00 0.00 177.57 176.30 1fr0 h GLU 714 N 0.40 -0.91 0.00 1.57 5.08 -0.41 -1.71 114.58 118.60 1fr0 h GLU 714 Ca 0.11 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1fr0 h GLU 714 Cb -0.03 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1fr0 h GLU 714 CO -0.02 -0.61 0.06 -0.85 -1.00 0.00 0.00 179.01 176.59 1fr0 n GLU 715 N -4.73 0.12 0.00 2.33 0.28 -0.57 -1.43 120.64 116.64 1fr0 n GLU 715 Ca -0.12 0.61 0.00 0.00 -0.16 0.00 0.00 57.16 57.49 1fr0 n GLU 715 Cb 0.37 -1.95 0.00 0.00 1.43 0.00 0.00 31.44 31.29 1fr0 n GLU 715 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1fr0 n GLY 716 N -1.31 -1.23 0.08 -1.84 0.00 0.24 -1.91 105.19 99.23 1fr0 n GLY 716 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 1fr0 n GLY 716 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1fr0 n HIS 717 N -1.64 0.53 -0.04 1.61 1.44 -0.99 -1.64 115.22 114.48 1fr0 n HIS 717 Ca 0.00 0.20 -0.15 0.00 -2.01 0.00 0.00 57.72 55.76 1fr0 n HIS 717 Cb 0.00 -0.83 -0.13 0.00 0.12 0.00 0.00 29.99 29.15 1fr0 n HIS 717 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 1fr0 h LYS 718 N 0.00 0.07 0.00 -1.40 1.57 -1.33 -2.82 116.57 112.65 1fr0 h LYS 718 Ca 0.00 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 1fr0 h LYS 718 Cb 0.34 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1fr0 h LYS 718 CO 0.00 1.06 -0.03 0.82 -0.57 0.00 0.00 179.45 180.73 1fr0 h ILE 719 N -0.85 0.00 -0.71 1.86 1.08 -1.32 -2.12 117.51 115.44 1fr0 h ILE 719 Ca -0.04 -0.94 0.11 0.00 -0.39 0.00 0.00 64.86 63.61 1fr0 h ILE 719 Cb 1.15 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.82 1fr0 h ILE 719 CO 0.03 0.00 0.30 0.11 -0.69 0.00 0.00 178.15 177.91 1fr0 h LYS 720 N -0.94 0.48 -0.04 2.37 6.56 -1.47 0.06 116.57 123.59 1fr0 h LYS 720 Ca 0.00 -0.03 -0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1fr0 h LYS 720 Cb 0.03 -0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 31.58 1fr0 h LYS 720 CO 0.00 0.32 0.02 0.78 -2.06 0.00 0.00 179.45 178.50 1fr0 h GLY 721 N 0.49 0.06 0.27 3.86 0.00 -1.60 -1.57 103.07 104.58 1fr0 h GLY 721 Ca 0.37 -0.03 0.11 0.00 0.00 0.00 0.00 47.33 47.77 1fr0 h GLY 721 CO -0.34 0.03 0.19 0.00 0.00 0.00 0.00 176.54 176.42 1fr0 h ALA 722 N 0.86 0.78 -0.85 3.60 0.00 -0.56 -0.25 119.26 122.83 1fr0 h ALA 722 Ca 0.01 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1fr0 h ALA 722 Cb 0.16 0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 1fr0 h ALA 722 CO -0.00 -0.25 0.55 0.00 0.00 0.00 0.00 179.25 179.55 1fr0 h ALA 723 N 1.46 1.09 -0.10 0.00 0.00 -0.75 -0.69 119.26 120.26 1fr0 h ALA 723 Ca 0.32 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1fr0 h ALA 723 Cb 0.45 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1fr0 h ALA 723 CO -0.36 0.52 0.22 0.78 0.00 0.00 0.00 179.25 180.41 1fr0 h GLY 724 N 1.17 0.00 1.79 0.00 0.00 -0.02 0.17 103.07 106.18 1fr0 h GLY 724 Ca 0.31 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.50 1fr0 h