#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wok s SER 663 N 0.00 7.05 0.00 4.39 0.15 -1.26 -4.05 113.70 119.98 1wok s SER 663 Ca 0.00 1.30 0.25 0.00 0.70 0.00 0.00 55.95 58.20 1wok s SER 663 Cb 0.00 -2.37 0.57 0.00 -1.71 0.00 0.00 66.02 62.51 1wok s SER 663 CO 0.00 0.18 1.47 1.17 1.20 0.00 0.00 173.24 177.27 1wok n LYS 664 N 1.32 2.07 -2.74 5.44 4.81 -1.26 -4.92 118.16 122.88 1wok n LYS 664 Ca -0.07 -1.57 -0.33 0.00 -0.87 0.00 0.00 58.31 55.47 1wok n LYS 664 Cb 0.51 -1.47 -0.06 0.00 0.02 0.00 0.00 35.03 34.03 1wok n LYS 664 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1wok s LEU 665 N -1.86 3.87 0.34 3.14 1.43 -1.26 -4.99 118.68 119.35 1wok s LEU 665 Ca 0.33 1.63 -0.29 0.00 -1.03 0.00 0.00 54.13 54.78 1wok s LEU 665 Cb 0.20 -4.50 -0.11 0.00 0.03 0.00 0.00 46.19 41.81 1wok s LEU 665 CO 0.31 -0.40 1.46 -2.84 0.23 0.00 0.00 176.35 175.11 1wok s PRO 666 N -3.38 4.18 0.27 1.29 0.02 -1.26 -4.73 135.00 131.40 1wok s PRO 666 Ca 0.61 2.47 -0.04 0.00 0.02 0.00 0.00 61.00 64.05 1wok s PRO 666 Cb -0.09 -3.02 0.53 0.00 0.02 0.00 0.00 34.50 31.94 1wok s PRO 666 CO 0.18 -0.47 1.47 1.17 -0.33 0.00 0.00 177.00 179.02 1wok n LYS 667 N 1.09 -0.08 -0.30 5.54 4.81 -1.26 -0.65 118.16 127.31 1wok n LYS 667 Ca 0.03 1.45 0.07 0.00 -0.87 0.00 0.00 58.31 58.99 1wok n LYS 667 Cb 0.40 -2.21 0.23 0.00 0.02 0.00 0.00 35.03 33.46 1wok n LYS 667 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1wok h PRO 668 N 0.00 0.60 -0.23 1.64 0.11 -2.00 0.13 132.00 132.25 1wok h PRO 668 Ca 0.49 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 66.54 1wok h PRO 668 Cb 0.85 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.82 1wok h PRO 668 CO -0.94 0.40 0.03 0.28 -0.21 0.00 0.00 178.00 177.55 1wok h VAL 669 N 0.62 1.24 -0.97 3.15 2.07 -1.23 -2.37 116.25 118.75 1wok h VAL 669 Ca 0.47 -0.80 0.22 0.00 0.82 0.00 0.00 66.70 67.41 1wok h VAL 669 Cb 0.67 1.32 -0.08 0.00 -1.52 0.00 0.00 31.29 31.68 1wok h VAL 669 CO -0.37 0.25 0.63 1.56 0.02 0.00 0.00 177.57 179.66 1wok h GLN 670 N 0.17 0.47 -0.35 1.57 4.20 -0.27 0.17 115.11 121.08 1wok h GLN 670 Ca 0.07 -0.03 -0.10 0.00 0.06 0.00 0.00 58.65 58.65 1wok h GLN 670 Cb 0.35 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1wok h GLN 670 CO 0.01 0.31 -0.17 -0.44 -0.67 0.00 0.00 178.83 177.87 1wok h ASP 671 N 0.48 0.75 -0.48 1.46 5.19 -0.40 -2.76 116.42 120.66 1wok h ASP 671 Ca 0.53 -0.40 -0.11 0.00 -0.62 0.00 0.00 57.03 56.43 1wok h ASP 671 Cb 1.22 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.51 1wok h ASP 671 CO -0.26 0.99 -0.10 0.17 -3.12 0.00 0.00 179.24 176.92 1wok h LEU 672 N 0.51 0.96 0.34 1.55 8.10 -0.25 -0.25 115.31 126.26 1wok h LEU 672 Ca 0.08 -0.31 -0.01 0.00 0.11 0.00 0.00 57.88 57.75 1wok h LEU 672 Cb 0.70 -0.26 -0.01 0.00 -0.44 0.00 0.00 40.66 40.66 1wok h LEU 672 CO 0.05 1.07 -0.22 0.40 -4.11 0.00 0.00 178.44 175.63 1wok h ILE 673 N 0.86 0.53 -0.64 0.15 1.08 -1.22 0.20 117.51 118.47 1wok h ILE 673 Ca 0.14 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.61 1wok h ILE 673 Cb 0.65 0.53 -0.03 0.00 -3.07 0.00 0.00 36.82 34.90 1wok h ILE 673 CO 0.04 0.00 0.42 0.07 -0.69 0.00 0.00 178.15 177.99 1wok h LYS 674 N -0.55 0.84 0.16 2.37 2.10 -1.44 -2.75 116.57 117.30 1wok h LYS 674 Ca -0.03 -0.05 0.01 0.00 -2.00 0.00 0.00 60.65 58.58 1wok h LYS 674 Cb 0.46 -0.19 -0.03 0.00 -0.90 0.00 0.00 32.23 31.57 1wok h LYS 674 CO 0.03 0.56 -0.26 1.98 -2.00 0.00 0.00 179.45 179.76 1wok h MET 675 N 0.86 -0.47 -0.91 0.07 4.05 -0.73 -1.10 114.93 116.70 1wok h MET 675 Ca 0.23 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.69 1wok h MET 675 Cb -0.09 0.11 0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1wok h MET 675 CO -0.05 -0.31 0.00 0.44 0.23 0.00 0.00 176.91 177.22 1wok n ILE 676 N -5.37 0.08 -1.06 1.77 -5.35 0.03 -2.69 119.36 106.77 1wok n ILE 676 Ca -0.07 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.41 1wok n ILE 676 Cb 0.28 -0.49 0.00 0.00 -1.74 0.00 0.00 39.64 37.69 1wok n ILE 676 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1wok n PHE 677 N 0.10 0.00 -2.06 4.28 3.72 -0.63 -4.40 117.46 118.47 1wok n PHE 677 Ca 0.00 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.00 1wok n PHE 677 Cb 0.24 0.01 -0.03 0.00 -0.94 0.00 0.00 39.48 38.76 1wok n PHE 677 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1wok s ASP 678 N 0.00 5.60 0.30 4.37 3.68 -0.51 -4.81 116.67 125.29 1wok s ASP 678 Ca 0.00 0.73 0.20 0.00 2.13 0.00 0.00 52.55 55.61 1wok s ASP 678 Cb 0.00 -2.53 1.08 0.00 -1.45 0.00 0.00 42.92 40.03 1wok s ASP 678 CO 0.00 -2.05 1.61 0.52 0.13 0.00 0.00 175.17 175.39 1wok n VAL 679 N 7.27 1.11 -0.05 1.11 0.31 -1.26 -1.64 118.33 125.19 1wok n VAL 679 Ca 0.21 0.72 -0.16 0.00 -0.01 0.00 0.00 64.34 65.09 1wok n VAL 679 Cb 0.50 -1.72 -0.13 0.00 -0.91 0.00 0.00 33.84 31.58 1wok n VAL 679 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 1wok h GLU 680 N 0.00 0.07 0.00 5.55 4.81 -1.99 -2.90 114.58 120.11 1wok h GLU 680 Ca 0.00 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1wok h GLU 680 Cb 0.00 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.43 1wok h GLU 680 CO 0.00 1.05 0.00 0.66 -0.73 0.00 0.00 179.01 179.99 1wok h SER 681 N -0.85 0.00 0.15 1.04 4.64 -1.70 0.12 113.55 116.94 1wok h SER 681 Ca -0.07 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.24 1wok h SER 681 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1wok h SER 681 CO 0.01 0.00 -0.07 0.24 -0.87 0.00 0.00 176.83 176.14 1wok h MET 682 N 0.00 -0.20 -0.97 4.77 2.86 -1.37 -2.81 114.93 117.21 1wok h MET 682 Ca 0.00 0.01 0.05 0.00 -2.06 0.00 0.00 59.70 57.70 1wok h MET 682 Cb 0.16 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 31.80 1wok h MET 682 CO 0.00 0.25 0.63 0.87 1.06 0.00 0.00 176.91 179.72 1wok h LYS 683 N -0.84 1.14 -0.72 1.72 1.57 -0.93 0.15 116.57 118.66 1wok h LYS 683 Ca -0.02 -0.07 0.13 0.00 -1.87 0.00 0.00 60.65 58.82 1wok h LYS 683 Cb 0.53 -0.26 -0.05 0.00 0.08 0.00 0.00 32.23 32.54 1wok h LYS 683 CO 0.03 0.75 0.48 -0.22 -0.57 0.00 0.00 179.45 179.93 1wok h LYS 684 N 1.17 0.46 0.34 3.15 3.11 -0.86 -1.33 116.57 122.63 1wok h LYS 684 Ca 0.40 -0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 58.20 1wok h LYS 684 Cb 0.09 -0.10 0.00 0.00 -1.00 0.00 0.00 32.23 31.22 1wok h LYS 684 CO -0.14 0.31 -0.16 0.00 -2.81 0.00 0.00 179.45 176.64 1wok h ALA 685 N 1.65 -0.46 -0.94 5.00 0.00 -0.44 -1.80 119.26 122.27 1wok h ALA 685 Ca 0.35 -0.16 0.21 0.00 0.00 0.00 0.00 54.91 55.31 1wok h ALA 685 Cb 0.70 0.18 -0.12 0.00 0.00 0.00 0.00 17.79 18.55 1wok h ALA 685 CO -0.11 -0.65 0.50 0.52 0.00 0.00 0.00 179.25 179.51 1wok h MET 686 N -0.68 0.54 -0.01 0.00 2.86 -0.90 0.89 114.93 117.63 1wok h MET 686 Ca -0.05 -0.03 -0.16 0.00 -2.06 0.00 0.00 59.70 57.40 1wok h MET 686 Cb 0.48 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1wok h MET 686 CO 0.08 0.36 -0.73 0.28 1.06 0.00 0.00 176.91 177.96 1wok h VAL 687 N 0.55 1.50 -0.23 -2.22 2.07 -1.29 -0.90 116.25 115.74 1wok h VAL 687 Ca 0.57 -2.44 0.07 0.00 0.82 0.00 0.00 66.70 65.72 1wok h VAL 687 Cb 1.02 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 33.10 1wok h VAL 687 CO -0.46 0.70 0.18 -0.08 0.02 0.00 0.00 177.57 177.93 1wok h GLU 688 N 0.03 0.00 -0.66 1.57 4.57 0.09 0.23 114.58 120.41 1wok h GLU 688 Ca -0.01 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1wok h GLU 688 Cb 1.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.88 1wok h GLU 688 CO 0.10 0.00 0.00 0.66 -1.18 0.00 0.00 179.01 178.59 1wok n TYR 689 N -4.23 1.33 -1.03 0.92 4.01 -1.13 -4.92 117.16 112.11 1wok n TYR 689 Ca 0.02 -0.58 -0.01 0.00 -0.16 0.00 0.00 57.90 57.17 1wok n TYR 689 Cb 0.33 -0.18 -0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1wok n TYR 689 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 1wok n GLU 690 N 1.24 -1.37 -1.75 -0.72 1.02 0.82 -4.93 120.64 114.94 1wok n GLU 690 Ca 0.25 0.39 -0.42 0.00 -0.02 0.00 0.00 57.16 57.37 1wok n GLU 690 Cb 0.81 -4.44 -0.02 0.00 -0.02 0.00 0.00 31.44 27.77 1wok n GLU 690 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1wok s ILE 691 N -1.38 2.04 -0.74 -3.67 1.01 -0.36 0.13 121.20 118.24 1wok s ILE 691 Ca 0.00 0.03 -0.26 0.00 0.00 0.00 0.00 60.65 60.42 1wok s ILE 691 Cb 0.00 -3.02 0.02 0.00 0.01 0.00 0.00 42.46 39.47 1wok s ILE 691 CO 0.00 0.00 1.44 -0.62 0.00 0.00 0.00 174.94 175.76 1wok s ASP 692 N 0.87 5.97 0.58 3.58 2.15 0.90 -4.46 116.67 126.25 1wok s ASP 692 Ca 0.69 -0.37 0.30 0.00 0.43 0.00 0.00 52.55 53.60 1wok s ASP 692 Cb -0.49 -2.55 1.76 0.00 -0.30 0.00 0.00 42.92 41.33 1wok s ASP 692 CO 0.39 -1.95 2.21 -0.07 -0.17 0.00 0.00 175.17 175.58 1wok h LEU 693 N 13.88 0.00 0.86 -1.34 -0.00 -1.88 0.53 115.31 127.37 1wok h LEU 693 Ca -0.22 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.62 1wok h LEU 693 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.73 1wok h LEU 693 CO 1.28 0.03 -0.48 1.56 -0.00 0.00 0.00 178.44 180.83 1wok h GLN 694 N 0.00 -1.20 -0.62 1.13 1.08 -1.98 -3.05 115.11 110.47 1wok h GLN 694 Ca -0.00 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1wok h GLN 694 Cb 0.09 0.27 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 