#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 -4.73 -1.93 1.09 -1.04 -1.26 -4.71 114.28 101.70 1fr0 n THR 655 Ca 0.00 0.38 -0.43 0.00 -2.04 0.00 0.00 64.05 61.96 1fr0 n THR 655 Cb 0.00 -4.03 -0.03 0.00 -1.82 0.00 0.00 70.33 64.45 1fr0 n THR 655 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 1fr0 s GLU 656 N -2.07 3.26 0.00 -2.82 2.56 -1.26 -4.84 118.70 113.54 1fr0 s GLU 656 Ca 0.26 1.50 0.00 0.00 0.00 0.00 0.00 54.97 56.72 1fr0 s GLU 656 Cb -0.03 -4.24 0.00 0.00 2.00 0.00 0.00 34.13 31.86 1fr0 s GLU 656 CO 0.64 -1.94 0.00 -1.91 -0.56 0.00 0.00 175.26 171.49 1fr0 n GLU 657 N 8.51 0.00 -0.35 4.30 2.13 -1.26 -5.16 120.64 128.81 1fr0 n GLU 657 Ca 0.24 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.77 1fr0 n GLU 657 Cb 0.47 0.00 0.27 0.00 0.27 0.00 0.00 31.44 32.45 1fr0 n GLU 657 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1fr0 n ASN 658 N -0.02 -3.16 -1.57 4.31 3.02 -1.26 -4.84 115.26 111.74 1fr0 n ASN 658 Ca 0.00 -0.56 -0.11 0.00 -0.03 0.00 0.00 54.58 53.88 1fr0 n ASN 658 Cb 0.00 -1.08 0.07 0.00 -0.61 0.00 0.00 39.78 38.16 1fr0 n ASN 658 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1fr0 n SER 659 N -5.09 3.66 -4.75 6.41 3.41 -1.26 -4.95 113.62 111.05 1fr0 n SER 659 Ca 0.08 -2.74 -0.37 0.00 -0.26 0.00 0.00 58.87 55.58 1fr0 n SER 659 Cb 0.57 -0.69 0.03 0.00 -0.26 0.00 0.00 64.21 63.85 1fr0 n SER 659 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1fr0 s LYS 660 N -1.47 3.21 -1.58 4.33 -0.14 -1.26 -2.45 119.74 120.39 1fr0 s LYS 660 Ca 0.25 2.02 -0.06 0.00 -1.36 0.00 0.00 55.97 56.82 1fr0 s LYS 660 Cb 0.21 -2.19 0.05 0.00 -1.68 0.00 0.00 37.83 34.23 1fr0 s LYS 660 CO 0.04 -1.07 0.30 0.43 -0.76 0.00 0.00 175.35 174.29 1fr0 n SER 661 N -1.09 -0.31 0.00 2.83 7.64 -1.26 -4.63 113.62 116.80 1fr0 n SER 661 Ca 0.11 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.82 1fr0 n SER 661 Cb 0.47 -2.14 0.00 0.00 -1.01 0.00 0.00 64.21 61.53 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 -4.44 0.00 0.00 1.43 0.00 -1.13 -4.88 120.64 111.62 1fr0 n GLU 662 Ca -0.21 0.00 0.14 0.00 0.00 0.00 0.00 57.16 57.09 1fr0 n GLU 662 Cb 0.63 -0.06 0.69 0.00 0.00 0.00 0.00 31.44 32.70 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 -1.88 2.38 -0.04 4.31 0.00 -1.02 -3.31 120.51 120.95 1fr0 n ALA 663 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 53.44 53.20 1fr0 n ALA 663 Cb 0.00 -1.46 -0.14 0.00 0.00 0.00 0.00 19.45 17.84 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 -1.36 1.10 -4.27 0.00 4.77 -1.26 -4.24 117.00 111.74 1fr0 n LEU 664 Ca 0.11 0.28 -0.15 0.00 -0.03 0.00 0.00 56.01 56.22 1fr0 n LEU 664 Cb 0.26 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.22 1fr0 n LEU 664 CO 0.23 0.51 -0.24 -1.48 -1.33 0.00 0.00 177.39 175.09 1fr0 s LEU 665 N -6.15 1.43 -0.34 2.23 0.05 -1.21 -2.27 118.68 112.42 1fr0 s LEU 665 Ca -0.10 -1.41 -0.21 0.00 0.05 0.00 0.00 54.13 52.46 1fr0 s LEU 665 Cb 0.07 0.20 0.00 0.00 -2.05 0.00 0.00 46.19 44.42 1fr0 s LEU 665 CO 0.81 -0.80 0.66 -0.62 -0.55 0.00 0.00 176.35 175.85 1fr0 s ASP 666 N -3.25 6.48 -0.07 1.48 -1.08 -0.90 -4.65 116.67 114.67 1fr0 s ASP 666 Ca 0.38 0.28 -0.24 0.00 -0.52 0.00 0.00 52.55 52.45 1fr0 s ASP 666 Cb 0.07 -2.34 -0.27 0.00 -1.46 0.00 0.00 42.92 38.92 1fr0 s ASP 666 CO 0.14 -0.59 0.91 0.40 0.52 0.00 0.00 175.17 176.55 1fr0 h ILE 667 N 5.65 1.59 -0.08 4.11 5.03 -1.93 -2.46 117.51 129.42 1fr0 h ILE 667 Ca -0.26 -2.30 -0.15 0.00 -0.12 0.00 0.00 64.86 62.02 1fr0 h ILE 667 Cb 1.11 3.09 0.01 0.00 -3.03 0.00 0.00 36.82 38.00 1fr0 h ILE 667 CO 0.84 0.64 -0.54 1.55 -0.68 0.00 0.00 178.15 179.96 1fr0 h PRO 668 N -0.54 0.51 -0.24 2.37 0.13 -1.98 -2.53 132.00 129.71 1fr0 h PRO 668 Ca -0.07 -0.44 -0.03 0.00 -0.87 0.00 0.00 66.00 64.59 1fr0 h PRO 668 Cb 1.29 0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 1fr0 h PRO 668 CO 0.08 1.07 0.03 1.98 -0.23 0.00 0.00 178.00 180.94 1fr0 h MET 669 N 0.09 0.40 0.46 0.86 4.05 -1.98 -2.16 114.93 116.65 1fr0 h MET 669 Ca -0.04 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1fr0 h MET 669 Cb 1.20 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.93 1fr0 h MET 669 CO 0.11 0.55 -0.40 -0.07 0.23 0.00 0.00 176.91 177.33 1fr0 h LEU 670 N 0.20 -1.07 -0.82 3.39 3.38 -1.51 -1.20 115.31 117.68 1fr0 h LEU 670 Ca 0.07 0.08 0.20 0.00 0.09 0.00 0.00 57.88 58.33 1fr0 h LEU 670 Cb 0.34 0.35 -0.13 0.00 0.09 0.00 0.00 40.66 41.31 1fr0 h LEU 670 CO 0.01 -0.57 0.15 -0.08 0.09 0.00 0.00 178.44 178.04 1fr0 h GLU 671 N -0.86 0.18 0.17 1.13 4.57 -1.43 0.95 114.58 119.29 1fr0 h GLU 671 Ca -0.04 -0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1fr0 h GLU 671 Cb 0.75 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 29.27 1fr0 h GLU 671 CO -0.03 0.12 -0.28 0.37 -1.18 0.00 0.00 179.01 178.01 1fr0 h GLN 672 N 0.18 -0.50 -0.43 1.92 4.15 -0.67 0.12 115.11 119.88 1fr0 h GLN 672 Ca 0.48 0.03 0.12 0.00 0.77 0.00 0.00 58.65 60.06 1fr0 h GLN 672 Cb 0.92 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.70 1fr0 h GLN 672 CO -0.64 -0.33 0.44 1.88 -1.93 0.00 0.00 178.83 178.25 1fr0 h TYR 673 N -0.52 0.00 -0.07 3.99 0.05 0.30 0.58 116.97 121.29 1fr0 h TYR 673 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1fr0 h TYR 673 Cb 0.52 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.26 1fr0 h TYR 673 CO -0.23 0.00 -0.01 1.25 -1.05 0.00 0.00 178.16 178.13 1fr0 h LEU 674 N 0.00 0.13 -0.08 3.88 7.12 0.56 -2.31 115.31 124.60 1fr0 h LEU 674 Ca 0.20 -0.33 0.00 0.00 0.13 0.00 0.00 57.88 57.88 1fr0 h LEU 674 Cb 1.08 -0.04 0.00 0.00 -0.53 0.00 0.00 40.66 41.18 1fr0 h LEU 674 CO -0.00 0.43 0.00 -1.84 -0.13 0.00 0.00 178.44 176.90 1fr0 n GLU 675 N -4.83 0.16 0.04 1.25 0.28 -0.12 -1.67 120.64 115.76 1fr0 n GLU 675 Ca -0.07 0.18 -0.03 0.00 -0.16 0.00 0.00 57.16 57.08 1fr0 n GLU 675 Cb 0.20 -1.71 -0.01 0.00 1.43 0.00 0.00 31.44 31.35 1fr0 n GLU 675 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 1fr0 h LEU 676 N 0.00 -0.16 0.00 -1.84 3.38 -0.69 -3.44 115.31 112.56 1fr0 h LEU 676 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1fr0 h LEU 676 Cb 0.60 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1fr0 h LEU 676 CO 0.00 0.22 -0.84 1.33 0.09 0.00 0.00 178.44 179.24 1fr0 n VAL 677 N -4.38 0.00 0.00 1.22 0.24 -0.90 -5.09 118.33 109.43 1fr0 n VAL 677 Ca -0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.28 1fr0 n VAL 677 Cb 0.08 -0.65 0.00 0.00 -1.47 0.00 0.00 33.84 31.79 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 2.52 0.17 0.00 7.63 0.00 -0.67 -4.69 105.19 110.15 1fr0 n GLY 678 Ca 0.00 -2.30 0.12 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.85 0.30 0.02 1.61 -0.04 -1.26 -3.61 135.00 131.18 1fr0 n PRO 679 Ca 0.00 0.05 -0.12 0.00 -0.04 0.00 0.00 63.50 63.39 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 -0.11 -0.21 0.54 3.11 -1.97 0.14 116.57 118.07 1fr0 h LYS 680 Ca 0.00 0.01 -0.03 0.00 -2.81 0.00 0.00 60.65 57.82 1fr0 h LYS 680 Cb 0.26 0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.51 1fr0 h LYS 680 CO 0.00 0.37 0.00 1.25 -2.81 0.00 0.00 179.45 178.26 1fr0 h LEU 681 N -0.65 0.36 -0.52 5.20 5.85 -1.86 0.17 115.31 123.86 1fr0 h LEU 681 Ca -0.01 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 1fr0 h LEU 681 Cb 0.53 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.44 1fr0 h LEU 681 CO 0.02 0.57 0.23 0.40 -0.34 0.00 0.00 178.44 179.32 1fr0 h ILE 682 N 0.13 1.21 0.05 4.05 2.04 -1.63 0.40 117.51 123.75 1fr0 h ILE 682 Ca 0.06 -0.62 -0.00 0.00 1.00 0.00 0.00 64.86 65.30 1fr0 h ILE 682 Cb 0.39 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1fr0 h ILE 682 CO 0.01 0.24 -0.02 0.74 0.00 0.00 0.00 178.15 179.12 1fr0 h THR 683 N 0.70 0.00 -0.07 -0.27 2.02 -0.63 -1.34 112.91 113.32 1fr0 h THR 683 Ca 0.18 -0.06 0.04 0.00 0.77 0.00 0.00 66.41 67.33 1fr0 h THR 683 Cb 0.16 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.52 1fr0 h THR 683 CO -0.02 0.00 -0.23 -0.78 0.37 0.00 0.00 175.52 174.86 1fr0 h ASP 684 N -0.12 -0.70 -0.11 4.18 1.82 -0.77 0.23 116.42 120.94 1fr0 h ASP 684 Ca -0.01 0.11 0.04 0.00 -0.39 0.00 0.00 57.03 56.78 1fr0 h ASP 684 Cb 0.05 0.30 -0.06 0.00 0.68 0.00 0.00 39.33 40.30 1fr0 h ASP 684 CO 0.01 -0.29 -0.32 1.23 -1.61 0.00 0.00 179.24 178.26 1fr0 h GLY 685 N -0.33 -0.45 0.71 -0.78 0.00 -0.27 -2.36 103.07 99.59 1fr0 h GLY 685 Ca 0.08 0.39 0.01 0.00 0.00 0.00 0.00 47.33 47.81 1fr0 h GLY 685 CO -0.26 -0.22 -0.19 -2.00 0.00 0.00 0.00 176.54 173.87 1fr0 h LEU 686 N -0.41 -0.52 -1.00 3.11 5.85 -0.79 -1.96 115.31 119.59 1fr0 h LEU 686 Ca 0.09 0.06 0.39 0.00 0.84 0.00 0.00 57.88 59.25 1fr0 h LEU 686 Cb 0.55 0.19 -0.18 0.00 0.37 0.00 0.00 40.66 41.59 1fr0 h LEU 686 CO -0.34 -0.28 0.46 0.00 -0.34 0.00 0.00 178.44 177.95 1fr0 h ALA 687 N 0.42 1.99 -0.14 1.25 0.00 -0.06 0.77 119.26 123.48 1fr0 h ALA 687 Ca 0.02 0.27 -0.05 0.00 0.00 0.00 0.00 54.91 55.15 1fr0 h ALA 687 Cb 0.39 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 1fr0 h ALA 687 CO -0.09 -0.86 -0.09 0.28 0.00 0.00 0.00 179.25 178.49 1fr0 h VAL 688 N 0.03 1.33 0.00 0.00 2.07 -0.90 -1.74 116.25 117.04 1fr0 h VAL 688 Ca 0.80 -1.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 1fr0 h VAL 688 Cb 2.03 1.81 -0.00 0.00 -1.52 0.00 0.00 31.29 33.60 1fr0 h VAL 688 CO -0.78 0.35 -0.09 0.15 0.02 0.00 0.00 177.57 177.22 1fr0 h PHE 689 N -0.04 0.00 0.00 1.57 3.57 0.74 -2.26 116.94 120.52 1fr0 h PHE 689 Ca 0.03 0.00 -0.23 0.00 3.53 0.00 0.00 57.97 61.30 1fr0 h PHE 689 Cb 0.59 0.00 0.02 0.00 2.79 0.00 0.00 35.95 39.35 1fr0 h PHE 689 CO 0.07 0.09 -0.89 0.93 -2.23 0.00 0.00 178.31 176.28 1fr0 h GLU 690 N 0.00 0.60 -0.30 1.11 4.39 -0.32 0.17 114.58 120.23 1fr0 h GLU 690 Ca -0.00 -0.65 -0.00 0.00 0.34 0.00 0.00 59.36 59.05 1fr0 h GLU 690 Cb 0.19 0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1fr0 h GLU 690 CO 0.01 1.25 0.17 0.87 -1.16 0.00 0.00 179.01 180.16 1fr0 h LYS 691 N 0.21 0.40 0.00 2.33 1.57 -0.75 -1.49 116.57 118.85 1fr0 h LYS 691 Ca -0.11 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.64 1fr0 h LYS 691 Cb 1.57 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1fr0 h LYS 691 CO 0.18 0.29 -0.87 -0.12 -0.57 0.00 0.00 179.45 178.35 1fr0 n MET 692 N -4.47 0.09 -0.32 3.15 1.56 -0.98 -4.39 117.12 111.76 1fr0 n MET 692 Ca 0.01 -0.01 0.02 0.00 -0.27 0.00 0.00 57.70 57.46 1fr0 n MET 692 Cb 0.09 -1.52 0.09 0.00 2.15 0.00 0.00 33.22 34.02 1fr0 n MET 692 CO 0.00 0.00 0.00 1.98 -0.73 0.00 0.00 175.97 177.22 1fr0 h MET 693 N 0.00 -0.02 0.00 2.12 4.05 0.46 1.66 114.93 123.19 1fr0 h MET 693 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.41 1fr0 h MET 693 Cb 0.57 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.37 1fr0 h MET 693 CO 0.00 -0.01 -0.04 -1.00 0.23 0.00 0.00 176.91 176.08 1fr0 h PRO 694 N -0.02 0.00 0.08 0.39 0.13 -1.77 -2.19 132.00 128.62 1fr0 h PRO 694 Ca 0.39 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 65.31 1fr0 h PRO 694 Cb 0.63 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.78 1fr0 h PRO 694 CO -0.90 0.04 -0.84 0.78 -0.23 0.00 0.00 178.00 176.85 1fr0 h GLY 695 N 2.01 0.49 0.64 1.56 0.00 0.20 -2.41 103.07 105.57 1fr0 h GLY 695 Ca -0.00 -1.01 -0.03 0.00 0.00 0.00 0.00 47.33 46.29 1fr0 h GLY 695 CO 0.01 0.89 -0.30 -0.97 0.00 0.00 0.00 176.54 176.16 1fr0 h TYR 696 N -0.08 -0.79 -0.61 5.60 0.05 -0.45 -2.79 116.97 117.90 1fr0 h TYR 696 Ca -0.13 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.76 1fr0 h TYR 696 Cb 1.58 0.26 -0.10 0.00 1.01 0.00 0.00 36.73 39.48 1fr0 h TYR 696 CO 0.15 -0.48 0.05 0.28 -1.05 0.00 0.00 178.16 177.11 1fr0 h VAL 697 N -1.22 0.54 -0.27 -2.88 2.07 -1.55 -1.76 116.25 111.18 1fr0 h VAL 697 Ca -0.09 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.41 1fr0 h VAL 697 Cb 0.66 0.37 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 1fr0 h VAL 697 CO 0.14 0.03 -0.49 -1.28 0.02 0.00 0.00 177.57 175.99 1fr0 h SER 698 N 0.16 -1.62 -0.99 0.57 0.87 -1.43 0.27 113.55 111.38 1fr0 h SER 698 Ca 0.32 0.20 0.24 0.00 -1.23 0.00 0.00 61.79 61.33 1fr0 h SER 698 Cb 0.51 0.65 -0.12 0.00 -0.44 0.00 0.00 62.40 62.99 1fr0 h SER 698 CO -0.48 -0.39 0.57 0.58 -0.53 0.00 0.00 176.83 176.58 1fr0 h VAL 699 N -0.42 0.53 -0.83 2.23 2.07 -1.06 0.34 116.25 119.11 1fr0 h VAL 699 Ca 0.05 -0.19 0.16 0.00 0.82 0.00 0.00 66.70 67.53 1fr0 h VAL 699 Cb 0.56 -0.08 -0.10 0.00 -1.52 0.00 0.00 31.29 30.15 1fr0 h VAL 699 CO -0.48 0.10 0.39 0.25 0.02 0.00 0.00 177.57 177.86 1fr0 h LEU 700 N 0.56 0.43 0.20 2.57 7.12 0.19 0.14 115.31 126.52 1fr0 h LEU 700 Ca 0.64 0.11 -0.01 0.00 0.13 0.00 0.00 57.88 58.74 1fr0 h LEU 700 Cb 1.21 0.05 0.00 0.00 -0.53 0.00 0.00 40.66 41.39 1fr0 h LEU 700 CO -0.48 0.16 -0.10 -0.08 -0.13 0.00 0.00 178.44 177.81 1fr0 h