GLY 724 CO -0.06 0.00 -0.61 0.23 0.00 0.00 0.00 176.54 176.10 1fr0 h SER 725 N 0.00 0.24 0.04 0.19 0.87 -0.82 -2.46 113.55 111.61 1fr0 h SER 725 Ca 0.05 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.47 1fr0 h SER 725 Cb 0.50 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.39 1fr0 h SER 725 CO -0.00 0.79 0.00 0.52 -0.53 0.00 0.00 176.83 177.61 1fr0 n VAL 726 N -3.86 0.00 0.00 2.23 0.31 0.55 -4.79 118.33 112.76 1fr0 n VAL 726 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.31 1fr0 n VAL 726 Cb 0.62 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 33.04 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 1.00 1.24 3.18 2.92 0.00 -0.93 -4.98 105.19 107.62 1fr0 n GLY 727 Ca 0.23 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 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 5.92 0.30 0.99 4.77 -0.23 -1.23 117.00 127.52 1fr0 n LEU 728 Ca 0.00 -4.66 0.19 0.00 -0.03 0.00 0.00 56.01 51.51 1fr0 n LEU 728 Cb 0.00 -1.52 0.90 0.00 -2.33 0.00 0.00 43.42 40.47 1fr0 n LEU 728 CO 0.00 1.13 1.07 0.08 -1.33 0.00 0.00 177.39 178.34 1fr0 h ARG 729 N 6.38 0.00 0.30 3.23 0.11 -1.72 -2.63 114.38 120.06 1fr0 h ARG 729 Ca 0.32 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.39 1fr0 h ARG 729 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.84 1fr0 h ARG 729 CO 1.38 0.00 -0.14 1.25 0.10 0.00 0.00 179.97 182.55 1fr0 h HIS 730 N 0.00 -0.38 -0.29 4.08 2.76 -1.66 -2.77 115.15 116.89 1fr0 h HIS 730 Ca 0.00 -0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.03 1fr0 h HIS 730 Cb 0.30 0.12 -0.00 0.00 1.55 0.00 0.00 27.41 29.38 1fr0 h HIS 730 CO 0.00 -0.14 -0.32 -0.07 -1.30 0.00 0.00 177.93 176.11 1fr0 h LEU 731 N -0.55 0.78 -0.74 0.26 3.38 -1.77 -2.62 115.31 114.04 1fr0 h LEU 731 Ca -0.04 -0.48 0.13 0.00 0.09 0.00 0.00 57.88 57.58 1fr0 h LEU 731 Cb 0.41 -0.22 -0.13 0.00 0.09 0.00 0.00 40.66 40.80 1fr0 h LEU 731 CO 0.07 1.10 -0.33 -0.61 0.09 0.00 0.00 178.44 178.76 1fr0 h GLN 732 N 0.47 -0.09 -0.25 1.13 -0.00 -1.22 0.84 115.11 116.00 1fr0 h GLN 732 Ca 0.04 0.01 -0.04 0.00 -0.00 0.00 0.00 58.65 58.66 1fr0 h GLN 732 Cb 0.89 0.02 -0.01 0.00 0.00 0.00 0.00 27.48 28.38 1fr0 h GLN 732 CO 0.08 -0.06 0.01 1.96 0.00 0.00 0.00 178.83 180.82 1fr0 h GLN 733 N -0.09 0.42 -0.14 1.69 7.50 -1.49 -2.77 115.11 120.24 1fr0 h GLN 733 Ca 0.29 -0.13 0.02 0.00 0.50 0.00 0.00 58.65 59.33 1fr0 h GLN 733 Cb 0.57 -0.04 -0.03 0.00 0.05 0.00 0.00 27.48 28.03 1fr0 h GLN 733 CO -0.80 0.58 -0.16 -0.07 -1.50 0.00 0.00 178.83 176.89 1fr0 h LEU 734 N 0.21 -0.55 -0.71 1.46 4.07 -0.49 -0.10 115.31 119.21 1fr0 h LEU 734 Ca 0.07 0.07 0.15 0.00 0.08 0.00 0.00 57.88 58.26 1fr0 h LEU 734 Cb 0.38 0.23 -0.12 0.00 1.08 0.00 0.00 40.66 42.22 1fr0 h LEU 734 CO 0.01 -0.11 -0.04 1.23 -1.08 0.00 0.00 178.44 178.46 1fr0 h GLY 735 N -0.09 0.72 -0.76 0.83 0.00 -1.27 0.36 103.07 102.86 1fr0 h GLY 735 Ca 0.02 0.13 0.37 0.00 0.00 0.00 0.00 47.33 47.85 1fr0 h GLY 735 CO -0.19 -0.26 0.56 -1.61 0.00 0.00 0.00 176.54 175.04 1fr0 h GLN 736 N 0.08 0.16 0.00 4.80 -0.00 -0.72 1.55 115.11 120.98 1fr0 h GLN 736 Ca 0.37 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 59.01 1fr0 h GLN 736 Cb 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 27.48 28.07 1fr0 h GLN 736 CO -0.64 0.11 -0.50 1.96 0.00 0.00 0.00 178.83 179.75 1fr0 h GLN 737 N 0.17 0.00 0.00 1.69 1.08 0.22 -3.29 115.11 114.99 1fr0 h GLN 737 Ca 0.79 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.93 1fr0 h GLN 737 Cb 1.96 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 29.38 1fr0 h GLN 737 CO -0.69 0.00 -0.28 0.82 -0.95 0.00 0.00 178.83 177.73 1fr0 h ILE 738 N 0.00 0.86 -0.26 2.54 2.04 0.31 -2.40 117.51 120.61 1fr0 h ILE 738 Ca 0.00 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.73 1fr0 h ILE 738 Cb 0.99 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 38.75 1fr0 h ILE 738 CO 0.00 0.28 0.00 0.00 0.00 0.00 0.00 178.15 178.43 1fr0 n GLN 739 N -3.70 2.74 -2.36 2.37 10.64 -0.89 -4.12 117.38 122.05 1fr0 n GLN 739 Ca -0.01 -1.41 -0.27 0.00 -1.83 0.00 0.00 57.00 53.48 1fr0 n GLN 739 Cb 0.39 -1.84 0.01 0.00 -0.86 0.00 0.00 30.24 27.94 1fr0 n GLN 739 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 1fr0 n SER 740 N 0.28 4.84 -2.27 2.61 3.41 -0.90 -4.90 113.62 116.70 1fr0 n SER 740 Ca 0.12 -3.73 -0.04 0.00 -0.26 0.00 0.00 58.87 54.96 1fr0 n SER 740 Cb 0.67 -0.45 -0.06 0.00 -0.26 0.00 0.00 64.21 64.11 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 -0.53 0.73 0.00 4.33 -0.04 -1.26 -2.86 135.00 135.37 1fr0 n PRO 741 Ca 0.41 -0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.52 1fr0 n PRO 741 Cb 0.71 -1.66 0.00 0.00 -0.04 0.00 0.00 33.50 32.52 1fr0 n PRO 741 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1fr0 n ASP 742 N 2.72 2.75 -4.74 3.54 8.00 -1.26 -4.98 116.55 122.58 1fr0 n ASP 742 Ca 0.15 -0.01 -0.41 0.00 0.71 0.00 0.00 54.79 55.23 1fr0 n ASP 742 Cb 0.34 0.57 -0.03 0.00 -0.02 0.00 0.00 41.12 41.98 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fr0 s LEU 743 N -1.70 4.43 0.38 0.64 1.02 -1.13 -4.88 118.68 117.45 1fr0 s LEU 743 Ca 0.00 2.38 0.28 0.00 0.02 0.00 0.00 54.13 56.81 1fr0 s LEU 743 Cb 0.00 -3.61 1.30 0.00 0.02 0.00 0.00 46.19 43.90 1fr0 s LEU 743 CO 0.00 -0.47 1.83 1.55 0.02 0.00 0.00 176.35 179.29 1fr0 h PRO 744 N 5.04 0.00 0.00 1.29 0.13 -1.96 -2.12 132.00 134.38 1fr0 h PRO 744 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1fr0 h PRO 744 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 1fr0 h PRO 744 CO 0.75 0.00 -1.95 0.00 -0.23 0.00 0.00 178.00 176.57 1fr0 n ALA 745 N -1.87 2.72 -0.12 -0.56 0.00 -1.26 -4.38 120.51 115.04 1fr0 n ALA 745 Ca 0.00 -0.51 -0.13 0.00 0.00 0.00 0.00 53.44 52.80 1fr0 n ALA 745 Cb 0.16 -0.69 -0.02 0.00 0.00 0.00 0.00 19.45 18.90 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 1.13 0.00 0.00 7.01 -1.74 0.18 115.95 122.53 1fr0 h TRP 746 Ca -0.02 -0.34 0.00 0.00 2.11 0.00 0.00 58.89 60.64 1fr0 h TRP 746 Cb 0.98 -0.24 0.00 0.00 -2.10 0.00 0.00 29.16 27.80 1fr0 h TRP 746 CO 0.00 1.17 0.00 1.49 -2.79 0.00 0.00 178.44 178.31 1fr0 h GLU 747 N 0.76 0.00 -0.02 2.65 4.22 -1.74 0.32 114.58 120.77 1fr0 h GLU 747 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.50 1fr0 h GLU 747 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1fr0 h GLU 747 CO 0.10 0.00 0.00 -3.47 -2.18 0.00 0.00 179.01 173.46 1fr0 n ASP 748 N -2.78 1.67 -0.02 1.04 -0.08 -0.93 -4.52 116.55 110.93 1fr0 n ASP 748 Ca -0.02 -1.35 0.03 0.00 -1.51 0.00 0.00 54.79 51.95 1fr0 n ASP 748 Cb 0.11 -0.01 -0.09 0.00 2.34 0.00 0.00 41.12 43.47 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 0.40 2.20 -0.32 1.67 3.02 0.58 -4.53 115.26 118.27 1fr0 n ASN 749 Ca 0.05 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.77 1fr0 n ASN 749 Cb 0.20 1.36 0.38 0.00 -0.61 0.00 0.00 39.78 41.10 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 0.38 -0.57 2.41 2.07 -1.22 0.14 116.25 119.47 1fr0 h VAL 750 Ca -0.08 -0.12 0.11 0.00 0.82 0.00 0.00 66.70 67.42 1fr0 h VAL 750 Cb 0.86 -0.01 -0.11 0.00 -1.52 0.00 0.00 31.29 30.50 1fr0 h VAL 750 CO 0.00 0.07 -0.28 1.23 0.02 0.00 0.00 177.57 178.61 1fr0 h GLY 751 N 0.36 0.04 1.20 2.17 0.00 -1.85 0.81 103.07 105.80 1fr0 h GLY 751 Ca 0.64 0.36 -0.11 0.00 0.00 0.00 0.00 47.33 48.22 1fr0 h GLY 751 CO -0.58 -0.22 -0.11 0.83 0.00 0.00 0.00 176.54 176.46 1fr0 h GLU 752 N -0.13 0.94 -0.63 4.80 5.08 -1.30 -2.74 114.58 120.60 1fr0 h GLU 752 Ca 0.24 -0.33 0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1fr0 h GLU 752 Cb 0.53 -0.07 -0.09 0.00 0.50 0.00 0.00 28.75 29.62 1fr0 h GLU 752 CO -0.65 0.99 0.17 -1.49 -1.00 0.00 0.00 179.01 177.04 1fr0 h TRP 753 N 0.84 0.28 -0.04 4.33 6.55 -0.31 0.31 115.95 127.91 1fr0 h TRP 753 Ca 0.13 0.04 -0.01 0.00 0.95 0.00 0.00 58.89 60.00 1fr0 h TRP 753 Cb 0.65 -0.03 -0.00 0.00 -0.86 0.00 0.00 29.16 28.92 1fr0 h TRP 753 CO 0.04 0.00 -0.02 0.82 -1.05 0.00 0.00 178.44 178.23 1fr0 h ILE 754 N 0.31 1.32 0.46 1.49 2.04 -1.12 -1.72 117.51 120.29 1fr0 h ILE 754 Ca 0.33 -1.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.18 1fr0 h ILE 754 Cb 0.48 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.45 1fr0 h ILE 754 CO -0.39 0.27 -0.42 -0.08 0.00 0.00 0.00 178.15 177.53 1fr0 h GLU 755 N -0.30 -0.85 0.04 2.37 4.81 -1.12 -2.28 114.58 117.25 1fr0 h GLU 755 Ca 0.01 0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.32 1fr0 h GLU 755 Cb 0.45 0.19 -0.03 0.00 0.63 0.00 0.00 28.75 29.99 1fr0 h GLU 755 CO 0.01 -0.57 -0.18 1.49 -0.73 0.00 0.00 179.01 179.03 1fr0 h GLU 756 N -0.89 -0.30 -0.36 1.92 4.81 -1.03 -1.95 114.58 116.78 1fr0 h GLU 756 Ca -0.05 0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1fr0 h GLU 756 Cb 0.77 0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.17 1fr0 h GLU 756 CO -0.04 -0.20 -0.32 1.98 -0.73 0.00 0.00 179.01 179.70 1fr0 h MET 757 N -0.31 -0.14 -0.04 1.92 4.05 -1.17 -1.90 114.93 117.35 1fr0 h MET 757 Ca 0.04 0.01 0.03 0.00 -0.28 0.00 0.00 59.70 59.50 1fr0 h MET 757 Cb 0.36 0.03 -0.06 0.00 -0.80 0.00 0.00 31.60 31.13 1fr0 h MET 757 CO -0.14 -0.09 -0.47 -0.22 0.23 0.00 0.00 176.91 176.22 1fr0 h LYS 758 N -0.14 -0.57 -2.86 0.39 3.11 -1.29 0.86 116.57 116.06 1fr0 h LYS 758 Ca 0.06 0.04 -0.61 0.00 -2.81 0.00 0.00 60.65 57.33 1fr0 h LYS 758 Cb 0.30 0.13 0.01 0.00 -1.00 0.00 0.00 32.23 31.67 1fr0 h LYS 758 CO -0.41 -0.38 3.28 0.39 -2.81 0.00 0.00 179.45 179.52 1fr0 n GLU 759 N -5.45 3.50 0.01 1.90 -0.58 -0.75 -3.92 120.64 115.34 1fr0 n GLU 759 Ca -0.06 -2.06 0.00 0.00 -0.42 0.00 0.00 57.16 54.62 1fr0 n GLU 759 Cb 0.38 -2.69 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 3.41 0.00 -0.32 3.49 2.13 -0.94 -4.84 120.64 123.57 1fr0 n GLU 760 Ca 0.74 0.00 0.08 0.00 0.66 0.00 0.00 57.16 58.64 1fr0 n GLU 760 Cb 0.32 0.00 0.24 0.00 0.27 0.00 0.00 31.44 32.28 1fr0 n GLU 760 CO 0.00 0.00 0.00 0.11 -0.41 0.00 0.00 177.13 176.83 1fr0 h TRP 761 N 0.00 0.93 -0.14 4.31 5.08 -0.96 -1.87 115.95 123.30 1fr0 h TRP 761 Ca 0.00 0.03 0.05 0.00 1.08 0.00 0.00 58.89 60.05 1fr0 h TRP 761 Cb 0.00 -0.28 -0.07 0.00 -3.00 0.00 0.00 29.16 25.82 1fr0 h TRP 761 CO 0.00 0.27 -0.37 0.00 -1.28 0.00 0.00 178.44 177.06 1fr0 h ARG 762 N 0.76 -0.43 -0.52 0.12 3.08 -1.78 -0.95 114.38 114.66 1fr0 h ARG 762 Ca 0.49 0.03 0.10 0.00 0.07 0.00 0.00 59.98 60.67 1fr0 h ARG 762 Cb 0.65 0.10 -0.10 0.00 0.08 0.00 0.00 29.97 30.70 1fr0 h ARG 762 CO -0.33 -0.28 -0.10 1.25 -1.07 0.00 0.00 179.97 179.43 1fr0 h HIS 763 N -0.44 -0.21 -0.90 3.04 2.76 -1.69 0.17 115.15 117.87 1fr0 h HIS 763 Ca 0.09 0.04 0.24 0.00 -2.20 0.00 0.00 60.37 58.55 1fr0 h HIS 763 Cb 0.59 0.18 -0.14 0.00 1.55 0.00 0.00 27.41 29.59 1fr0 h HIS 763 CO -0.45 -0.20 0.32 -0.44 -1.30 0.00 0.00 177.93 175.86 1fr0 h ASP 764 N 0.03 0.16 0.12 3.26 3.32 -0.90 -0.76 116.42 121.65 1fr0 h ASP 764 Ca 0.25 0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 1fr0 h ASP 764 Cb 0.39 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.16 1fr0 h ASP 764 CO -0.51 -0.11 -0.06 0.58 -1.72 0.00 0.00 179.24 177.42 1fr0 h VAL 765 N 0.27 1.06 -0.66 -1.35 2.07 -0.19 -1.73 116.25 115.72 1fr0 h VAL 765 Ca 0.58 -1.10 0.09 0.00 0.82 0.00 0.00 66.70 67.09 1fr0 h VAL 765 Cb 1.18 1.71 -0.11 0.00 -1.52 0.00 0.00 31.29 32.54 1fr0 h VAL 765 CO -0.61 0.25 -0.46 -0.08 0.02 0.00 0.00 177.57 176.68 1fr0 h GLU 766 N -0.72 -0.19 0.05 1.57 4.22 0.21 0.12 114.58 119.84 1fr0 h GLU 766 Ca -0.02 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.44 1fr0 h GLU 766 Cb 0.53 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1fr0 h GLU 766 CO 0.03 -0.12 -0.05 0.28 -2.18 0.00 0.00 179.01 176.96 1fr0 h VAL 767 N -0.19 0.89 -0.55 0.32 2.07 -1.30 -2.59 116.25 114.90 1fr0 h VAL 767 Ca 0.18 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.78 1fr0 h VAL 767 Cb 0.55 0.89 -0.10 0.00 -1.52 0.00 0.00 