1wok h GLN 694 CO 0.00 -0.80 0.00 1.63 -0.95 0.00 0.00 178.83 178.71 1wok n LYS 695 N -5.56 2.71 -2.95 1.46 4.01 -1.05 -4.62 118.16 112.15 1wok n LYS 695 Ca -0.15 -2.26 -0.08 0.00 -0.51 0.00 0.00 58.31 55.31 1wok n LYS 695 Cb 0.51 -1.58 -0.02 0.00 -0.51 0.00 0.00 35.03 33.43 1wok n LYS 695 CO 0.00 0.00 0.00 1.41 -1.11 0.00 0.00 177.40 177.70 1wok s MET 696 N -1.40 1.00 -0.01 1.97 1.75 0.18 -4.81 119.30 117.98 1wok s MET 696 Ca 0.41 -1.15 -0.09 0.00 -1.25 0.00 0.00 55.69 53.61 1wok s MET 696 Cb 0.23 -0.31 -0.05 0.00 2.84 0.00 0.00 34.83 37.55 1wok s MET 696 CO 0.25 -1.32 0.29 -1.25 -0.65 0.00 0.00 175.02 172.35 1wok s PRO 697 N 0.87 3.65 0.00 4.11 0.04 -1.18 -3.84 135.00 138.66 1wok s PRO 697 Ca 0.28 0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.38 1wok s PRO 697 Cb -0.01 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1wok s PRO 697 CO -0.08 0.67 0.37 1.28 0.04 0.00 0.00 177.00 179.28 1wok n LEU 698 N 1.43 0.00 0.33 -3.56 4.77 -1.26 0.23 117.00 118.94 1wok n LEU 698 Ca -0.13 0.37 0.04 0.00 -0.03 0.00 0.00 56.01 56.25 1wok n LEU 698 Cb 0.53 -0.18 0.19 0.00 -2.33 0.00 0.00 43.42 41.64 1wok n LEU 698 CO 0.38 -0.18 1.03 1.23 -1.33 0.00 0.00 177.39 178.53 1wok h GLY 699 N 0.00 0.00 0.67 -0.72 0.00 -2.00 0.92 103.07 101.94 1wok h GLY 699 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1wok h GLY 699 CO 0.00 0.00 -0.93 1.17 0.00 0.00 0.00 176.54 176.78 1wok n LYS 700 N -2.59 0.25 -0.76 4.80 4.81 0.62 -4.96 118.16 120.33 1wok n LYS 700 Ca -0.00 0.01 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 1wok n LYS 700 Cb 0.85 -1.59 0.14 0.00 0.02 0.00 0.00 35.03 34.45 1wok n LYS 700 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1wok n LEU 701 N -1.92 -1.64 -3.64 3.14 4.77 0.32 -4.98 117.00 113.06 1wok n LEU 701 Ca 0.02 0.09 -0.09 0.00 -0.03 0.00 0.00 56.01 56.01 1wok n LEU 701 Cb 0.42 -1.03 -0.07 0.00 -2.33 0.00 0.00 43.42 40.41 1wok n LEU 701 CO 0.39 -3.46 0.69 -0.94 -1.33 0.00 0.00 177.39 172.75 1wok s SER 702 N -1.84 -0.50 0.15 -1.43 1.04 -1.26 -5.03 113.70 104.84 1wok s SER 702 Ca 0.55 0.94 -0.19 0.00 0.48 0.00 0.00 55.95 57.73 1wok s SER 702 Cb -0.15 0.98 0.05 0.00 0.10 0.00 0.00 66.02 67.00 1wok s SER 702 CO 0.68 -0.16 1.66 0.50 0.98 0.00 0.00 173.24 176.90 1wok h LYS 703 N 4.47 -0.09 -0.34 4.02 1.63 -1.96 -2.15 116.57 122.15 1wok h LYS 703 Ca -0.28 0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.57 1wok h LYS 703 Cb 1.18 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.79 1wok h LYS 703 CO 0.11 -0.06 0.09 0.00 -3.45 0.00 0.00 179.45 176.14 1wok h ARG 704 N -0.09 0.21 0.14 1.90 -0.00 -1.99 -2.34 114.38 112.20 1wok h ARG 704 Ca 0.15 -0.01 -0.00 0.00 -0.50 0.00 0.00 59.98 59.62 1wok h ARG 704 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 29.97 30.24 1wok h ARG 704 CO -0.36 0.14 -0.18 0.37 0.00 0.00 0.00 179.97 179.94 1wok h GLN 705 N 0.22 -0.31 -0.73 0.04 4.15 -1.81 -1.00 115.11 115.66 1wok h GLN 705 Ca 0.16 0.02 0.16 0.00 0.77 0.00 0.00 58.65 59.75 1wok h GLN 705 Cb 0.15 0.07 -0.13 0.00 0.21 0.00 0.00 27.48 27.78 1wok h GLN 705 CO -0.18 -0.21 -0.06 0.82 -1.93 0.00 0.00 178.83 177.26 1wok h ILE 706 N -0.32 0.33 -0.33 2.39 2.04 -1.41 -0.13 117.51 120.07 1wok h ILE 706 Ca -0.02 -0.02 0.07 0.00 1.00 0.00 0.00 64.86 65.89 1wok h ILE 706 Cb 0.29 0.26 -0.06 0.00 -0.74 0.00 0.00 36.82 36.57 1wok h ILE 706 CO -0.04 0.01 -0.08 1.56 0.00 0.00 0.00 178.15 179.60 1wok h GLN 707 N 0.06 0.01 -0.66 2.37 4.20 -1.21 -0.77 115.11 119.11 1wok h GLN 707 Ca 0.38 -0.00 0.10 0.00 0.06 0.00 0.00 58.65 59.19 1wok h GLN 707 Cb 0.64 -0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.38 1wok h GLN 707 CO -0.68 0.00 0.44 0.00 -0.67 0.00 0.00 178.83 177.92 1wok h ALA 708 N 1.33 1.94 0.00 3.87 0.00 0.36 0.28 119.26 127.04 1wok h ALA 708 Ca 0.16 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 1wok h ALA 708 Cb 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1wok h ALA 708 CO -0.33 -0.09 -0.45 0.00 0.00 0.00 0.00 179.25 178.37 1wok h ALA 709 N 1.67 1.09 -0.10 0.00 0.00 -0.70 -2.59 119.26 118.63 1wok h ALA 709 Ca 0.31 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1wok h ALA 709 Cb 0.52 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1wok h ALA 709 CO -0.10 0.57 0.06 1.88 0.00 0.00 0.00 179.25 181.66 1wok h TYR 710 N 0.00 0.13 -0.41 0.00 0.05 0.45 0.29 116.97 117.48 1wok h TYR 710 Ca -0.00 -0.00 0.05 0.00 0.05 0.00 0.00 58.73 58.83 1wok h TYR 710 Cb 0.89 -0.04 -0.05 0.00 1.01 0.00 0.00 36.73 38.54 1wok h TYR 710 CO 0.00 0.12 0.13 1.03 -1.05 0.00 0.00 178.16 178.39 1wok h SER 711 N 0.10 0.12 0.02 3.88 0.87 -1.20 -1.08 113.55 116.27 1wok h SER 711 Ca 0.03 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.66 1wok h SER 711 Cb 0.03 0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 1wok h SER 711 CO -0.01 0.11 -0.10 0.40 -0.53 0.00 0.00 176.83 176.70 1wok h ILE 712 N 0.29 0.76 -0.95 2.23 2.04 -1.08 -1.04 117.51 119.76 1wok h ILE 712 Ca 0.19 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.25 1wok h ILE 712 Cb 0.19 0.76 -0.11 0.00 -0.74 0.00 0.00 36.82 36.91 1wok h ILE 712 CO -0.20 0.00 0.54 -0.07 0.00 0.00 0.00 178.15 178.41 1wok h LEU 713 N -0.18 0.64 -0.52 1.44 3.38 0.33 0.57 115.31 120.96 1wok h LEU 713 Ca 0.03 0.11 -0.00 0.00 0.09 0.00 0.00 57.88 58.11 1wok h LEU 713 Cb 0.21 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 40.97 1wok h LEU 713 CO -0.08 0.19 -0.02 0.77 0.09 0.00 0.00 178.44 179.39 1wok h SER 714 N 0.64 0.00 -0.04 -0.43 4.64 -0.70 -2.80 113.55 114.86 1wok h SER 714 Ca 0.57 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.78 1wok h SER 714 Cb 0.94 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1wok h SER 714 CO -0.42 0.02 -0.30 -0.33 -0.87 0.00 0.00 176.83 174.92 1wok h GLU 715 N 0.00 0.50 -0.06 4.77 5.08 0.14 -1.05 114.58 123.96 1wok h GLU 715 Ca -0.00 -0.21 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 1wok h GLU 715 Cb 0.84 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 1wok h GLU 715 CO 0.00 0.75 -0.37 0.28 -1.00 0.00 0.00 179.01 178.68 1wok h VAL 716 N 0.43 1.28 0.16 3.13 2.07 -1.04 -1.82 116.25 120.47 1wok h VAL 716 Ca 0.05 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.22 1wok h VAL 716 Cb 0.75 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 32.18 1wok h VAL 716 CO 0.06 0.39 -0.08 -0.61 0.02 0.00 0.00 177.57 177.35 1wok h GLN 717 N 0.10 -0.21 -0.46 1.57 4.15 -1.22 -1.92 115.11 117.12 1wok h GLN 717 Ca 0.01 0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.54 1wok h GLN 717 Cb 0.70 0.05 -0.10 0.00 0.21 0.00 0.00 27.48 28.34 1wok h GLN 717 CO 0.05 -0.14 -0.26 0.37 -1.93 0.00 0.00 178.83 176.92 1wok h GLN 718 N -0.32 -0.16 0.00 1.69 -0.00 -1.27 0.19 115.11 115.23 1wok h GLN 718 Ca -0.02 0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.63 1wok h GLN 718 Cb 0.17 0.04 -0.00 0.00 0.00 0.00 0.00 27.48 27.69 1wok h GLN 718 CO 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 178.83 178.74 1wok h ALA 719 N 1.04 1.23 0.12 3.38 0.00 -1.44 0.10 119.26 123.70 1wok h ALA 719 Ca 0.21 -0.02 -0.36 0.00 0.00 0.00 0.00 54.91 54.74 1wok h ALA 719 Cb 0.50 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1wok h ALA 719 CO -0.56 0.03 -1.93 -0.24 0.00 0.00 0.00 179.25 176.55 1wok h VAL 720 N 0.00 0.70 -0.00 0.00 3.04 0.10 -2.84 116.25 117.24 1wok h VAL 720 Ca -0.00 -2.41 0.00 0.00 -1.01 0.00 0.00 66.70 63.28 1wok h VAL 720 Cb 0.10 2.54 0.00 0.00 -2.01 0.00 0.00 31.29 31.92 1wok h VAL 720 CO 0.00 0.86 -0.17 -1.54 -1.01 0.00 0.00 177.57 175.71 1wok n SER 721 N -3.46 0.25 -0.36 3.17 3.41 0.17 -3.01 113.62 113.80 1wok n SER 721 Ca -0.29 0.02 0.03 0.00 -0.26 0.00 0.00 58.87 58.37 1wok n SER 721 Cb 1.05 -0.18 0.07 0.00 -0.26 0.00 0.00 64.21 64.90 1wok n SER 721 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wok n GLN 722 N -1.37 1.84 -0.99 4.33 3.00 0.00 -5.07 117.38 119.13 1wok n GLN 722 Ca 0.08 -1.51 0.13 0.00 -0.01 0.00 0.00 57.00 55.70 1wok n GLN 722 Cb 0.32 -1.16 -0.03 0.00 0.00 0.00 0.00 30.24 29.37 1wok n GLN 722 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1wok n GLY 723 N 0.23 -1.90 0.00 1.08 0.00 -1.07 -4.99 105.19 98.53 1wok n GLY 723 Ca 0.06 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.85 1wok n GLY 723 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wok n SER 724 N -3.33 0.00 0.00 1.61 3.41 -1.25 -4.55 113.62 109.50 1wok n SER 724 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 1wok n SER 724 Cb 0.45 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1wok n SER 724 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wok n SER 725 N 0.00 0.00 -0.08 4.04 3.41 -1.26 -5.04 113.62 114.70 1wok n SER 725 Ca 0.00 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.39 1wok n SER 725 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 1wok n SER 725 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1wok n ASP 726 N 1.62 2.00 -0.31 4.04 9.92 -1.26 -4.20 116.55 128.36 1wok n ASP 726 Ca 0.00 0.21 0.19 0.00 -0.53 0.00 0.00 54.79 54.65 1wok n ASP 726 Cb 0.00 -0.78 0.45 0.00 -0.64 0.00 0.00 41.12 40.15 1wok n ASP 726 CO 0.00 0.00 0.00 -1.28 