GLU 701 N 0.54 -0.26 -0.98 1.25 4.22 0.12 -2.04 114.58 117.43 1fr0 h GLU 701 Ca 0.46 0.02 0.30 0.00 0.08 0.00 0.00 59.36 60.22 1fr0 h GLU 701 Cb 0.70 0.06 -0.14 0.00 0.50 0.00 0.00 28.75 29.87 1fr0 h GLU 701 CO -0.40 0.09 0.52 1.03 -2.18 0.00 0.00 179.01 178.07 1fr0 h SER 702 N -0.95 0.46 0.22 1.04 0.87 -0.89 0.13 113.55 114.43 1fr0 h SER 702 Ca -0.03 0.18 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 1fr0 h SER 702 Cb 0.47 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1fr0 h SER 702 CO 0.05 -0.11 -0.11 0.78 -0.53 0.00 0.00 176.83 176.91 1fr0 h ASN 703 N 0.34 -0.25 -1.13 6.23 2.35 -0.75 -2.84 115.58 119.52 1fr0 h ASN 703 Ca 0.69 -0.26 0.34 0.00 -0.55 0.00 0.00 56.30 56.53 1fr0 h ASN 703 Cb 1.53 0.07 -0.12 0.00 0.05 0.00 0.00 38.32 39.84 1fr0 h ASN 703 CO -0.60 0.18 0.71 0.25 -1.65 0.00 0.00 177.43 176.32 1fr0 h LEU 704 N -0.75 0.39 -0.99 1.61 5.85 -0.25 1.42 115.31 122.60 1fr0 h LEU 704 Ca -0.03 0.13 -0.09 0.00 0.84 0.00 0.00 57.88 58.73 1fr0 h LEU 704 Cb 0.50 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1fr0 h LEU 704 CO 0.05 -0.07 -0.45 0.74 -0.34 0.00 0.00 178.44 178.37 1fr0 h THR 705 N 0.26 1.14 -0.49 1.05 2.02 -1.15 -2.65 112.91 113.10 1fr0 h THR 705 Ca 0.72 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1fr0 h THR 705 Cb 1.94 1.93 0.00 0.00 -1.74 0.00 0.00 68.15 70.28 1fr0 h THR 705 CO -0.43 0.44 0.00 0.00 0.37 0.00 0.00 175.52 175.90 1fr0 n ALA 706 N -2.37 2.92 -2.05 6.16 0.00 0.48 -4.89 120.51 120.75 1fr0 n ALA 706 Ca -0.01 -1.16 -0.15 0.00 0.00 0.00 0.00 53.44 52.12 1fr0 n ALA 706 Cb 0.51 -1.02 -0.02 0.00 0.00 0.00 0.00 19.45 18.92 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 0.80 -1.17 -2.10 0.00 3.00 -0.64 -4.89 117.38 112.38 1fr0 n GLN 707 Ca 0.19 0.82 -0.42 0.00 -0.01 0.00 0.00 57.00 57.58 1fr0 n GLN 707 Cb 0.68 -5.11 0.00 0.00 0.00 0.00 0.00 30.24 25.81 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 -0.78 4.84 0.21 1.08 8.00 -0.79 -4.70 116.55 124.41 1fr0 n ASP 708 Ca -0.17 -3.01 0.06 0.00 0.71 0.00 0.00 54.79 52.38 1fr0 n ASP 708 Cb 0.60 -1.54 0.48 0.00 -0.02 0.00 0.00 41.12 40.64 1fr0 n ASP 708 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1fr0 h LYS 709 N 5.77 0.00 0.47 -1.24 1.57 -1.90 -2.21 116.57 119.03 1fr0 h LYS 709 Ca 0.47 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.23 1fr0 h LYS 709 Cb 0.61 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1fr0 h LYS 709 CO 1.72 0.27 -0.23 -0.22 -0.57 0.00 0.00 179.45 180.42 1fr0 h LYS 710 N 0.00 -0.61 -0.36 3.15 3.64 -1.99 -1.02 116.57 119.37 1fr0 h LYS 710 Ca -0.00 0.04 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1fr0 h LYS 710 Cb 0.53 0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.47 1fr0 h LYS 710 CO 0.03 -0.31 0.24 0.78 -2.27 0.00 0.00 179.45 177.93 1fr0 h GLY 711 N -1.03 0.40 0.59 5.01 0.00 -1.95 -0.48 103.07 105.62 1fr0 h GLY 711 Ca -0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 1fr0 h GLY 711 CO 0.11 0.12 -0.02 -2.22 0.00 0.00 0.00 176.54 174.53 1fr0 h ILE 712 N 0.35 1.35 -0.09 2.60 2.04 -1.32 0.58 117.51 123.02 1fr0 h ILE 712 Ca 0.15 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.87 1fr0 h ILE 712 Cb 0.16 2.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 1fr0 h ILE 712 CO -0.03 0.28 -0.30 0.58 0.00 0.00 0.00 178.15 178.68 1fr0 h VAL 713 N -0.37 1.25 0.00 1.67 2.07 -0.74 -0.15 116.25 119.97 1fr0 h VAL 713 Ca 0.00 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.34 1fr0 h VAL 713 Cb 0.47 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1fr0 h VAL 713 CO 0.00 0.35 -0.01 -0.08 0.02 0.00 0.00 177.57 177.86 1fr0 h GLU 714 N 0.14 0.00 0.00 1.57 4.57 -1.05 -3.21 114.58 116.59 1fr0 h GLU 714 Ca 0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.20 1fr0 h GLU 714 Cb 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1fr0 h GLU 714 CO 0.04 0.00 0.00 0.39 -1.18 0.00 0.00 179.01 178.26 1fr0 n GLU 715 N -4.53 0.02 0.06 1.92 -0.58 0.19 -1.59 120.64 116.13 1fr0 n GLU 715 Ca -0.00 0.43 -0.03 0.00 -0.42 0.00 0.00 57.16 57.14 1fr0 n GLU 715 Cb 0.01 -1.55 -0.01 0.00 -0.57 0.00 0.00 31.44 29.31 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 0.88 -0.21 1.69 0.62 0.00 -1.08 -2.59 103.07 102.38 