31.29 31.11 1fr0 h VAL 767 CO -0.74 0.00 -0.49 0.25 0.02 0.00 0.00 177.57 176.61 1fr0 h LEU 768 N -0.11 -1.67 -0.69 2.57 5.85 -0.06 0.29 115.31 121.48 1fr0 h LEU 768 Ca 0.00 0.25 0.15 0.00 0.84 0.00 0.00 57.88 59.13 1fr0 h LEU 768 Cb 0.11 0.73 -0.12 0.00 0.37 0.00 0.00 40.66 41.75 1fr0 h LEU 768 CO -0.02 -0.35 -0.02 0.11 -0.34 0.00 0.00 178.44 177.82 1fr0 h LYS 769 N -0.27 0.09 -0.52 1.25 1.79 -0.62 0.82 116.57 119.11 1fr0 h LYS 769 Ca 0.14 -0.01 0.02 0.00 -2.18 0.00 0.00 60.65 58.63 1fr0 h LYS 769 Cb 0.56 -0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.17 1fr0 h LYS 769 CO -0.68 0.06 0.35 0.00 -1.08 0.00 0.00 179.45 178.10 1fr0 h ALA 770 N 1.65 1.69 0.22 3.86 0.00 -0.19 -1.97 119.26 124.52 1fr0 h ALA 770 Ca 0.37 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.26 1fr0 h ALA 770 Cb 0.62 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1fr0 h ALA 770 CO -0.62 0.27 -0.37 2.35 0.00 0.00 0.00 179.25 180.87 1fr0 h TRP 771 N 0.65 -1.03 0.00 0.00 7.01 0.35 0.84 115.95 123.77 1fr0 h TRP 771 Ca 0.20 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.22 1fr0 h TRP 771 Cb 0.01 0.42 -0.00 0.00 -2.10 0.00 0.00 29.16 27.49 1fr0 h TRP 771 CO -0.00 -0.50 -0.01 0.28 -2.79 0.00 0.00 178.44 175.43 1fr0 h VAL 772 N -0.67 0.05 -0.19 2.65 2.07 -1.06 1.64 116.25 120.74 1fr0 h VAL 772 Ca 0.00 -0.20 -0.19 0.00 0.82 0.00 0.00 66.70 67.13 1fr0 h VAL 772 Cb 0.66 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 1fr0 h VAL 772 CO -0.16 0.01 -0.65 0.00 0.02 0.00 0.00 177.57 176.79 1fr0 h ALA 773 N 1.99 0.51 0.00 1.67 0.00 -0.13 -3.36 119.26 119.93 1fr0 h ALA 773 Ca -0.00 -0.56 -0.14 0.00 0.00 0.00 0.00 54.91 54.22 1fr0 h ALA 773 Cb 0.19 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1fr0 h ALA 773 CO 0.00 0.70 -1.65 0.36 0.00 0.00 0.00 179.25 178.66 1fr0 n LYS 774 N -3.94 1.79 0.00 0.00 2.85 -0.52 -4.85 118.16 113.49 1fr0 n LYS 774 Ca -0.05 -0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.18 1fr0 n LYS 774 Cb 0.67 -1.26 0.00 0.00 -0.65 0.00 0.00 35.03 33.79 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1fr0 n ALA 775 N -2.25 0.00 -3.64 0.58 0.00 0.55 -4.87 120.51 110.88 1fr0 n ALA 775 Ca -0.13 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.98 1fr0 n ALA 775 Cb 0.69 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.16 1fr0 n ALA 775 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1fr0 n THR 776 N 0.00 -3.60 -1.79 0.00 -1.04 -1.26 -4.81 114.28 101.78 1fr0 n THR 776 Ca 0.00 0.04 -0.35 0.00 -2.04 0.00 0.00 64.05 61.70 1fr0 n THR 776 Cb 0.00 -3.24 0.00 0.00 -1.82 0.00 0.00 70.33 65.27 1fr0 n THR 776 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1fr0 n LYS 777 N -1.24 2.79 0.00 -2.82 5.02 -1.26 -5.16 118.16 115.48 1fr0 n LYS 777 Ca -0.19 -3.13 0.13 0.00 -2.02 0.00 0.00 58.31 53.10 1fr0 n LYS 777 Cb 0.69 -2.24 0.38 0.00 -0.02 0.00 0.00 35.03 33.84 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05