0.13 0.00 0.00 177.20 176.05 1wok h SER 727 N -0.39 0.54 -0.07 -2.24 0.87 -2.00 -2.24 113.55 108.02 1wok h SER 727 Ca -0.49 0.08 -0.10 0.00 -1.23 0.00 0.00 61.79 60.05 1wok h SER 727 Cb 1.76 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.70 1wok h SER 727 CO -0.11 0.16 -0.36 1.56 -0.53 0.00 0.00 176.83 177.56 1wok h GLN 728 N 0.51 0.37 -0.95 2.24 1.08 -1.97 -2.79 115.11 113.60 1wok h GLN 728 Ca 0.55 -0.30 0.13 0.00 -1.45 0.00 0.00 58.65 57.59 1wok h GLN 728 Cb 1.22 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 28.63 1wok h GLN 728 CO -0.29 0.94 0.58 0.82 -0.95 0.00 0.00 178.83 179.93 1wok h ILE 729 N -0.11 0.85 -0.75 2.54 2.04 -1.59 -0.71 117.51 119.79 1wok h ILE 729 Ca -0.02 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 1wok h ILE 729 Cb 1.01 -0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1wok h ILE 729 CO 0.07 0.16 0.30 -0.07 0.00 0.00 0.00 178.15 178.62 1wok h LEU 730 N 0.87 1.01 -0.59 1.44 3.38 -1.45 -2.86 115.31 117.12 1wok h LEU 730 Ca 0.49 -0.15 -0.15 0.00 0.09 0.00 0.00 57.88 58.17 1wok h LEU 730 Cb 0.57 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1wok h LEU 730 CO -0.30 0.90 -0.50 0.44 0.09 0.00 0.00 178.44 179.07 1wok h ASP 731 N 1.08 0.59 -0.30 -0.43 3.32 -0.87 -2.68 116.42 117.13 1wok h ASP 731 Ca 0.25 -0.29 -0.14 0.00 0.02 0.00 0.00 57.03 56.87 1wok h ASP 731 Cb 0.20 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1wok h ASP 731 CO -0.02 0.98 -0.33 -0.07 -1.72 0.00 0.00 179.24 178.08 1wok h LEU 732 N 0.42 0.86 0.05 1.55 3.38 -1.29 -0.84 115.31 119.44 1wok h LEU 732 Ca 0.02 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1wok h LEU 732 Cb 1.02 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1wok h LEU 732 CO 0.09 1.11 -0.02 0.28 0.09 0.00 0.00 178.44 179.99 1wok h SER 733 N 0.69 -0.06 -0.40 -0.43 0.02 -1.51 0.81 113.55 112.67 1wok h SER 733 Ca 0.07 -0.17 0.07 0.00 -0.84 0.00 0.00 61.79 60.92 1wok h SER 733 Cb 0.88 0.01 -0.09 0.00 0.14 0.00 0.00 62.40 63.35 1wok h SER 733 CO 0.08 0.14 -0.43 0.78 -1.14 0.00 0.00 176.83 176.25 1wok h ASN 734 N -0.25 -1.44 -0.51 3.07 2.35 -1.36 0.54 115.58 117.98 1wok h ASN 734 Ca -0.01 0.22 0.14 0.00 -0.55 0.00 0.00 56.30 56.10 1wok h ASN 734 Cb 0.22 0.63 -0.02 0.00 0.05 0.00 0.00 38.32 39.20 1wok h ASN 734 CO 0.01 -0.37 0.36 0.03 -1.65 0.00 0.00 177.43 175.81 1wok h ARG 735 N -0.34 0.01 0.08 0.81 3.08 -0.84 0.73 114.38 117.91 1wok h ARG 735 Ca 0.13 -0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.18 1wok h ARG 735 Cb 0.59 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.63 1wok h ARG 735 CO -0.57 0.01 -0.04 0.35 -1.07 0.00 0.00 179.97 178.65 1wok h PHE 736 N 0.01 -0.10 -0.10 3.04 3.57 0.24 -2.99 116.94 120.61 1wok h PHE 736 Ca 0.24 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 1wok h PHE 736 Cb 0.95 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1wok h PHE 736 CO -0.00 0.45 -0.19 1.88 -2.23 0.00 0.00 178.31 178.22 1wok h TYR 737 N -0.87 0.18 0.00 0.41 0.05 -0.00 -0.19 116.97 116.54 1wok h TYR 737 Ca -0.01 -0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.75 1wok h TYR 737 Cb 0.59 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 38.28 1wok h TYR 737 CO 0.13 0.35 0.00 0.00 -1.05 0.00 0.00 178.16 177.60 1wok h THR 738 N 0.16 0.00 0.00 -2.88 1.03 0.41 -3.05 112.91 108.58 1wok h THR 738 Ca 0.03 -0.28 -0.12 0.00 -0.01 0.00 0.00 66.41 66.03 1wok h THR 738 Cb 0.43 1.09 -0.02 0.00 -1.07 0.00 0.00 68.15 68.58 1wok h THR 738 CO 0.03 0.00 -1.07 -0.11 -0.01 0.00 0.00 175.52 174.36 1wok n LEU 739 N -2.58 1.87 -4.24 0.00 7.94 -0.43 -4.72 117.00 114.84 1wok n LEU 739 Ca 0.01 0.48 -0.43 0.00 -1.11 0.00 0.00 56.01 54.96 1wok n LEU 739 Cb 0.22 -0.86 -0.04 0.00 0.53 0.00 0.00 43.42 43.27 1wok n LEU 739 CO 0.21 -0.12 0.33 -0.63 -1.11 0.00 0.00 177.39 176.08 1wok s ILE 740 N -2.45 4.99 0.13 1.96 -1.09 -0.22 -5.05 121.20 119.47 1wok s ILE 740 Ca -0.24 -2.79 -0.35 0.00 -2.23 0.00 0.00 60.65 55.04 1wok s ILE 740 Cb 0.05 -4.11 -0.16 0.00 -1.58 0.00 0.00 42.46 36.66 1wok s ILE 740 CO 0.39 -1.00 1.32 -2.65 -1.23 0.00 0.00 174.94 171.77 1wok n PRO 741 N 3.61 1.35 -4.39 2.79 -0.02 -1.16 -4.58 135.00 132.61 1wok n PRO 741 Ca 0.13 0.49 -0.24 0.00 -2.02 0.00 0.00 63.50 61.86 1wok n PRO 741 Cb 0.43 -2.10 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1wok n PRO 741 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1wok s HIS 742 N 0.29 2.09 -0.41 6.00 3.76 -1.26 -0.07 115.29 125.69 1wok s HIS 742 Ca 0.79 -0.40 0.02 0.00 -0.15 0.00 0.00 55.06 55.32 1wok s HIS 742 Cb -0.86 -1.02 0.12 0.00 1.11 0.00 0.00 32.58 31.93 1wok s HIS 742 CO 0.47 0.46 0.19 0.34 -0.85 0.00 0.00 174.74 175.35 1wok s ASP 743 N -2.80 4.01 -0.24 1.40 2.15 0.12 -4.55 116.67 116.76 1wok s ASP 743 Ca 0.20 -2.42 -0.01 0.00 0.43 0.00 0.00 52.55 50.74 1wok s ASP 743 Cb -0.06 -1.19 0.12 0.00 -0.30 0.00 0.00 42.92 41.48 1wok s ASP 743 CO 0.09 -0.31 2.21 0.49 -0.17 0.00 0.00 175.17 177.48 1wok n PHE 744 N 3.84 1.09 0.00 -5.34 3.72 -1.26 -4.87 117.46 114.64 1wok n PHE 744 Ca 0.05 -1.71 0.00 0.00 -0.05 0.00 0.00 57.45 55.74 1wok n PHE 744 Cb 0.37 -0.94 0.00 0.00 -0.94 0.00 0.00 39.48 37.96 1wok n PHE 744 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wok n GLY 745 N 0.81 0.82 0.10 1.37 0.00 -1.26 -0.57 105.19 106.46 1wok n GLY 745 Ca 0.26 0.71 0.02 0.00 0.00 0.00 0.00 46.02 47.01 1wok n GLY 745 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1wok n MET 746 N 0.00 1.29 -2.48 1.61 2.81 -1.26 -5.08 117.12 114.02 1wok n MET 746 Ca 0.00 -1.35 -0.23 0.00 -1.81 0.00 0.00 57.70 54.31 1wok n MET 746 Cb 0.00 -0.88 0.06 0.00 -0.71 0.00 0.00 33.22 31.70 1wok n MET 746 CO 0.00 0.00 0.00 -1.59 1.51 0.00 0.00 175.97 175.89 1wok s LYS 747 N -0.93 2.23 -0.29 0.03 -2.85 0.26 -5.04 119.74 113.15 1wok s LYS 747 Ca 0.07 -0.68 -0.29 0.00 -1.00 0.00 0.00 55.97 54.06 1wok s LYS 747 Cb 0.06 -2.35 0.01 0.00 -2.06 0.00 0.00 37.83 33.49 1wok s LYS 747 CO 0.01 -1.05 1.07 0.15 0.10 0.00 0.00 175.35 175.62 1wok s LYS 748 N -5.01 4.14 -0.39 1.78 -0.14 -1.26 -4.92 119.74 113.94 1wok s LYS 748 Ca 0.60 1.18 -0.36 0.00 -1.36 0.00 0.00 55.97 56.03 1wok s LYS 748 Cb -0.09 -3.70 -0.13 0.00 -1.68 0.00 0.00 37.83 32.23 1wok s LYS 748 CO 0.42 -0.80 2.20 -2.30 -0.76 0.00 0.00 175.35 174.10 1wok n PRO 749 N 6.67 0.86 -1.48 -1.68 -0.02 -1.26 -4.87 135.00 133.22 1wok n PRO 749 Ca 0.12 0.23 -0.39 0.00 -2.02 0.00 0.00 63.50 61.44 1wok n PRO 749 Cb 0.47 -2.29 0.03 0.00 -0.02 0.00 0.00 33.50 31.68 1wok n PRO 749 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1wok n PRO 750 N 8.10 0.62 -4.39 0.52 -0.04 -1.26 -4.99 135.00 133.56 1wok n PRO 750 Ca 0.44 0.24 -0.34 0.00 -0.04 0.00 0.00 63.50 63.79 1wok n PRO 750 Cb 0.18 -1.71 -0.10 0.00 -0.04 0.00 0.00 33.50 31.83 1wok n PRO 750 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1wok s LEU 751 N 0.73 3.45 -0.37 1.53 2.96 -1.26 -5.08 118.68 120.62 1wok s LEU 751 Ca 0.67 0.04 -0.14 0.00 -0.22 0.00 0.00 54.13 54.49 1wok s LEU 751 Cb -0.49 -1.80 0.00 0.00 0.50 0.00 0.00 46.19 44.40 1wok s LEU 751 CO 0.55 0.30 0.26 -0.76 -1.32 0.00 0.00 176.35 175.39 1wok s LEU 752 N -0.43 4.80 0.00 -0.68 1.43 -1.26 -4.62 118.68 117.92 1wok s LEU 752 Ca 0.07 -0.69 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 1wok s LEU 752 Cb -0.12 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.96 1wok s LEU 752 CO 0.02 -0.35 0.00 -0.46 0.23 0.00 0.00 176.35 175.80 1wok n ASN 753 N 5.12 0.00 0.00 2.29 6.94 -1.26 -4.93 115.26 123.43 1wok n ASN 753 Ca -0.12 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.44 1wok n ASN 753 Cb 0.48 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.90 1wok n ASN 753 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1wok n ASN 754 N 0.00 0.00 0.00 0.53 5.03 -1.26 -4.68 115.26 114.87 1wok n ASN 754 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 1wok n ASN 754 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1wok n ASN 754 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1wok n ALA 755 N -0.82 0.00 -1.27 5.41 0.00 -1.26 -4.24 120.51 118.33 1wok n ALA 755 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1wok n ALA 755 Cb 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 18.92 1wok n ALA 755 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1wok n ASP 756 N 0.00 0.00 0.05 0.00 5.75 -1.26 -4.69 116.55 116.40 1wok n ASP 756 Ca 0.00 -0.96 0.13 0.00 -0.01 0.00 0.00 54.79 53.95 1wok n ASP 756 Cb 0.00 0.00 0.47 0.00 -1.03 0.00 0.00 41.12 40.56 1wok n ASP 756 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1wok n SER 757 N 0.00 0.44 -0.02 -1.12 3.41 -1.26 -2.35 113.62 112.71 1wok n SER 757 Ca 0.00 0.45 -0.11 0.00 -0.26 0.00 0.00 58.87 58.95 1wok n SER 757 Cb 0.24 -0.52 -0.14 0.00 -0.26 0.00 0.00 64.21 63.53 1wok n SER 757 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 1wok n VAL 758 N -1.87 1.62 -0.18 -3.33 0.24 -1.26 -4.02 118.33 109.52 1wok n VAL 758 Ca 0.06 -0.77 -0.02 0.00 -2.04 0.00 0.00 64.34 61.57 1wok n VAL 758 Cb 0.39 -1.12 0.08 0.00 -1.47 0.00 0.00 33.84 31.71 1wok n VAL 758 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 1wok h GLN 759 N 0.01 0.44 