1fr0 h GLY 716 Ca 0.00 0.08 -0.14 0.00 0.00 0.00 0.00 47.33 47.27 1fr0 h GLY 716 CO 0.00 -0.08 -0.52 1.12 0.00 0.00 0.00 176.54 177.07 1fr0 h HIS 717 N -0.56 0.40 -0.00 5.60 2.07 -1.54 -1.24 115.15 119.88 1fr0 h HIS 717 Ca -0.02 -0.14 -0.00 0.00 -2.85 0.00 0.00 60.37 57.36 1fr0 h HIS 717 Cb 0.16 -0.08 -0.00 0.00 2.57 0.00 0.00 27.41 30.06 1fr0 h HIS 717 CO 0.03 0.78 0.00 -0.22 -3.07 0.00 0.00 177.93 175.45 1fr0 h LYS 718 N 0.26 0.00 0.30 5.12 3.64 -1.44 1.02 116.57 125.47 1fr0 h LYS 718 Ca 0.01 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 1fr0 h LYS 718 Cb 1.00 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1fr0 h LYS 718 CO 0.09 0.08 -0.15 0.82 -2.27 0.00 0.00 179.45 178.02 1fr0 h ILE 719 N -0.07 0.00 -0.74 2.00 5.03 -1.45 -2.31 117.51 119.97 1fr0 h ILE 719 Ca 0.00 -0.46 0.09 0.00 -0.12 0.00 0.00 64.86 64.37 1fr0 h ILE 719 Cb 0.08 0.00 -0.07 0.00 -3.03 0.00 0.00 36.82 33.80 1fr0 h ILE 719 CO -0.00 0.00 0.40 0.11 -0.68 0.00 0.00 178.15 177.98 1fr0 h LYS 720 N -0.87 0.66 -0.88 2.37 6.56 -1.31 -0.31 116.57 122.79 1fr0 h LYS 720 Ca -0.04 -0.04 0.05 0.00 -1.06 0.00 0.00 60.65 59.56 1fr0 h LYS 720 Cb 0.31 -0.15 -0.05 0.00 -0.57 0.00 0.00 32.23 31.77 1fr0 h LYS 720 CO 0.07 0.44 0.58 0.78 -2.06 0.00 0.00 179.45 179.25 1fr0 h GLY 721 N 0.68 1.27 0.66 3.86 0.00 0.10 -1.61 103.07 108.02 1fr0 h GLY 721 Ca 0.36 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1fr0 h GLY 721 CO -0.24 0.34 -0.02 0.00 0.00 0.00 0.00 176.54 176.61 1fr0 h ALA 722 N 1.50 0.08 -0.80 3.60 0.00 -0.50 -3.12 119.26 120.02 1fr0 h ALA 722 Ca 0.36 -0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.15 1fr0 h ALA 722 Cb 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1fr0 h ALA 722 CO -0.12 -0.19 0.44 0.00 0.00 0.00 0.00 179.25 179.38 1fr0 h ALA 723 N 0.63 1.14 -0.27 0.00 0.00 -0.83 0.15 119.26 120.08 1fr0 h ALA 723 Ca 0.01 0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.04 1fr0 h ALA 723 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1fr0 h ALA 723 CO 0.01 0.05 0.41 0.78 0.00 0.00 0.00 179.25 180.49 1fr0 h GLY 724 N 0.74 0.00 2.00 0.00 0.00 -1.23 0.52 103.07 105.11 1fr0 h GLY 724 Ca 0.39 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.66 1fr0 h GLY 724 CO -0.26 0.00 -0.29 1.76 0.00 0.00 0.00 176.54 177.75 1fr0 h SER 725 N 0.00 0.00 -0.04 0.19 0.02 -0.73 -2.63 113.55 110.35 1fr0 h SER 725 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1fr0 h SER 725 Cb 0.94 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.48 1fr0 h SER 725 CO -0.00 0.29 0.00 0.52 -1.14 0.00 0.00 176.83 176.50 1fr0 n VAL 726 N -3.36 0.04 0.00 2.27 0.31 0.18 -4.83 118.33 112.94 1fr0 n VAL 726 Ca 0.01 -0.22 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 1fr0 n VAL 726 Cb 0.51 0.29 0.00 0.00 -0.91 0.00 0.00 33.84 33.73 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 1.12 1.13 2.96 2.92 0.00 -0.99 -4.93 105.19 107.40 1fr0 n GLY 727 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1fr0 n GLY 727 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fr0 n LEU 728 N 0.00 6.45 0.48 0.99 4.77 -0.10 -2.13 117.00 127.46 1fr0 n LEU 728 Ca 0.00 -4.72 -0.20 0.00 -0.03 0.00 0.00 56.01 51.06 1fr0 n LEU 728 Cb 0.00 -1.46 -0.10 0.00 -2.33 0.00 0.00 43.42 39.53 1fr0 n LEU 728 CO 0.00 1.36 0.56 0.03 -1.33 0.00 0.00 177.39 178.00 1fr0 h ARG 729 N 5.86 -1.20 -1.40 3.23 2.47 -1.61 -2.32 114.38 119.41 1fr0 h ARG 729 Ca 0.35 0.08 0.47 0.00 -1.26 0.00 0.00 59.98 59.63 1fr0 h ARG 729 Cb 0.66 0.27 -0.14 0.00 -1.65 0.00 0.00 29.97 29.12 1fr0 h ARG 729 CO 1.53 -0.80 0.90 1.25 0.56 0.00 0.00 179.97 183.41 1fr0 h HIS 730 N -1.25 0.49 -0.04 3.04 2.76 -1.63 0.52 115.15 119.05 1fr0 h HIS 730 Ca -0.12 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 57.97 1fr0 h HIS 730 Cb 0.97 -0.11 0.01 0.00 1.55 0.00 0.00 27.41 29.82 1fr0 h HIS 730 CO -0.04 -0.26 -0.38 -0.07 -1.30 0.00 0.00 177.93 175.88 1fr0 h LEU 731 N 0.02 0.40 -0.37 0.26 -0.00 -1.70 -2.76 115.31 111.15 1fr0 h LEU 731 Ca 0.87 -0.70 0.08 0.00 -0.00 0.00 0.00 57.88 58.13 1fr0 h LEU 731 Cb 2.83 -0.12 -0.08 0.00 -0.00 0.00 0.00 40.66 43.29 1fr0 h LEU 731 CO -0.44 1.04 -0.15 -0.61 -0.00 0.00 0.00 178.44 178.27 1fr0 h GLN 732 N -0.22 -0.08 0.39 1.13 