0.00 7.34 5.75 -1.74 0.33 115.11 127.24 1wok h GLN 759 Ca -0.33 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.14 1wok h GLN 759 Cb 2.03 -0.10 -0.00 0.00 1.07 0.00 0.00 27.48 30.48 1wok h GLN 759 CO 0.08 0.29 -0.00 0.00 -2.65 0.00 0.00 178.83 176.54 1wok h ALA 760 N 1.35 1.85 0.00 3.38 0.00 -1.70 0.10 119.26 124.24 1wok h ALA 760 Ca 0.27 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 1wok h ALA 760 Cb 0.26 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1wok h ALA 760 CO -0.23 0.00 -0.83 0.87 0.00 0.00 0.00 179.25 179.05 1wok h LYS 761 N 0.00 0.00 -0.21 0.00 1.79 -0.71 -2.53 116.57 114.90 1wok h LYS 761 Ca -0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1wok h LYS 761 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1wok h LYS 761 CO 0.00 0.60 0.07 0.28 -1.08 0.00 0.00 179.45 179.32 1wok h VAL 762 N 0.00 1.19 0.18 0.50 2.07 0.20 -1.26 116.25 119.12 1wok h VAL 762 Ca -0.04 -0.60 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1wok h VAL 762 Cb 1.55 1.19 -0.04 0.00 -1.52 0.00 0.00 31.29 32.47 1wok h VAL 762 CO 0.08 0.19 -0.36 -0.33 0.02 0.00 0.00 177.57 177.17 1wok h GLU 763 N 0.17 -0.61 -0.07 1.57 5.08 -1.27 -0.22 114.58 119.24 1wok h GLU 763 Ca 0.07 0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1wok h GLU 763 Cb 0.23 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 1wok h GLU 763 CO -0.00 -0.40 -0.26 1.98 -1.00 0.00 0.00 179.01 179.33 1wok h MET 764 N -0.63 -0.26 -0.90 2.33 4.05 -1.27 -0.73 114.93 117.52 1wok h MET 764 Ca 0.01 0.02 0.22 0.00 -0.28 0.00 0.00 59.70 59.67 1wok h MET 764 Cb 0.63 0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 31.43 1wok h MET 764 CO -0.17 -0.17 0.61 -0.07 0.23 0.00 0.00 176.91 177.33 1wok h LEU 765 N -0.27 0.32 -0.07 3.39 4.07 -1.12 0.15 115.31 121.77 1wok h LEU 765 Ca 0.02 0.04 -0.01 0.00 0.08 0.00 0.00 57.88 58.01 1wok h LEU 765 Cb 0.32 -0.02 -0.00 0.00 1.08 0.00 0.00 40.66 42.03 1wok h LEU 765 CO -0.21 0.12 0.03 0.44 -1.08 0.00 0.00 178.44 177.74 1wok h ASP 766 N 0.31 0.11 0.15 -0.43 3.45 0.24 -2.59 116.42 117.67 1wok h ASP 766 Ca 0.47 -0.18 0.01 0.00 0.43 0.00 0.00 57.03 57.75 1wok h ASP 766 Cb 1.30 -0.03 -0.02 0.00 -0.56 0.00 0.00 39.33 40.03 1wok h ASP 766 CO -0.15 0.26 -0.17 -1.13 -1.57 0.00 0.00 179.24 176.49 1wok h ASN 767 N -0.06 -0.45 -1.07 6.45 -0.73 0.57 -2.65 115.58 117.64 1wok h ASN 767 Ca 0.02 0.05 0.31 0.00 1.87 0.00 0.00 56.30 58.55 1wok h ASN 767 Cb 0.19 0.16 -0.12 0.00 0.27 0.00 0.00 38.32 38.82 1wok h ASN 767 CO -0.00 -0.25 0.65 -0.07 -0.37 0.00 0.00 177.43 177.39 1wok h LEU 768 N -0.36 0.48 0.36 0.34 3.38 -0.85 -0.60 115.31 118.06 1wok h LEU 768 Ca 0.01 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.10 1wok h LEU 768 Cb 0.35 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1wok h LEU 768 CO -0.05 -0.03 -0.19 -0.07 0.09 0.00 0.00 178.44 178.18 1wok h LEU 769 N 0.35 -0.47 0.15 1.67 3.38 -1.08 -0.91 115.31 118.40 1wok h LEU 769 Ca 0.69 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.68 1wok h LEU 769 Cb 1.70 0.13 0.00 0.00 0.09 0.00 0.00 40.66 42.58 1wok h LEU 769 CO -0.46 -0.32 -0.07 0.44 0.09 0.00 0.00 178.44 178.12 1wok h ASP 770 N -0.52 -0.17 -0.95 -0.43 3.32 -1.33 -0.45 116.42 115.89 1wok h ASP 770 Ca -0.04 -0.21 0.29 0.00 0.02 0.00 0.00 57.03 57.08 1wok h ASP 770 Cb 0.41 0.04 -0.15 0.00 0.22 0.00 0.00 39.33 39.85 1wok h ASP 770 CO 0.06 0.13 0.36 0.40 -1.72 0.00 0.00 179.24 178.47 1wok h ILE 771 N -0.47 0.24 -0.20 0.35 2.04 -1.15 0.82 117.51 119.14 1wok h ILE 771 Ca -0.02 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.74 1wok h ILE 771 Cb 0.37 0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 1wok h ILE 771 CO 0.03 0.04 -0.00 -0.08 0.00 0.00 0.00 178.15 178.14 1wok h GLU 772 N 0.20 0.35 -0.05 2.37 4.22 -0.75 -2.90 114.58 118.03 1wok h GLU 772 Ca 0.65 -0.11 0.04 0.00 0.08 0.00 0.00 59.36 60.02 1wok h GLU 772 Cb 1.45 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.62 1wok h GLU 772 CO -0.68 0.55 -0.25 0.28 -2.18 0.00 0.00 179.01 176.73 1wok h VAL 773 N 0.11 0.41 -0.24 0.32 2.07 0.22 -1.20 116.25 117.94 1wok h VAL 773 Ca 0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.61 1wok h VAL 773 Cb 0.40 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.52 1wok h VAL 773 CO 0.01 0.00 -0.44 0.00 0.02 0.00 0.00 177.57 177.16 1wok h ALA 774 N 0.50 -0.73 -0.84 1.67 0.00 -0.68 0.13 119.26 119.31 1wok h ALA 774 Ca 0.08 -0.02 0.20 0.00 0.00 0.00 0.00 54.91 55.16 1wok h ALA 774 Cb 0.48 1.00 -0.12 0.00 0.00 0.00 0.00 17.79 19.14 1wok h ALA 774 CO -0.26 -0.92 0.31 -0.92 0.00 0.00 0.00 179.25 177.47 1wok h TYR 775 N -0.37 0.51 -0.35 0.00 3.20 -1.30 0.23 116.97 118.89 1wok h TYR 775 Ca 0.04 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 1wok h TYR 775 Cb 0.50 -0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.66 1wok h TYR 775 CO -0.65 -0.06 0.17 1.03 -1.64 0.00 0.00 178.16 177.01 1wok h SER 776 N 0.36 0.46 -0.23 -2.11 0.87 0.11 -2.59 113.55 110.42 1wok h SER 776 Ca 0.51 -0.13 -0.08 0.00 -1.23 0.00 0.00 61.79 60.86 1wok h SER 776 Cb 0.92 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 1wok h SER 776 CO -0.52 0.46 -0.10 -0.07 -0.53 0.00 0.00 176.83 176.07 1wok h LEU 777 N 0.43 0.59 0.00 2.23 3.38 0.67 -2.44 115.31 120.17 1wok h LEU 777 Ca 0.12 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1wok h LEU 777 Cb 0.12 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1wok h LEU 777 CO -0.01 0.72 0.00 -0.11 0.09 0.00 0.00 178.44 179.13 1wok n LEU 778 N -4.20 0.00 0.00 1.67 7.94 0.65 -3.06 117.00 119.99 1wok n LEU 778 Ca 0.01 0.21 0.00 0.00 -1.11 0.00 0.00 56.01 55.12 1wok n LEU 778 Cb 0.33 -0.21 0.00 0.00 0.53 0.00 0.00 43.42 44.07 1wok n LEU 778 CO 0.41 -0.10 0.01 -2.11 -1.11 0.00 0.00 177.39 174.49 1wok n ARG 779 N -1.21 4.91 0.00 1.96 1.85 -0.96 -4.47 116.66 118.74 1wok n ARG 779 Ca 0.09 -0.02 0.15 0.00 -1.00 0.00 0.00 57.85 57.07 1wok n ARG 779 Cb 0.11 -0.40 0.74 0.00 -1.05 0.00 0.00 32.46 31.85 1wok n ARG 779 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1wok n GLY 780 N 0.71 -1.12 2.73 2.89 0.00 -0.98 -4.22 105.19 105.20 1wok n GLY 780 Ca 0.00 -0.20 -0.08 0.00 0.00 0.00 0.00 46.02 45.74 1wok n GLY 780 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wok n GLY 781 N 1.24 0.19 0.04 -0.02 0.00 -1.25 -5.00 105.19 100.39 1wok n GLY 781 Ca 0.16 0.14 -0.06 0.00 0.00 0.00 0.00 46.02 46.26 1wok n GLY 781 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wok n SER 782 N 0.98 3.31 -1.98 1.61 3.41 -1.26 -4.72 113.62 114.96 1wok n SER 782 Ca 0.07 -0.04 -0.11 0.00 -0.26 0.00 0.00 58.87 58.53 1wok n SER 782 Cb 0.67 0.03 -0.16 0.00 -0.26 0.00 0.00 64.21 64.49 1wok n SER 782 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1wok n ASP 783 N -2.66 5.13 -4.80 4.04 5.75 -1.26 -4.84 116.55 117.91 1wok n ASP 783 Ca -0.15 -2.45 -0.24 0.00 -0.01 0.00 0.00 54.79 51.94 1wok n ASP 783 Cb 0.68 -1.37 -0.05 0.00 -1.03 0.00 0.00 41.12 39.34 1wok n ASP 783 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1wok s ASP 784 N 2.02 4.65 -0.10 -1.12 2.15 -1.26 -5.15 116.67 117.86 1wok s ASP 784 Ca 0.61 -0.99 -0.06 0.00 0.43 0.00 0.00 52.55 52.54 1wok s ASP 784 Cb 0.29 -0.42 0.04 0.00 -0.30 0.00 0.00 42.92 42.53 1wok s ASP 784 CO 0.00 -0.63 0.24 -0.44 -0.17 0.00 0.00 175.17 174.17 1wok s SER 785 N -4.01 -0.25 0.00 -0.34 0.01 -1.26 -5.01 113.70 102.84 1wok s SER 785 Ca 0.42 0.50 0.00 0.00 1.31 0.00 0.00 55.95 58.18 1wok s SER 785 Cb 0.01 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.66 1wok s SER 785 CO 0.24 -0.14 0.00 -0.24 0.41 0.00 0.00 173.24 173.51 1wok n SER 786 N 3.80 0.00 -4.71 2.44 2.88 -1.26 -5.14 113.62 111.63 1wok n SER 786 Ca -0.21 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.05 1wok n SER 786 Cb 0.55 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 1wok n SER 786 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1wok s LYS 787 N 0.00 2.12 0.35 -1.46 1.02 -1.26 -4.75 119.74 115.75 1wok s LYS 787 Ca 0.00 -2.05 -0.26 0.00 0.02 0.00 0.00 55.97 53.68 1wok s LYS 787 Cb 0.00 -1.78 -0.13 0.00 -0.52 0.00 0.00 37.83 35.40 1wok s LYS 787 CO 0.00 -0.17 0.84 -3.47 -0.92 0.00 0.00 175.35 171.63 1wok n ASP 788 N -1.18 0.45 0.00 2.83 -0.08 -1.26 -4.69 116.55 112.63 1wok n ASP 788 Ca -0.06 1.07 0.00 0.00 -1.51 0.00 0.00 54.79 54.29 1wok n ASP 788 Cb 0.66 -1.22 0.00 0.00 2.34 0.00 0.00 41.12 42.89 1wok n ASP 788 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1wok n PRO 789 N 0.58 0.00 0.24 -0.67 -0.02 -1.26 -1.71 135.00 132.16 1wok n PRO 789 Ca 0.11 0.07 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 1wok n PRO 789 Cb 0.35 -1.57 -0.06 0.00 -0.02 0.00 0.00 33.50 32.20 1wok n PRO 789 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1wok h ILE 790 N 0.00 0.23 0.00 4.25 1.08 -1.99 0.10 117.51 121.18 1wok h ILE 790 Ca 0.00 -0.51 -0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1wok h ILE 790 Cb 0.14 0.34 -0.00 0.00 -3.07 0.00 0.00 36.82 34.23 1wok h ILE 790 CO 0.00 0.04 -0.00 0.44 -0.69 0.00 0.00 178.15 177.94 1wok h ASP 791 N -1.08 0.00 0.09 1.72 3.32 -1.65 0.66 116.42 119.48 1wok h ASP 791 Ca -0.07 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.71 1wok h ASP 791 Cb 0.58 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.15 1wok h ASP 791 CO 0.11 0.00 -1.07 0.58 -1.72 0.00 0.00 179.24 177.14 1wok h VAL 792 N 0.00 1.30 0.02 -1.35 2.07 -1.57 -3.04 116.25 113.69 1wok h VAL 792 Ca -0.00 -2.33 -0.27 0.00 0.82 0.00 0.00 66.70 64.92 1wok h VAL 792 Cb 0.03 2.46 -0.04 0.00 -1.52 0.00 0.00 31.29 32.23 1wok h VAL 792 CO 0.00 0.72 -1.45 0.78 0.02 0.00 0.00 177.57 177.64 1wok h ASN 793 N 0.34 0.07 -0.43 0.57 2.35 0.11 -3.29 115.58 115.30 1wok h ASN 793 Ca -0.13 -0.11 0.06 0.00 -0.55 0.00 0.00 56.30 55.56 1wok h ASN 793 Cb 1.73 -0.02 -0.05 0.00 0.05 0.00 0.00 38.32 40.02 1wok h ASN 793 CO 0.21 1.10 0.12 0.22 -1.65 0.00 0.00 177.43 177.42 1wok h TYR 794 N 0.01 0.21 0.00 1.19 3.20 0.15 -1.53 116.97 120.20 1wok h TYR 794 Ca -0.19 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.64 1wok h TYR 794 Cb 1.93 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 40.16 1wok h TYR 794 CO 0.01 0.06 -0.29 1.05 -1.64 0.00 0.00 178.16 177.35 1wok h GLU 795 N 0.27 0.00 -0.15 1.82 4.11 -1.66 -2.75 114.58 116.23 1wok h GLU 795 Ca 0.21 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.58 1wok h GLU 795 Cb 0.