4.15 0.55 -2.32 115.11 118.72 1fr0 h GLN 732 Ca -0.04 0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.37 1fr0 h GLN 732 Cb 1.07 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.78 1fr0 h GLN 732 CO 0.08 -0.05 -0.19 1.96 -1.93 0.00 0.00 178.83 178.69 1fr0 h GLN 733 N -0.08 -0.51 -0.98 1.69 1.08 -1.52 -2.00 115.11 112.79 1fr0 h GLN 733 Ca 0.19 0.03 0.33 0.00 -1.45 0.00 0.00 58.65 57.75 1fr0 h GLN 733 Cb 0.37 0.12 -0.17 0.00 -0.05 0.00 0.00 27.48 27.74 1fr0 h GLN 733 CO -0.43 -0.29 0.30 -0.07 -0.95 0.00 0.00 178.83 177.38 1fr0 h LEU 734 N -0.61 -0.03 -0.04 1.46 4.07 -1.15 0.41 115.31 119.43 1fr0 h LEU 734 Ca -0.05 0.25 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 1fr0 h LEU 734 Cb 0.45 0.35 -0.00 0.00 1.08 0.00 0.00 40.66 42.54 1fr0 h LEU 734 CO 0.09 -0.34 -0.03 1.23 -1.08 0.00 0.00 178.44 178.31 1fr0 h GLY 735 N 0.06 0.09 -0.89 0.83 0.00 -1.14 -1.03 103.07 100.99 1fr0 h GLY 735 Ca 0.70 -0.09 0.39 0.00 0.00 0.00 0.00 47.33 48.33 1fr0 h GLY 735 CO -0.80 0.08 1.07 -1.61 0.00 0.00 0.00 176.54 175.28 1fr0 h GLN 736 N -0.37 0.00 0.00 4.80 4.15 0.54 1.22 115.11 125.45 1fr0 h GLN 736 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1fr0 h GLN 736 Cb 0.52 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.21 1fr0 h GLN 736 CO 0.01 0.00 -1.70 1.04 -1.93 0.00 0.00 178.83 176.24 1fr0 n GLN 737 N -3.86 0.50 0.20 1.69 6.02 -0.84 -4.21 117.38 116.88 1fr0 n GLN 737 Ca 0.29 -0.14 0.07 0.00 -0.01 0.00 0.00 57.00 57.21 1fr0 n GLN 737 Cb 1.49 -1.53 0.40 0.00 1.02 0.00 0.00 30.24 31.62 1fr0 n GLN 737 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.06 177.02 1fr0 h ILE 738 N 0.00 0.86 -0.29 5.09 6.09 0.29 -2.50 117.51 127.04 1fr0 h ILE 738 Ca 0.00 -1.33 0.00 0.00 -1.37 0.00 0.00 64.86 62.16 1fr0 h ILE 738 Cb 0.88 1.81 0.00 0.00 0.47 0.00 0.00 36.82 39.98 1fr0 h ILE 738 CO 0.00 0.32 0.00 0.00 -3.07 0.00 0.00 178.15 175.40 1fr0 n GLN 739 N -3.60 1.99 -2.76 2.19 10.64 -0.95 -4.19 117.38 120.69 1fr0 n GLN 739 Ca -0.01 -1.18 -0.27 0.00 -1.83 0.00 0.00 57.00 53.71 1fr0 n GLN 739 Cb 0.46 -1.41 -0.02 0.00 -0.86 0.00 0.00 30.24 28.40 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 0.37 4.54 0.00 2.61 3.41 -0.94 -4.84 113.62 118.78 1fr0 n SER 740 Ca 0.11 -3.69 0.03 0.00 -0.26 0.00 0.00 58.87 55.05 1fr0 n SER 740 Cb 0.37 -0.52 0.17 0.00 -0.26 0.00 0.00 64.21 63.97 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 0.36 0.00 4.33 -0.04 -1.26 -2.76 135.00 135.29 1fr0 n PRO 741 Ca 0.34 0.00 0.14 0.00 -0.04 0.00 0.00 63.50 63.94 1fr0 n PRO 741 Cb 0.50 -1.25 0.60 0.00 -0.04 0.00 0.00 33.50 33.30 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 -0.75 0.03 -4.71 3.54 8.00 -1.26 -4.75 116.55 116.64 1fr0 n ASP 742 Ca 0.04 0.50 -0.42 0.00 0.71 0.00 0.00 54.79 55.63 1fr0 n ASP 742 Cb 0.02 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.58 1fr0 n ASP 742 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1fr0 s LEU 743 N -3.06 4.39 0.41 0.64 1.43 -1.11 -4.90 118.68 116.48 1fr0 s LEU 743 Ca 0.13 1.75 0.29 0.00 -1.03 0.00 0.00 54.13 55.28 1fr0 s LEU 743 Cb 0.18 -3.58 1.30 0.00 0.03 0.00 0.00 46.19 44.13 1fr0 s LEU 743 CO 0.52 -0.26 1.87 1.55 0.23 0.00 0.00 176.35 180.26 1fr0 h PRO 744 N 6.54 0.00 0.00 1.29 0.13 -1.94 -2.35 132.00 135.68 1fr0 h PRO 744 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1fr0 h PRO 744 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1fr0 h PRO 744 CO 0.75 0.00 -1.72 0.00 -0.23 0.00 0.00 178.00 176.81 1fr0 n ALA 745 N -1.91 3.35 0.09 -0.56 0.00 -1.26 -4.18 120.51 116.03 1fr0 n ALA 745 Ca 0.01 -0.54 -0.07 0.00 0.00 0.00 0.00 53.44 52.84 1fr0 n ALA 745 Cb 0.21 -0.75 -0.01 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 0.14 0.00 0.00 7.01 -1.78 -1.71 115.95 119.61 1fr0 h TRP 746 Ca 0.00 -0.08 0.00 0.00 2.11 0.00 0.00 58.89 60.92 1fr0 h TRP 746 Cb 0.86 -0.01 0.00 0.00 -2.10 0.00 0.00 29.16 27.90 1fr0 h TRP 746 CO 0.00 0.92 0.00 -0.85 -2.79 0.00 0.00 178.44 175.72 1fr0 n GLU 747 N -3.58 0.14 -0.00 2.65 0.28 -1.14 -1.15 120.64 117.83 1fr0 n GLU 747 Ca -0.02 0.13 0.07 0.00 -0.16 0.00 0.00 57.16 57.18 1fr0 n GLU 747 Cb 0.82 -1.67 -0.10 0.00 1.43 0.00 0.00 31.44 31.93 1fr0 n GLU 747 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 