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1wok h GLU 795 CO -0.24 0.29 -0.16 0.87 0.07 0.00 0.00 179.01 179.84 1wok h LYS 796 N 0.00 0.24 0.00 1.06 1.57 -1.35 -1.24 116.57 116.85 1wok h LYS 796 Ca -0.00 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1wok h LYS 796 Cb 0.57 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.85 1wok h LYS 796 CO 0.04 0.40 -0.15 -0.07 -0.57 0.00 0.00 179.45 179.11 1wok h LEU 797 N 0.23 0.00 -1.09 2.94 3.38 -1.26 -3.47 115.31 116.05 1wok h LEU 797 Ca 0.04 0.00 -0.42 0.00 0.09 0.00 0.00 57.88 57.60 1wok h LEU 797 Cb 0.42 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.25 1wok h LEU 797 CO 0.03 0.15 -0.73 0.29 0.09 0.00 0.00 178.44 178.26 1wok n LYS 798 N -4.04 -6.74 -3.69 1.13 4.76 -0.47 -4.16 118.16 104.96 1wok n LYS 798 Ca -0.02 0.74 -0.15 0.00 -2.87 0.00 0.00 58.31 56.01 1wok n LYS 798 Cb 0.23 -5.69 -0.14 0.00 -1.84 0.00 0.00 35.03 27.59 1wok n LYS 798 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1wok s THR 799 N -3.35 -0.24 0.21 -0.18 -1.32 -1.26 -2.25 115.64 107.24 1wok s THR 799 Ca 0.48 0.28 -0.31 0.00 -1.21 0.00 0.00 61.69 60.93 1wok s THR 799 Cb -0.23 -0.34 -0.10 0.00 -1.51 0.00 0.00 72.50 70.33 1wok s THR 799 CO 0.77 0.12 1.45 -0.62 -2.21 0.00 0.00 174.62 174.12 1wok s ASP 800 N 2.00 6.69 -0.10 8.08 2.15 -1.19 -4.81 116.67 129.48 1wok s ASP 800 Ca -0.01 2.58 0.02 0.00 0.43 0.00 0.00 52.55 55.57 1wok s ASP 800 Cb -0.12 -2.61 0.01 0.00 -0.30 0.00 0.00 42.92 39.90 1wok s ASP 800 CO -0.07 -0.70 -0.16 -0.63 -0.17 0.00 0.00 175.17 173.44 1wok s ILE 801 N 0.41 1.50 0.01 4.11 1.01 -1.26 -0.99 121.20 125.99 1wok s ILE 801 Ca 0.62 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.62 1wok s ILE 801 Cb -0.41 -1.36 -0.01 0.00 0.01 0.00 0.00 42.46 40.69 1wok s ILE 801 CO 0.38 0.44 -0.04 -0.54 0.00 0.00 0.00 174.94 175.18 1wok s LYS 802 N 0.81 0.34 0.18 2.79 -0.14 -1.08 -4.99 119.74 117.65 1wok s LYS 802 Ca -0.10 -0.31 -0.30 0.00 -1.36 0.00 0.00 55.97 53.89 1wok s LYS 802 Cb -0.16 -0.24 -0.08 0.00 -1.68 0.00 0.00 37.83 35.68 1wok s LYS 802 CO 0.01 0.06 1.04 0.08 -0.76 0.00 0.00 175.35 175.78 1wok s VAL 803 N -0.51 4.02 -0.42 3.17 1.01 -1.26 -0.67 120.40 125.74 1wok s VAL 803 Ca -0.03 1.80 -0.18 0.00 0.00 0.00 0.00 61.98 63.56 1wok s VAL 803 Cb -0.04 -4.15 0.02 0.00 0.00 0.00 0.00 36.38 32.21 1wok s VAL 803 CO -0.00 0.33 0.50 -0.69 0.00 0.00 0.00 175.10 175.24 1wok s VAL 804 N -0.44 5.01 0.00 2.92 1.01 -0.61 -4.87 120.40 123.42 1wok s VAL 804 Ca 0.47 -0.18 -0.38 0.00 0.00 0.00 0.00 61.98 61.89 1wok s VAL 804 Cb -0.28 -4.08 -0.17 0.00 0.00 0.00 0.00 36.38 31.85 1wok s VAL 804 CO 0.34 -0.46 1.40 -0.67 0.00 0.00 0.00 175.10 175.71 1wok n ASP 805 N 5.80 1.67 -0.33 3.32 2.03 -1.26 -4.63 116.55 123.15 1wok n ASP 805 Ca -0.05 1.11 0.12 0.00 0.52 0.00 0.00 54.79 56.49 1wok n ASP 805 Cb 0.48 -1.16 0.26 0.00 -0.72 0.00 0.00 41.12 39.98 1wok n ASP 805 CO 0.00 0.00 0.00 -0.09 -1.92 0.00 0.00 177.20 175.19 1wok h ARG 806 N 4.96 0.03 -0.89 -0.67 2.43 -1.96 0.63 114.38 118.91 1wok h ARG 806 Ca -0.48 -0.00 -0.35 0.00 -0.81 0.00 0.00 59.98 58.34 1wok h ARG 806 Cb 1.34 -0.01 -0.21 0.00 -0.42 0.00 0.00 29.97 30.67 1wok h ARG 806 CO 0.81 0.02 0.44 -0.25 -1.51 0.00 0.00 179.97 179.48 1wok n ASP 807 N -5.46 4.17 -4.74 -3.80 8.00 -1.26 -4.67 116.55 108.80 1wok n ASP 807 Ca 0.21 -3.32 -0.41 0.00 0.71 0.00 0.00 54.79 51.98 1wok n ASP 807 Cb 0.69 -0.78 -0.04 0.00 -0.02 0.00 0.00 41.12 40.97 1wok n ASP 807 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1wok s SER 808 N -1.02 7.42 0.28 -2.24 0.15 0.22 -4.94 113.70 113.57 1wok s SER 808 Ca 0.52 1.94 -0.01 0.00 0.70 0.00 0.00 55.95 59.10 1wok s SER 808 Cb 0.43 -2.60 0.64 0.00 -1.71 0.00 0.00 66.02 62.78 1wok s SER 808 CO 0.11 -0.11 1.61 -0.08 1.20 0.00 0.00 173.24 175.98 1wok h GLU 809 N 5.20 0.09 -0.96 5.44 4.81 -1.91 0.64 114.58 127.88 1wok h GLU 809 Ca -0.44 -0.01 0.13 0.00 -0.13 0.00 0.00 59.36 58.92 1wok h GLU 809 Cb 1.21 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 30.49 1wok h GLU 809 CO 0.72 0.06 0.61 0.93 -0.73 0.00 0.00 179.01 180.59 1wok h GLU 810 N 0.09 0.85 -0.96 1.92 5.08 -1.92 -1.35 114.58 118.29 1wok h GLU 810 Ca 0.53 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.92 1wok h GLU 810 Cb 1.03 -0.19 -0.07 0.00 0.50 0.00 0.00 28.75 30.02 1wok h GLU 810 CO -0.77 0.56 0.61 0.00 -1.00 0.00 0.00 179.01 178.41 1wok h ALA 811 N 1.57 1.37 0.00 3.43 0.00 0.03 0.20 119.26 125.87 1wok h ALA 811 Ca 0.49 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.33 1wok h ALA 811 Cb 0.60 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1wok h ALA 811 CO -0.25 0.32 -0.28 1.49 0.00 0.00 0.00 179.25 180.53 1wok h GLU 812 N 1.05 0.00 0.02 0.00 4.81 -1.11 -1.76 114.58 117.59 1wok h GLU 812 Ca 0.44 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.64 1wok h GLU 812 Cb 0.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1wok h GLU 812 CO -0.21 0.28 -0.15 0.82 -0.73 0.00 0.00 179.01 179.03 1wok h ILE 813 N 0.00 1.73 -0.32 2.32 2.04 -0.98 -2.34 117.51 119.96 1wok h ILE 813 Ca -0.00 -2.37 0.04 0.00 1.00 0.00 0.00 64.86 63.53 1wok h ILE 813 Cb 0.60 3.33 -0.04 0.00 -0.74 0.00 0.00 36.82 39.97 1wok h ILE 813 CO 0.04 0.61 0.08 0.40 0.00 0.00 0.00 178.15 179.28 1wok h ILE 814 N -0.92 0.86 -0.50 -0.67 2.04 -0.99 -1.11 117.51 116.22 1wok h ILE 814 Ca -0.03 -0.07 0.03 0.00 1.00 0.00 0.00 64.86 65.79 1wok h ILE 814 Cb 1.09 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.78 1wok h ILE 814 CO 0.01 0.04 0.29 0.03 0.00 0.00 0.00 178.15 178.52 1wok h ARG 815 N 0.20 0.57 -0.23 2.37 3.08 -1.44 -2.10 114.38 116.83 1wok h ARG 815 Ca 0.15 -0.03 0.06 0.00 0.07 0.00 0.00 59.98 60.23 1wok h ARG 815 Cb 0.15 -0.13 -0.07 0.00 0.08 0.00 0.00 29.97 30.00 1wok h ARG 815 CO -0.18 0.38 -0.27 -0.22 -1.07 0.00 0.00 179.97 178.61 1wok h LYS 816 N 0.59 -0.27 -0.61 0.04 3.64 -0.82 -1.72 116.57 117.41 1wok h LYS 816 Ca 0.20 0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.71 1wok h LYS 816 Cb 0.03 0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 31.79 1wok h LYS 816 CO -0.10 -0.18 -0.31 -0.92 -2.27 0.00 0.00 179.45 175.67 1wok h TYR 817 N -0.28 -0.83 0.08 1.91 5.03 -0.66 -0.62 116.97 121.60 1wok h TYR 817 Ca 0.13 0.07 -0.00 0.00 2.58 0.00 0.00 58.73 61.51 1wok h TYR 817 Cb 0.49 0.46 -0.00 0.00 1.55 0.00 0.00 36.73 39.22 1wok h TYR 817 CO -0.41 -0.37 -0.08 0.28 -1.32 0.00 0.00 178.16 176.27 1wok h VAL 818 N -0.13 0.00 -1.05 1.81 2.07 -0.70 0.25 116.25 118.50 1wok h VAL 818 Ca 0.25 0.00 0.30 0.00 0.82 0.00 0.00 66.70 68.07 1wok h VAL 818 Cb 0.54 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 1wok h VAL 818 CO -0.69 0.00 0.75 0.50 0.02 0.00 0.00 177.57 178.15 1wok h LYS 819 N -0.16 0.04 0.00 1.57 3.64 -1.16 -2.12 116.57 118.38 1wok h LYS 819 Ca -0.01 -0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 1wok h LYS 819 Cb 0.14 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 1wok h LYS 819 CO -0.01 0.03 -0.37 -0.91 -2.27 0.00 0.00 179.45 175.91 1wok h ASN 820 N 0.04 0.00 -0.32 4.20 4.21 -0.91 -3.36 115.58 119.44 1wok h ASN 820 Ca 0.51 -0.74 -0.17 0.00 1.21 0.00 0.00 56.30 57.11 1wok h ASN 820 Cb 1.95 0.00 -0.10 0.00 -1.12 0.00 0.00 38.32 39.05 1wok h ASN 820 CO -0.03 1.09 0.21 0.35 -1.29 0.00 0.00 177.43 177.76 1wok n THR 821 N -4.57 1.73 -3.31 2.81 -2.24 0.87 -4.02 114.28 105.54 1wok n THR 821 Ca -0.15 -0.63 -0.42 0.00 -2.27 0.00 0.00 64.05 60.57 1wok n THR 821 Cb 0.49 -0.85 -0.09 0.00 -2.10 0.00 0.00 70.33 67.78 1wok n THR 821 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1wok s HIS 822 N -1.05 3.17 0.41 4.78 5.04 -0.87 -1.21 115.29 125.57 1wok s HIS 822 Ca 0.18 -0.18 -0.26 0.00 -1.54 0.00 0.00 55.06 53.27 1wok s HIS 822 Cb 0.15 -2.88 -0.10 0.00 0.04 0.00 0.00 32.58 29.79 1wok s HIS 822 CO 0.03 -0.62 1.24 0.00 -2.34 0.00 0.00 174.74 173.05 1wok n ALA 823 N 5.62 1.17 0.10 1.58 0.00 -1.26 -4.94 120.51 122.79 1wok n ALA 823 Ca -0.07 0.27 -0.04 0.00 0.00 0.00 0.00 53.44 53.60 1wok n ALA 823 Cb 0.48 -2.25 0.14 0.00 0.00 0.00 0.00 19.45 17.82 1wok n ALA 823 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wok h THR 824 N 2.06 1.40 0.00 0.00 1.03 -1.97 -2.85 112.91 112.58 1wok h THR 824 Ca -0.47 -1.99 0.00 0.00 -0.01 0.00 0.00 66.41 63.93 1wok h THR 824 Cb 1.30 2.03 0.00 0.00 -1.07 0.00 0.00 68.15 70.40 1wok h THR 824 CO 0.60 0.58 0.00 0.35 -0.01 0.00 0.00 175.52 177.04 1wok n THR 825 N -3.86 0.47 -2.41 0.00 -2.24 -1.26 -3.64 114.28 101.34 1wok n THR 825 Ca -0.02 0.12 -0.40 0.00 -2.27 0.00 0.00 64.05 61.47 1wok n THR 825 Cb 0.61 -0.77 0.03 0.00 -2.10 0.00 0.00 70.33 68.10 1wok n THR 825 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1wok n HIS 826 N -1.40 2.86 0.34 4.78 -0.00 -1.07 -4.71 115.22 116.01 1wok n HIS 826 Ca 0.07 -2.50 0.05 0.00 -0.00 0.00 0.00 57.72 55.34 1wok n HIS 826 Cb 0.21 -1.18 0.19 0.00 -0.00 0.00 0.00 29.99 29.21 1wok n HIS 826 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.34 176.61 1wok n ASN 827 N -0.22 2.87 -1.32 0.41 0.23 -1.24 -4.07 115.26 111.91 1wok n ASN 827 Ca 0.49 -2.28 0.06 0.00 -0.53 0.00 0.00 54.58 52.32 1wok n ASN 827 Cb 0.25 -0.45 0.27 0.00 -2.08 0.00 0.00 39.78 37.77 1wok n ASN 827 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1wok n ALA 828 N 0.45 3.11 0.00 -2.53 0.00 -1.26 -4.91 120.51 115.37 1wok n ALA 828 Ca 0.14 -1.23 0.00 0.00 0.00 0.00 0.00 53.44 52.35 1wok n ALA 828 Cb 0.57 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1wok n ALA 828 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1wok n TYR 829 N 0.68 0.00 -2.71 0.00 0.18 -1.26 -4.28 117.16 109.77 1wok n TYR 829 Ca 0.19 0.00 -0.20 0.00 1.88 0.00 0.00 57.90 59.78 1wok n TYR 829 Cb 0.76 0.00 0.09 0.00 -0.38 0.00 0.00 39.34 39.82 1wok n TYR 829 CO 0.00 0.00 0.00 -3.47 -2.08 0.00 0.00 176.86 171.31 1wok n ASP 830 N 0.00 1.42 -3.81 9.48 2.03 -1.01 -4.82 116.55 119.84 1wok n ASP 830 Ca 0.00 -2.13 -0.14 0.00 0.52 0.00 0.00 54.79 53.04 1wok n ASP 830 Cb 0.00 -0.53 -0.15 0.00 -0.72 0.00 0.00 41.12 39.72 1wok n ASP 830 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 1wok s LEU 831 N 0.00 1.45 -0.05 -2.67 1.43 -1.26 -2.95 118.68 114.63 1wok s LEU 831 Ca 0.58 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.73 1wok s LEU 831 Cb -0.04 -0.01 0.02 0.00 0.03 0.00 0.00 46.19 46.20 1wok s LEU 831 CO 0.38 -0.07 -0.04 -0.70 0.23 0.00 0.00 176.35 176.15 1wok s GLU 832 N 0.61 0.86 -0.98 1.70 2.56 -1.09 -5.02 118.70 117.34 1wok s GLU 832 Ca -0.05 -0.09 -0.24 0.00 0.00 0.00 0.00 54.97 54.59 1wok s GLU 832 Cb -0.07 -0.93 0.04 0.00 2.00 0.00 0.00 34.13 35.17 1wok s GLU 832 CO -0.02 -0.13 1.45 0.08 -0.56 0.00 0.00 175.26 176.09 1wok s VAL 833 N 1.13 3.87 0.23 3.70 1.01 -1.26 -1.71 120.40 127.38 1wok s VAL 833 Ca -0.08 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 1wok s VAL 833 Cb -0.14 -4.99 0.14 0.00 0.00 0.00 0.00 36.38 31.39 1wok s VAL 833 CO -0.01 -1.88 1.77 0.40 0.00 0.00 0.00 175.10 175.38 1wok h ILE 834 N 6.72 1.25 -3.29 2.22 1.08 -1.37 -3.46 117.51 120.67 1wok h ILE 834 Ca 0.13 -0.89 -0.10 0.00 -0.39 0.00 0.00 64.86 63.61 1wok h ILE 834 Cb 1.02 0.55 -0.17 0.00 -3.07 0.00 0.00 36.82 35.14 1wok h ILE 834 CO 1.40 0.34 -0.26 -1.81 -0.69 0.00 0.00 178.15 177.13 1wok s ASP 835 N -6.49 -0.12 -0.05 1.72 -0.00 0.03 -4.96 116.67 106.80 1wok s ASP 835 Ca -0.11 -0.17 0.01 0.00 -0.00 0.00 0.00 52.55 52.28 1wok s ASP 835 Cb 0.15 0.35 0.02 0.00 -0.00 0.00 0.00 42.92 43.44 1wok s ASP 835 CO 0.83 -0.59 -0.07 -0.63 -0.00 0.00 0.00 175.17 174.71 1wok s ILE 836 N -2.41 0.73 0.11 0.77 1.01 -1.26 -1.12 121.20 119.02 1wok s ILE 836 Ca -0.06 -0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.42 1wok s ILE 836 Cb -0.01 -0.71 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 1wok s ILE 836 CO -0.02 0.27 -0.17 -0.36 0.00 0.00 0.00 174.94 174.65 1wok s PHE 837 N 0.81 1.57 -0.41 3.97 0.08 0.36 -1.57 117.98 122.79 1wok s PHE 837 Ca -0.13 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.47 1wok s PHE 837 Cb -0.15 -0.84 0.11 0.00 -0.57 0.00 0.00 43.02 41.57 1wok s PHE 837 CO 0.01 0.17 0.17 0.21 -0.10 0.00 0.00 175.22 175.68 1wok s LYS 838 N -2.14 1.84 0.21 0.44 2.20 0.16 -0.49 119.74 121.95 1wok s LYS 838 Ca 0.06 -1.98 0.03 0.00 -0.36 0.00 0.00 55.97 53.72 1wok s LYS 838 Cb -0.08 -3.42 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 1wok s LYS 838 CO 0.04 -1.03 0.36 0.96 -0.36 0.00 0.00 175.35 175.31 1wok s ILE 839 N 0.82 5.26 -0.42 5.43 -0.00 -0.82 -2.65 121.20 128.82 1wok s ILE 839 Ca 0.11 -0.71 0.04 0.00 -0.00 0.00 0.00 60.65 60.09 1wok s ILE 839 Cb -0.21 -3.79 0.17 0.00 -0.00 0.00 0.00 42.46 38.62 1wok s ILE 839 CO -0.05 -0.24 0.41 -0.70 -0.00 0.00 0.00 174.94 174.36 1wok s GLU 840 N -3.62 0.86 0.01 0.37 2.12 -0.16 -4.44 118.70 113.85 1wok s GLU 840 Ca 0.36 -1.63 -0.36 0.00 0.36 0.00 0.00 54.97 53.70 1wok s GLU 840 Cb -0.10 -1.01 -0.14 0.00 0.26 0.00 0.00 34.13 33.13 1wok s GLU 840 CO 0.29 -1.33 1.62 0.54 -0.54 0.00 0.00 175.26 175.84 1wok n ARG 841 N 3.19 1.76 -1.70 4.30 1.74 -1.26 -3.16 116.66 121.53 1wok n ARG 841 Ca 0.23 0.64 -0.44 0.00 -0.77 0.00 0.00 57.85 57.51 1wok n ARG 841 Cb 0.48 -2.38 -0.03 0.00 -1.02 0.00 0.00 32.46 29.51 1wok n ARG 841 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1wok n GLU 842 N 4.29 2.42 0.00 5.56 2.13 -0.96 -2.59 120.64 131.50 1wok n GLU 842 Ca 0.20 0.87 0.00 0.00 0.66 0.00 0.00 57.16 58.89 1wok n GLU 842 Cb 0.24 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.29 1wok n GLU 842 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1wok n GLY 843 N 3.32 2.25 0.33 8.31 0.00 -1.26 -4.85 105.19 113.30 1wok n GLY 843 Ca 0.15 -0.38 0.21 0.00 0.00 0.00 0.00 46.02 46.00 1wok n GLY 843 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1wok h GLU 844 N 0.00 0.00 0.00 1.61 4.81 -1.89 -2.52 114.58 116.59 1wok h GLU 844 Ca 0.00 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1wok h GLU 844 Cb 0.00 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1wok h GLU 844 CO 0.00 0.00 -0.30 0.00 -0.73 0.00 0.00 179.01 177.98 1wok n GLN 846 N -3.85 1.09 0.00 0.00 7.27 -0.96 -3.40 117.38 117.53 1wok n GLN 846 Ca -0.01 -0.06 0.09 0.00 0.07 0.00 0.00 57.00 57.08 1wok n GLN 846 Cb 0.38 -1.40 0.44 0.00 2.41 0.00 0.00 30.24 32.07 1wok n GLN 846 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 1wok n ARG 847 N -2.39 0.14 -0.09 3.69 1.85 -1.19 -2.44 116.66 116.23 1wok n ARG 847 Ca -0.17 0.14 -0.10 0.00 -1.00 0.00 0.00 57.85 56.73 1wok n ARG 847 Cb 0.79 -1.50 -0.14 0.00 -1.05 0.00 0.00 32.46 30.56 1wok n ARG 847 CO 0.00 0.00 0.00 0.98 -0.01 0.00 0.00 177.63 178.60 1wok n TYR 848 N -1.39 0.00 -0.29 2.89 9.36 -1.20 -4.63 117.16 121.89 1wok n TYR 848 Ca 0.07 0.00 0.09 0.00 3.32 0.00 0.00 57.90 61.38 1wok n TYR 848 Cb 0.18 -0.89 0.19 0.00 -0.63 0.00 0.00 39.34 38.20 1wok n TYR 848 CO 0.00 0.00 0.00 1.17 0.22 0.00 0.00 176.86 178.25 1wok n LYS 849 N -2.73 -0.07 0.30 2.98 3.00 -1.02 0.38 118.16 121.00 1wok n LYS 849 Ca -0.31 1.25 0.18 0.00 -0.00 0.00 0.00 58.31 59.43 1wok n LYS 849 Cb 1.06 -1.94 1.01 0.00 0.00 0.00 0.00 35.03 35.17 1wok n LYS 849 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 1wok h PRO 850 N 0.00 0.00 -0.02 1.64 0.11 -1.82 0.03 132.00 131.93 1wok h PRO 850 Ca 0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.57 1wok h PRO 850 Cb 0.86 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1wok h PRO 850 CO -0.80 0.00 -0.16 1.19 -0.21 0.00 0.00 178.00 178.02 1wok n PHE 851 N -3.52 0.00 1.55 0.65 3.72 0.16 -4.04 117.46 115.98 1wok n PHE 851 Ca -0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.51 1wok n PHE 851 Cb 0.13 -0.00 0.75 0.00 -0.94 0.00 0.00 39.48 39.41 1wok n PHE 851 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1wok n LYS 852 N 0.77 0.74 0.03 -1.08 4.81 -0.00 -2.30 118.16 121.13 1wok n LYS 852 Ca 0.13 0.01 0.04 0.00 -0.87 0.00 0.00 58.31 57.61 1wok n LYS 852 Cb 0.53 -1.50 -0.09 0.00 0.02 0.00 0.00 35.03 34.00 1wok n LYS 852 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1wok n GLN 853 N -1.04 0.63 -0.32 1.64 1.13 -1.26 -4.93 117.38 113.23 1wok n GLN 853 Ca 0.18 0.10 -0.28 0.00 -1.94 0.00 0.00 57.00 55.06 1wok n GLN 853 Cb 0.10 -1.73 0.26 0.00 0.11 0.00 0.00 30.24 28.99 1wok n GLN 853 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1wok n LEU 854 N -2.70 -0.77 -4.45 1.08 7.94 -0.97 -5.04 117.00 112.09 1wok n LEU 854 Ca -0.09 -0.68 -0.23 0.00 -1.11 0.00 0.00 56.01 53.90 1wok n LEU 854 Cb 0.75 -0.99 -0.10 0.00 0.53 0.00 0.00 43.42 43.61 1wok n LEU 854 CO 0.43 -4.17 -0.48 -1.38 -1.11 0.00 0.00 177.39 170.68 1wok s HIS 855 N -2.15 2.21 -0.36 1.96 -3.43 -1.26 -4.79 115.29 107.48 1wok s HIS 855 Ca 0.61 -0.37 -0.02 0.00 -0.80 0.00 0.00 55.06 54.49 1wok s HIS 855 Cb -0.13 -0.98 0.00 0.00 -1.43 0.00 0.00 32.58 30.05 1wok s HIS 855 CO 0.54 0.65 0.31 0.09 -2.00 0.00 0.00 174.74 174.32 1wok n ASN 856 N -0.50 -2.76 -4.73 7.38 4.13 -1.26 0.11 115.26 117.63 1wok n ASN 856 Ca -0.06 -0.16 -0.40 0.00 1.68 0.00 0.00 54.58 55.64 1wok n ASN 856 Cb 0.60 -1.76 -0.05 0.00 -1.54 0.00 0.00 39.78 37.03 1wok n ASN 856 