1fr0 n ASP 748 N -1.90 1.27 -0.00 -1.84 2.03 -1.16 -4.49 116.55 110.46 1fr0 n ASP 748 Ca 0.06 -0.36 0.04 0.00 0.52 0.00 0.00 54.79 55.06 1fr0 n ASP 748 Cb 0.37 1.37 -0.06 0.00 -0.72 0.00 0.00 41.12 42.08 1fr0 n ASP 748 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 1fr0 n ASN 749 N -1.70 1.10 -0.34 1.67 6.94 -0.65 -4.55 115.26 117.72 1fr0 n ASN 749 Ca -0.00 -0.52 0.15 0.00 -0.02 0.00 0.00 54.58 54.19 1fr0 n ASN 749 Cb 0.30 1.12 0.34 0.00 -2.36 0.00 0.00 39.78 39.18 1fr0 n ASN 749 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1fr0 h VAL 750 N 0.00 0.59 -0.40 3.53 2.07 -1.34 -1.59 116.25 119.10 1fr0 h VAL 750 Ca 0.00 -0.21 0.04 0.00 0.82 0.00 0.00 66.70 67.36 1fr0 h VAL 750 Cb 0.27 -0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 29.91 1fr0 h VAL 750 CO 0.00 0.11 -0.38 1.23 0.02 0.00 0.00 177.57 178.55 1fr0 h GLY 751 N 0.60 -1.36 0.77 2.17 0.00 -1.84 0.16 103.07 103.56 1fr0 h GLY 751 Ca 0.60 0.81 0.04 0.00 0.00 0.00 0.00 47.33 48.78 1fr0 h GLY 751 CO -0.45 -0.32 0.31 0.83 0.00 0.00 0.00 176.54 176.91 1fr0 h GLU 752 N -0.18 0.59 -0.87 4.80 5.08 -1.65 -1.58 114.58 120.76 1fr0 h GLU 752 Ca 0.07 -0.04 0.22 0.00 -1.00 0.00 0.00 59.36 58.61 1fr0 h GLU 752 Cb 0.36 -0.13 -0.15 0.00 0.50 0.00 0.00 28.75 29.33 1fr0 h GLU 752 CO -0.48 0.39 0.05 2.35 -1.00 0.00 0.00 179.01 180.33 1fr0 h TRP 753 N 0.60 0.02 0.00 4.33 2.91 0.04 0.89 115.95 124.75 1fr0 h TRP 753 Ca 0.24 0.06 -0.13 0.00 1.13 0.00 0.00 58.89 60.20 1fr0 h TRP 753 Cb 0.10 0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 28.86 1fr0 h TRP 753 CO -0.08 -0.30 -0.60 0.82 -1.03 0.00 0.00 178.44 177.25 1fr0 h ILE 754 N 0.09 1.30 0.31 2.65 2.04 0.02 -2.54 117.51 121.38 1fr0 h ILE 754 Ca 0.51 -2.14 -0.01 0.00 1.00 0.00 0.00 64.86 64.21 1fr0 h ILE 754 Cb 0.97 2.19 0.00 0.00 -0.74 0.00 0.00 36.82 39.25 1fr0 h ILE 754 CO -0.76 0.58 -0.15 -0.08 0.00 0.00 0.00 178.15 177.75 1fr0 h GLU 755 N 0.00 -0.39 -0.80 2.37 4.81 0.15 -2.49 114.58 118.22 1fr0 h GLU 755 Ca -0.01 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.30 1fr0 h GLU 755 Cb 1.15 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.57 1fr0 h GLU 755 CO 0.08 -0.08 0.53 1.49 -0.73 0.00 0.00 179.01 180.30 1fr0 h GLU 756 N -0.95 0.89 -0.17 1.92 4.81 -0.80 -2.21 114.58 118.06 1fr0 h GLU 756 Ca -0.04 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1fr0 h GLU 756 Cb 0.50 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1fr0 h GLU 756 CO 0.07 0.59 0.10 1.98 -0.73 0.00 0.00 179.01 181.02 1fr0 h MET 757 N 0.92 0.23 0.66 1.92 4.05 -1.47 -3.05 114.93 118.19 1fr0 h MET 757 Ca 0.34 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.71 1fr0 h MET 757 Cb 0.16 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 30.91 1fr0 h MET 757 CO -0.11 0.20 -0.48 -0.22 0.23 0.00 0.00 176.91 176.53 1fr0 h LYS 758 N 0.20 -1.04 -2.76 0.39 3.64 -0.93 0.20 116.57 116.27 1fr0 h LYS 758 Ca 0.06 0.07 -0.58 0.00 -1.27 0.00 0.00 60.65 58.93 1fr0 h LYS 758 Cb 0.03 0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1fr0 h LYS 758 CO -0.01 -0.70 2.87 -1.91 -2.27 0.00 0.00 179.45 177.44 1fr0 n GLU 759 N -5.40 3.43 0.01 1.90 2.13 -0.98 -3.94 120.64 117.79 1fr0 n GLU 759 Ca -0.13 -2.08 0.00 0.00 0.66 0.00 0.00 57.16 55.61 1fr0 n GLU 759 Cb 0.47 -2.62 0.00 0.00 0.27 0.00 0.00 31.44 29.55 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 3.17 0.00 -0.31 5.31 2.13 -1.10 -4.91 120.64 124.93 1fr0 n GLU 760 Ca 0.70 0.00 0.15 0.00 0.66 0.00 0.00 57.16 58.67 1fr0 n GLU 760 Cb 0.37 0.00 0.31 0.00 0.27 0.00 0.00 31.44 32.39 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 0.24 -0.05 4.31 5.08 -0.72 0.07 115.95 124.88 1fr0 h TRP 761 Ca 0.00 0.06 0.02 0.00 1.08 0.00 0.00 58.89 60.05 1fr0 h TRP 761 Cb 0.00 0.05 -0.05 0.00 -3.00 0.00 0.00 29.16 26.15 1fr0 h TRP 761 CO 0.00 -0.32 -0.49 -0.09 -1.28 0.00 0.00 178.44 176.26 1fr0 h ARG 762 N 0.11 -0.56 -0.83 0.12 2.43 -1.79 -0.85 114.38 113.02 1fr0 h ARG 762 Ca 0.59 0.04 0.16 0.00 -0.81 0.00 0.00 59.98 59.96 1fr0 h ARG 762 Cb 1.25 0.13 -0.16 0.00 -0.42 0.00 0.00 29.97 30.77 1fr0 h ARG 762 CO -0.76 -0.37 -0.22 1.25 -1.51 0.00 0.00 179.97 178.36 1fr0 h HIS 763 N -0.58 -0.47 -1.01 2.20 2.76 -1.36 0.99 115.15 117.69 1fr0 h HIS 763 Ca 0.02 0.08 0.24 0.00 -2.20 0.00 0.00 60.37 58.50 1fr0 h HIS 763 Cb 0.64 0.34 -0.12 0.00 1.55 0.00 0.00 27.41 29.82 1fr0 h HIS 763 CO -0.53 -0.36 0.60 0.22 -1.30 0.00 0.00 177.93 176.56 1fr0 h ASP 764 N -0.01 0.69 0.07 3.26 1.82 -0.88 -1.29 116.42 120.09 1fr0 h ASP 764 Ca 0.39 0.13 -0.00 0.00 -0.39 0.00 0.00 57.03 57.16 1fr0 h ASP 764 Cb 0.61 0.02 0.00 0.00 0.68 0.00 0.00 39.33 40.64 1fr0 h ASP 764 CO -0.86 0.14 -0.03 0.58 -1.61 0.00 0.00 179.24 177.45 1fr0 h VAL 765 N 0.61 1.03 -0.78 2.25 2.07 0.14 -2.13 116.25 119.44 1fr0 h VAL 765 Ca 0.63 -1.50 0.10 0.00 0.82 0.00 0.00 66.70 66.75 1fr0 h VAL 765 Cb 1.17 1.84 -0.12 0.00 -1.52 0.00 0.00 31.29 32.66 1fr0 h VAL 765 CO -0.46 0.31 -0.47 -0.08 0.02 0.00 0.00 177.57 176.89 1fr0 h GLU 766 N -0.91 -0.12 -0.26 1.57 4.22 -0.19 0.12 114.58 119.01 1fr0 h GLU 766 Ca -0.01 0.01 -0.01 0.00 0.08 0.00 0.00 59.36 59.43 1fr0 h GLU 766 Cb 0.58 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 1fr0 h GLU 766 CO 0.02 -0.08 0.13 0.28 -2.18 0.00 0.00 179.01 177.18 1fr0 h VAL 767 N -0.12 1.14 -0.78 0.32 2.07 -1.38 -2.68 116.25 114.80 1fr0 h VAL 767 Ca 0.21 -0.38 0.15 0.00 0.82 0.00 0.00 66.70 67.50 1fr0 h VAL 767 Cb 0.53 0.92 -0.15 0.00 -1.52 0.00 0.00 31.29 31.07 1fr0 h VAL 767 CO -0.82 0.13 -0.23 0.25 0.02 0.00 0.00 177.57 176.92 1fr0 h LEU 768 N 0.29 -0.84 -0.34 2.57 5.85 -0.13 0.34 115.31 123.05 1fr0 h LEU 768 Ca 0.09 0.24 0.03 0.00 0.84 0.00 0.00 57.88 59.08 1fr0 h LEU 768 Cb 0.10 0.52 -0.03 0.00 0.37 0.00 0.00 40.66 41.62 1fr0 h LEU 768 CO -0.01 -0.27 0.15 0.50 -0.34 0.00 0.00 178.44 178.46 1fr0 h LYS 769 N -0.02 0.30 -0.34 1.25 3.64 -0.77 -2.47 116.57 118.15 1fr0 h LYS 769 Ca 0.36 -0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.77 1fr0 h LYS 769 Cb 0.58 -0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.29 1fr0 h LYS 769 CO -0.81 0.20 0.08 0.00 -2.27 0.00 0.00 179.45 176.64 1fr0 h ALA 770 N 1.19 0.37 -0.76 5.00 0.00 -0.12 -1.86 119.26 123.08 1fr0 h ALA 770 Ca 0.15 0.06 0.15 0.00 0.00 0.00 0.00 54.91 55.26 1fr0 h ALA 770 Cb 0.09 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 17.85 1fr0 h ALA 770 CO -0.12 -0.32 0.29 2.35 0.00 0.00 0.00 179.25 181.44 1fr0 h TRP 771 N 0.20 0.49 -0.29 0.00 7.01 -0.50 0.14 115.95 123.00 1fr0 h TRP 771 Ca 0.16 0.04 -0.00 0.00 2.11 0.00 0.00 58.89 61.20 1fr0 h TRP 771 Cb 0.17 -0.10 -0.01 0.00 -2.10 0.00 0.00 29.16 27.12 1fr0 h TRP 771 CO -0.17 0.04 0.17 0.28 -2.79 0.00 0.00 178.44 175.96 1fr0 h VAL 772 N 0.42 1.11 0.00 2.65 2.07 -1.02 1.38 116.25 122.85 1fr0 h VAL 772 Ca 0.42 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.68 1fr0 h VAL 772 Cb 0.66 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1fr0 h VAL 772 CO -0.42 0.11 0.00 0.00 0.02 0.00 0.00 177.57 177.27 1fr0 h ALA 773 N 1.06 1.00 0.03 1.67 0.00 -0.70 -2.84 119.26 119.48 1fr0 h ALA 773 Ca 0.10 0.00 -0.39 0.00 0.00 0.00 0.00 54.91 54.63 1fr0 h ALA 773 Cb 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 1fr0 h ALA 773 CO -0.02 0.00 -2.28 1.17 0.00 0.00 0.00 179.25 178.12 1fr0 n LYS 774 N -3.05 0.66 -0.12 0.00 0.00 0.34 -4.44 118.16 111.55 1fr0 n LYS 774 Ca 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 58.31 58.48 1fr0 n LYS 774 Cb 0.28 -1.58 0.02 0.00 0.00 0.00 0.00 35.03 33.75 1fr0 n LYS 774 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1fr0 h ALA 775 N -0.21 0.49 -0.43 3.14 0.00 0.18 -3.32 119.26 119.10 1fr0 h ALA 775 Ca -0.55 0.02 -0.28 0.00 0.00 0.00 0.00 54.91 54.11 1fr0 h ALA 775 Cb 1.83 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.54 1fr0 h ALA 775 CO -0.12 -0.18 0.87 0.99 0.00 0.00 0.00 179.25 180.80 1fr0 s THR 776 N -6.15 3.45 0.00 0.00 2.01 -1.07 -4.74 115.64 109.14 1fr0 s THR 776 Ca -0.13 -0.73 0.00 0.00 0.31 0.00 0.00 61.69 61.14 1fr0 s THR 776 Cb 0.12 -4.41 0.00 0.00 0.01 0.00 0.00 72.50 68.22 1fr0 s THR 776 CO 0.72 -0.83 0.00 0.29 -0.69 0.00 0.00 174.62 174.11 1fr0 n LYS 777 N 8.33 0.00 0.00 4.92 5.02 -1.25 -4.98 118.16 130.19 1fr0 n LYS 777 Ca 0.44 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.75 1fr0 n LYS 777 Cb 0.47 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.60 1fr0 n LYS 777 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51