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1wok s ARG 857 N -4.99 4.45 0.17 3.52 1.70 -1.26 -2.85 118.95 119.69 1wok s ARG 857 Ca 0.10 0.96 -0.14 0.00 -0.47 0.00 0.00 55.73 56.18 1wok s ARG 857 Cb -0.04 -3.41 0.02 0.00 -0.57 0.00 0.00 34.95 30.94 1wok s ARG 857 CO 0.20 0.15 0.41 -0.98 -1.08 0.00 0.00 175.30 173.99 1wok s ARG 858 N 0.48 1.22 -0.25 3.89 1.70 -0.48 -1.59 118.95 123.93 1wok s ARG 858 Ca 0.38 -0.94 -0.27 0.00 -0.47 0.00 0.00 55.73 54.43 1wok s ARG 858 Cb -0.19 0.46 0.00 0.00 -0.57 0.00 0.00 34.95 34.65 1wok s ARG 858 CO 0.20 -0.49 0.95 -0.51 -1.08 0.00 0.00 175.30 174.37 1wok s LEU 859 N -2.89 4.08 0.05 -1.89 1.43 -0.88 -1.42 118.68 117.16 1wok s LEU 859 Ca 0.10 1.17 0.04 0.00 -1.03 0.00 0.00 54.13 54.42 1wok s LEU 859 Cb 0.01 -3.38 -0.03 0.00 0.03 0.00 0.00 46.19 42.83 1wok s LEU 859 CO -0.04 -0.63 -0.12 -0.76 0.23 0.00 0.00 176.35 175.03 1wok s LEU 860 N 3.09 2.24 0.59 1.79 1.43 -0.31 -4.63 118.68 122.88 1wok s LEU 860 Ca 0.40 -0.54 -0.13 0.00 -1.03 0.00 0.00 54.13 52.83 1wok s LEU 860 Cb -0.15 -0.44 -0.05 0.00 0.03 0.00 0.00 46.19 45.59 1wok s LEU 860 CO 0.08 -0.08 1.02 0.26 0.23 0.00 0.00 176.35 177.86 1wok s TRP 861 N -1.15 3.50 -0.23 0.29 0.52 0.10 -2.02 118.94 119.95 1wok s TRP 861 Ca -0.03 1.37 -0.06 0.00 0.02 0.00 0.00 56.10 57.40 1wok s TRP 861 Cb -0.09 -2.77 0.11 0.00 -1.15 0.00 0.00 33.47 29.57 1wok s TRP 861 CO 0.01 -0.64 0.47 -1.58 0.02 0.00 0.00 176.95 175.23 1wok s HIS 862 N -2.95 -0.96 -0.12 -1.98 2.46 -0.72 -1.60 115.29 109.43 1wok s HIS 862 Ca 0.57 1.59 0.01 0.00 0.47 0.00 0.00 55.06 57.70 1wok s HIS 862 Cb -0.11 0.37 -0.01 0.00 -0.13 0.00 0.00 32.58 32.70 1wok s HIS 862 CO 0.46 -0.58 -0.16 0.20 -2.47 0.00 0.00 174.74 172.19 1wok s GLY 863 N 2.67 1.48 0.20 1.59 0.00 -1.25 0.09 107.32 112.11 1wok s GLY 863 Ca 0.01 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.84 1wok s GLY 863 CO -0.15 -0.27 0.20 -1.26 0.00 0.00 0.00 173.10 171.62 1wok n SER 864 N 3.43 -0.53 -4.79 1.64 2.88 -1.25 -4.52 113.62 110.48 1wok n SER 864 Ca -0.18 -2.27 -0.35 0.00 -1.33 0.00 0.00 58.87 54.74 1wok n SER 864 Cb 0.53 1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 65.11 1wok n SER 864 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1wok s ARG 865 N -2.72 3.76 0.02 -1.46 1.81 -1.25 -4.20 118.95 114.91 1wok s ARG 865 Ca 0.22 1.48 -0.25 0.00 -1.72 0.00 0.00 55.73 55.46 1wok s ARG 865 Cb 0.01 -2.18 -0.18 0.00 -0.45 0.00 0.00 34.95 32.15 1wok s ARG 865 CO 0.16 -0.48 1.40 0.00 -0.68 0.00 0.00 175.30 175.70 1wok h THR 866 N 1.62 1.10 0.00 0.02 1.03 -1.89 -1.26 112.91 113.53 1wok h THR 866 Ca -0.49 -0.67 0.00 0.00 -0.01 0.00 0.00 66.41 65.24 1wok h THR 866 Cb 1.23 1.53 0.00 0.00 -1.07 0.00 0.00 68.15 69.85 1wok h THR 866 CO 0.59 0.16 0.00 0.35 -0.01 0.00 0.00 175.52 176.62 1wok n THR 867 N -5.00 1.49 0.05 0.00 -2.24 -1.26 -0.91 114.28 106.41 1wok n THR 867 Ca -0.08 0.37 0.09 0.00 -2.27 0.00 0.00 64.05 62.16 1wok n THR 867 Cb 0.19 -1.35 -0.07 0.00 -2.10 0.00 0.00 70.33 67.00 1wok n THR 867 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1wok n ASN 868 N -1.39 0.59 0.20 3.42 5.15 -0.51 -4.15 115.26 118.57 1wok n ASN 868 Ca 0.00 0.24 0.04 0.00 -0.60 0.00 0.00 54.58 54.26 1wok n ASN 868 Cb 0.01 0.84 0.43 0.00 -0.53 0.00 0.00 39.78 40.53 1wok n ASN 868 CO 0.00 0.00 0.00 -0.26 1.40 0.00 0.00 177.26 178.40 1wok h PHE 869 N 0.00 0.03 -0.60 1.20 -1.00 -0.65 -3.15 116.94 112.78 1wok h PHE 869 Ca -0.05 -0.00 0.11 0.00 2.81 0.00 0.00 57.97 60.83 1wok h PHE 869 Cb 1.15 -0.01 -0.08 0.00 3.61 0.00 0.00 35.95 40.62 1wok h PHE 869 CO 0.00 0.28 0.16 0.00 -1.61 0.00 0.00 178.31 177.14 1wok h ALA 870 N 1.72 0.73 -0.03 2.45 0.00 -1.77 -1.37 119.26 121.00 1wok h ALA 870 Ca 0.00 0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.82 1wok h ALA 870 Cb 0.45 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1wok h ALA 870 CO 0.03 -0.27 -0.84 0.78 0.00 0.00 0.00 179.25 178.95 1wok h GLY 871 N 0.31 0.39 0.95 0.00 0.00 -1.81 -2.98 103.07 99.93 1wok h GLY 871 Ca 0.31 -0.63 0.02 0.00 0.00 0.00 0.00 47.33 47.03 1wok h GLY 871 CO -0.36 0.56 0.60 -2.22 0.00 0.00 0.00 176.54 175.11 1wok h ILE 872 N 0.21 1.20 0.00 2.60 2.04 -1.32 1.13 117.51 123.37 1wok h ILE 872 Ca -0.05 -0.41 -0.11 0.00 1.00 0.00 0.00 64.86 65.29 1wok h ILE 872 Cb 1.45 -0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 1wok h ILE 872 CO 0.14 0.22 -0.51 -0.07 0.00 0.00 0.00 178.15 177.93 1wok h LEU 873 N 1.20 0.00 0.00 1.44 3.38 -1.33 0.69 115.31 120.69 1wok h LEU 873 Ca 0.35 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.07 1wok h LEU 873 Cb -0.08 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.63 1wok h LEU 873 CO -0.09 0.51 -1.56 0.77 0.09 0.00 0.00 178.44 178.15 1wok h SER 874 N 0.00 0.00 -0.00 -0.43 4.64 -1.15 -3.39 113.55 113.23 1wok h SER 874 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1wok h SER 874 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1wok h SER 874 CO 0.07 0.87 -0.25 0.00 -0.87 0.00 0.00 176.83 176.65 1wok n GLN 875 N -3.02 3.71 -0.35 4.77 1.13 0.38 -5.00 117.38 119.00 1wok n GLN 875 Ca -0.13 -0.22 0.04 0.00 -1.94 0.00 0.00 57.00 54.75 1wok n GLN 875 Cb 0.98 -0.89 -0.02 0.00 0.11 0.00 0.00 30.24 30.42 1wok n GLN 875 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1wok n GLY 876 N 0.99 -2.44 3.71 1.08 0.00 0.24 -4.73 105.19 104.04 1wok n GLY 876 Ca 0.02 -1.38 -0.42 0.00 0.00 0.00 0.00 46.02 44.24 1wok n GLY 876 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wok s LEU 877 N -5.20 4.37 0.30 0.99 1.43 -1.26 -4.67 118.68 114.64 1wok s LEU 877 Ca 0.00 2.49 0.08 0.00 -1.03 0.00 0.00 54.13 55.67 1wok s LEU 877 Cb 0.00 -3.58 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 1wok s LEU 877 CO 0.00 -0.80 -0.08 -0.60 0.23 0.00 0.00 176.35 175.10 1wok s ARG 878 N 1.61 1.65 -0.00 1.70 3.00 -1.26 -4.88 118.95 120.76 1wok s ARG 878 Ca 0.70 -1.84 -0.09 0.00 -1.00 0.00 0.00 55.73 53.50 1wok s ARG 878 Cb -0.41 -1.36 -0.05 0.00 0.00 0.00 0.00 34.95 33.13 1wok s ARG 878 CO 0.31 0.08 0.30 0.96 0.00 0.00 0.00 175.30 176.95 1wok s ILE 879 N -2.86 5.24 0.23 4.11 -4.36 -1.26 -4.84 121.20 117.46 1wok s ILE 879 Ca 0.30 0.36 -0.28 0.00 -0.26 0.00 0.00 60.65 60.78 1wok s ILE 879 Cb 0.03 -3.58 -0.17 0.00 1.25 0.00 0.00 42.46 39.99 1wok s ILE 879 CO 0.14 0.43 0.55 0.00 0.24 0.00 0.00 174.94 176.30 1wok n ALA 880 N 1.35 -2.56 -0.55 2.27 0.00 -1.26 -4.89 120.51 114.87 1wok n ALA 880 Ca -0.13 0.41 -0.30 0.00 0.00 0.00 0.00 53.44 53.43 1wok n ALA 880 Cb 0.53 -1.65 0.22 0.00 0.00 0.00 0.00 19.45 18.54 1wok n ALA 880 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1wok n PRO 881 N 0.98 -2.32 -0.15 0.00 -0.04 -1.26 -4.87 135.00 127.34 1wok n PRO 881 Ca 0.17 -0.66 -0.11 0.00 -0.04 0.00 0.00 63.50 62.85 1wok n PRO 881 Cb 0.27 -1.86 -0.01 0.00 -0.04 0.00 0.00 33.50 31.86 1wok n PRO 881 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1wok h PRO 882 N -2.50 0.86 -0.99 0.54 0.11 -2.01 -2.88 132.00 125.13 1wok h PRO 882 Ca -0.54 -0.33 0.08 0.00 0.11 0.00 0.00 66.00 65.32 1wok h PRO 882 Cb 1.31 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.30 1wok h PRO 882 CO 0.40 0.97 0.64 0.93 -0.21 0.00 0.00 178.00 180.72 1wok h GLU 883 N 0.69 1.08 -6.81 1.05 3.07 -1.91 -3.44 114.58 108.31 1wok h GLU 883 Ca 0.11 -0.06 -0.57 0.00 -0.50 0.00 0.00 59.36 58.34 1wok h GLU 883 Cb 0.65 -0.24 0.13 0.00 -0.84 0.00 0.00 28.75 28.45 1wok h GLU 883 CO 0.04 0.71 0.37 0.00 -1.40 0.00 0.00 179.01 178.74 1wok n ALA 884 N -2.36 0.89 -2.71 3.43 0.00 -1.09 -3.78 120.51 114.88 1wok n ALA 884 Ca 0.16 0.20 -0.41 0.00 0.00 0.00 0.00 53.44 53.39 1wok n ALA 884 Cb 0.23 -2.21 -0.04 0.00 0.00 0.00 0.00 19.45 17.44 1wok n ALA 884 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1wok s PRO 885 N -2.33 4.51 0.30 0.00 0.04 -1.26 -4.93 135.00 131.33 1wok s PRO 885 Ca 0.65 1.20 -0.01 0.00 0.04 0.00 0.00 61.00 62.88 1wok s PRO 885 Cb -0.49 -3.46 0.48 0.00 0.04 0.00 0.00 34.50 31.07 1wok s PRO 885 CO 0.55 -0.01 1.95 -0.39 0.04 0.00 0.00 177.00 179.14 1wok h VAL 886 N 4.79 1.16 -0.08 -0.36 -1.51 -1.94 -2.20 116.25 116.11 1wok h VAL 886 Ca -0.41 -0.37 0.02 0.00 -1.23 0.00 0.00 66.70 64.72 1wok h VAL 886 Cb 1.21 -0.02 -0.00 0.00 -2.13 0.00 0.00 31.29 30.35 1wok h VAL 886 CO 0.75 0.20 0.54 0.74 -1.23 0.00 0.00 177.57 178.57 1wok h THR 887 N 1.08 0.04 0.00 7.19 2.02 -1.97 0.18 112.91 121.45 1wok h THR 887 Ca 0.33 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.51 1wok h THR 887 Cb -0.01 0.48 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1wok h THR 887 CO -0.09 0.00 0.00 1.23 0.37 0.00 0.00 175.52 177.03 1wok h GLY 888 N 0.00 0.00 -2.74 2.16 0.00 -1.76 -3.45 103.07 97.28 1wok h GLY 888 Ca 0.04 0.00 -0.63 0.00 0.00 0.00 0.00 47.33 46.74 1wok h GLY 888 CO -0.00 0.00 -0.79 -0.19 0.00 0.00 0.00 176.54 175.56 1wok s TYR 889 N -3.38 2.27 0.12 5.60 1.51 0.65 -4.92 117.35 119.20 1wok s TYR 889 Ca 0.05 -0.35 -0.02 0.00 -1.01 0.00 0.00 57.07 55.74 1wok s TYR 889 Cb 0.09 -1.06 -0.13 0.00 -0.11 0.00 0.00 41.96 40.76 1wok s TYR 889 CO 0.51 0.59 1.28 1.98 -1.11 0.00 0.00 175.55 178.80 1wok h MET 890 N 2.77 0.28 0.00 -0.62 1.85 -1.87 -3.35 114.93 113.99 1wok h MET 890 Ca -0.43 -0.36 -0.05 0.00 -0.61 0.00 0.00 59.70 58.25 1wok h MET 890 Cb 1.23 0.11 -0.11 0.00 0.43 0.00 0.00 31.60 33.26 1wok h MET 890 CO 0.54 1.09 -0.64 1.19 -0.40 0.00 0.00 176.91 178.69 1wok n PHE 891 N -3.64 0.00 0.00 1.39 3.72 -1.24 -1.97 117.46 115.72 1wok n PHE 891 Ca -0.06 -1.17 0.00 0.00 -0.05 0.00 0.00 57.45 56.17 1wok n PHE 891 Cb 0.89 -0.21 0.00 0.00 -0.94 0.00 0.00 39.48 39.21 1wok n PHE 891 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1wok n GLY 892 N -0.65 -1.33 3.63 1.37 0.00 -1.26 -3.63 105.19 103.32 1wok n GLY 892 Ca 0.15 -1.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 1wok n GLY 892 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1wok n LYS 893 N -1.11 2.36 -1.31 1.61 5.02 -1.26 -4.87 118.16 118.61 1wok n LYS 893 Ca 0.00 0.78 0.00 0.00 -2.02 0.00 0.00 58.31 57.07 1wok n LYS 893 Cb 0.00 -3.07 0.00 0.00 -0.02 0.00 0.00 35.03 31.94 1wok n LYS 893 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1wok n GLY 894 N 5.15 1.39 3.60 0.72 0.00 -1.26 -4.87 105.19 109.91 1wok n GLY 894 Ca 0.25 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 1wok n GLY 894 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1wok s ILE 895 N -2.59 4.65 0.27 -0.61 1.01 -0.56 -4.68 121.20 118.69 1wok s ILE 895 Ca 0.00 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 60.60 1wok s ILE 895 Cb 0.00 -3.10 -0.03 0.00 0.01 0.00 0.00 42.46 39.34 1wok s ILE 895 CO 0.00 0.44 0.41 -0.31 0.00 0.00 0.00 174.94 175.48 1wok s TYR 896 N 0.54 3.47 0.14 3.97 1.51 -1.26 -2.55 117.35 123.17 1wok s TYR 896 Ca 0.03 0.10 -0.16 0.00 -1.01 0.00 0.00 57.07 56.02 1wok s TYR 896 Cb -0.13 -1.67 0.03 0.00 -0.11 0.00 0.00 41.96 40.08 1wok s TYR 896 CO 0.01 0.35 0.41 -0.06 -1.11 0.00 0.00 175.55 175.16 1wok s PHE 897 N -2.06 -0.16 0.34 2.71 0.40 -0.12 -4.82 117.98 114.27 1wok s PHE 897 Ca 0.36 -0.17 0.03 0.00 -0.60 0.00 0.00 56.93 56.55 1wok s PHE 897 Cb -0.09 0.26 -0.04 0.00 0.51 0.00 0.00 43.02 43.66 1wok s PHE 897 CO 0.31 -0.74 0.12 0.00 0.70 0.00 0.00 175.22 175.61 1wok s ALA 898 N -3.82 2.37 -0.02 5.36 0.00 -0.63 -1.51 121.76 123.50 1wok s ALA 898 Ca 0.05 -1.66 0.03 0.00 0.00 0.00 0.00 51.96 50.38 1wok s ALA 898 Cb 0.01 0.89 0.05 0.00 0.00 0.00 0.00 23.12 24.07 1wok s ALA 898 CO -0.10 -0.40 0.87 -0.40 0.00 0.00 0.00 175.76 175.73 1wok n ASP 899 N -0.96 1.08 -3.84 0.00 5.68 -1.26 -0.72 116.55 116.53 1wok n ASP 899 Ca -0.02 -1.89 -0.30 0.00 -0.50 0.00 0.00 54.79 52.08 1wok n ASP 899 Cb 0.65 -0.11 -0.14 0.00 -1.14 0.00 0.00 41.12 40.38 1wok n ASP 899 CO 0.00 0.00 0.00 -0.04 -1.33 0.00 0.00 177.20 175.83 1wok s MET 900 N -0.85 1.35 0.38 0.11 -1.94 -1.26 -4.78 119.30 112.30 1wok s MET 900 Ca 0.06 -1.90 0.21 0.00 -1.71 0.00 0.00 55.69 52.35 1wok s MET 900 Cb 0.05 -2.67 1.26 0.00 2.01 0.00 0.00 34.83 35.48 1wok s MET 900 CO 0.01 -1.06 1.63 -0.24 -0.01 0.00 0.00 175.02 175.35 1wok h VAL 901 N 5.90 0.17 -0.97 -6.03 3.04 -1.48 1.13 116.25 118.01 1wok h VAL 901 Ca -0.06 -0.06 0.04 0.00 -1.01 0.00 0.00 66.70 65.61 1wok h VAL 901 Cb 0.96 -0.01 -0.06 0.00 -2.01 0.00 0.00 31.29 30.17 1wok h VAL 901 CO 0.53 0.03 0.63 0.28 -1.01 0.00 0.00 177.57 178.03 1wok h SER 902 N 0.17 1.05 -0.62 3.17 0.02 -1.91 0.84 113.55 116.27 1wok h SER 902 Ca 0.79 -0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.77 1wok h SER 902 Cb 2.09 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 64.35 1wok h SER 902 CO -0.59 0.71 0.36 0.50 -1.14 0.00 0.00 176.83 176.68 1wok h LYS 903 N 1.22 0.68 -0.02 3.45 3.64 0.10 -0.47 116.57 125.17 1wok h LYS 903 Ca 0.39 -0.04 -0.21 0.00 -1.27 0.00 0.00 60.65 59.52 1wok h LYS 903 Cb 0.01 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1wok h LYS 903 CO -0.13 0.45 -0.88 0.77 -2.27 0.00 0.00 179.45 177.40 1wok h SER 904 N 0.70 0.46 -0.03 4.20 0.02 -1.27 -3.25 113.55 114.38 1wok h SER 904 Ca 0.26 -0.35 0.03 0.00 -0.84 0.00 0.00 61.79 60.89 1wok h SER 904 Cb 0.09 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.43 1wok h SER 904 CO -0.13 1.14 -0.36 0.00 -1.14 0.00 0.00 176.83 176.33 1wok h ALA 905 N 0.84 -0.53 -0.93 3.77 0.00 0.15 -0.90 119.26 121.66 1wok h ALA 905 Ca -0.06 -0.02 0.27 0.00 0.00 0.00 0.00 54.91 55.10 1wok h ALA 905 Cb 1.49 0.64 -0.04 0.00 0.00 0.00 0.00 17.79 19.89 1wok h ALA 905 CO 0.15 -0.87 1.05 -0.91 0.00 0.00 0.00 179.25 178.66 1wok h ASN 906 N -0.50 0.00 -0.11 0.00 2.35 -1.14 0.65 115.58 116.83 1wok h ASN 906 Ca 0.06 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1wok h ASN 906 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 1wok h ASN 906 CO -0.30 0.00 0.00 -1.22 -1.65 0.00 0.00 177.43 174.26 1wok n TYR 907 N -3.38 0.14 1.10 1.19 4.01 -0.34 -3.29 117.16 116.59 1wok n TYR 907 Ca 0.21 -0.07 0.13 0.00 -0.16 0.00 0.00 57.90 58.00 1wok n TYR 907 Cb 1.34 0.00 0.36 0.00 -0.31 0.00 0.00 39.34 40.74 1wok n TYR 907 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1wok n HIS 909 N -1.25 -1.46 -3.59 0.00 8.25 -1.21 -4.63 115.22 111.33 1wok n HIS 909 Ca 0.08 0.18 -0.22 0.00 -0.26 0.00 0.00 57.72 57.50 1wok n HIS 909 Cb 0.33 -2.90 -0.01 0.00 1.12 0.00 0.00 29.99 28.53 1wok n HIS 909 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1wok s THR 910 N -3.60 4.96 0.28 1.59 -4.23 -1.26 -5.04 115.64 108.34 1wok s THR 910 Ca 0.44 -0.73 -0.00 0.00 -1.18 0.00 0.00 61.69 60.22 1wok s THR 910 Cb -0.23 -3.78 -0.02 0.00 1.34 0.00 0.00 72.50 69.81 1wok s THR 910 CO 0.96 -0.41 0.29 -0.44 -0.54 0.00 0.00 174.62 174.48 1wok s SER 911 N -4.04 0.75 0.54 3.99 0.01 0.69 -4.97 113.70 110.67 1wok s SER 911 Ca 0.39 -1.47 0.31 0.00 1.31 0.00 0.00 55.95 56.49 1wok s SER 911 Cb -0.09 0.52 1.69 0.00 0.21 0.00 0.00 66.02 68.35 1wok s SER 911 CO 0.33 -1.04 1.94 -0.61 0.41 0.00 0.00 173.24 174.27 1wok h GLN 912 N 2.32 0.00 0.00 12.44 4.15 -1.99 -1.65 115.11 130.39 1wok h GLN 912 Ca -0.30 0.00 -0.18 0.00 0.77 0.00 0.00 58.65 58.94 1wok h GLN 912 Cb 1.24 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.90 1wok h GLN 912 CO 0.43 0.00 -1.06 0.78 -1.93 0.00 0.00 178.83 177.05 1wok h GLY 913 N 0.00 0.00 -7.53 2.39 0.00 -2.01 -3.43 103.07 92.50 1wok h GLY 913 Ca 0.00 0.00 -0.70 0.00 0.00 0.00 0.00 47.33 46.63 1wok h GLY 913 CO 0.00 0.00 -0.39 -0.35 0.00 0.00 0.00 176.54 175.80 1wok s ASP 914 N -6.65 5.32 0.19 0.19 3.68 -0.65 -4.96 116.67 113.79 1wok s ASP 914 Ca -0.26 -2.63 0.24 0.00 2.13 0.00 0.00 52.55 52.03 1wok s ASP 914 Cb 0.05 -1.87 0.34 0.00 -1.45 0.00 0.00 42.92 39.99 1wok s ASP 914 CO 0.54 -0.43 1.36 1.55 0.13 0.00 0.00 175.17 178.32 1wok h PRO 915 N 7.34 0.00 -5.93 4.34 0.13 -1.76 0.20 132.00 136.31 1wok h PRO 915 Ca -0.04 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.49 1wok h PRO 915 Cb 0.98 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.05 1wok h PRO 915 CO 0.72 0.00 -0.15 0.42 -0.23 0.00 0.00 178.00 178.76 1wok s ILE 916 N -3.20 5.05 0.18 -3.56 1.09 -1.26 -1.11 121.20 118.38 1wok s ILE 916 Ca 0.06 0.94 -0.00 0.00 -1.10 0.00 0.00 60.65 60.54 1wok s ILE 916 Cb 0.11 -3.78 -0.04 0.00 -1.06 0.00 0.00 42.46 37.69 1wok s ILE 916 CO 0.71 0.48 0.08 -0.83 -0.10 0.00 0.00 174.94 175.28 1wok s GLY 917 N -0.41 1.28 -0.10 6.18 0.00 -0.53 -4.97 107.32 108.78 1wok s GLY 917 Ca 0.25 -1.62 0.04 0.00 0.00 0.00 0.00 44.72 43.39 1wok s GLY 917 CO 0.13 -1.43 -0.23 1.08 0.00 0.00 0.00 173.10 172.65 1wok s LEU 918 N -3.14 2.05 0.05 0.66 1.43 -1.26 -1.85 118.68 116.61 1wok s LEU 918 Ca 0.31 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.93 1wok s LEU 918 Cb 0.07 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.91 1wok s LEU 918 CO 0.07 0.15 -0.14 -0.51 0.23 0.00 0.00 176.35 176.16 1wok s ILE 919 N 0.36 1.07 0.24 -0.59 2.07 -1.13 -3.74 121.20 119.48 1wok s ILE 919 Ca -0.18 -1.09 0.07 0.00 -1.41 0.00 0.00 60.65 58.04 1wok s ILE 919 Cb -0.18 -1.00 -0.04 0.00 0.13 0.00 0.00 42.46 41.38 1wok s ILE 919 CO 0.08 -0.09 0.14 -0.76 -1.91 0.00 0.00 174.94 172.40 1wok s LEU 920 N -1.35 3.66 -0.13 8.50 1.43 0.11 -2.04 118.68 128.86 1wok s LEU 920 Ca -0.00 -0.33 -0.00 0.00 -1.03 0.00 0.00 54.13 52.77 1wok s LEU 920 Cb -0.09 -2.21 0.03 0.00 0.03 0.00 0.00 46.19 43.95 1wok s LEU 920 CO 0.02 -0.01 -0.09 -0.76 0.23 0.00 0.00 176.35 175.73 1wok s LEU 921 N -3.69 1.41 0.11 1.79 1.43 -1.03 -1.76 118.68 116.95 1wok s LEU 921 Ca 0.32 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 53.05 1wok s LEU 921 Cb -0.08 -0.96 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 1wok s LEU 921 CO 0.23 -0.11 -0.12 -0.83 0.23 0.00 0.00 176.35 175.75 1wok s GLY 922 N 1.63 0.95 -0.41 -3.19 0.00 -0.86 -1.49 107.32 103.96 1wok s GLY 922 Ca 0.04 -1.22 -0.15 0.00 0.00 0.00 0.00 44.72 43.40 1wok s GLY 922 CO -0.09 -1.28 0.29 -1.83 0.00 0.00 0.00 173.10 170.19 1wok s GLU 923 N -2.64 2.98 0.02 2.90 -1.05 -0.88 -1.16 118.70 118.87 1wok s GLU 923 Ca 0.06 -1.01 -0.08 0.00 -0.15 0.00 0.00 54.97 53.79 1wok s GLU 923 Cb -0.04 -3.96 -0.05 0.00 -0.44 0.00 0.00 34.13 29.64 1wok s GLU 923 CO 0.02 -0.74 0.30 0.14 0.95 0.00 0.00 175.26 175.93 1wok s VAL 924 N 1.67 5.25 -0.67 1.83 -7.23 -0.51 -1.97 120.40 118.77 1wok s VAL 924 Ca 0.05 0.28 -0.16 0.00 -1.81 0.00 0.00 61.98 60.33 1wok s VAL 924 Cb -0.19 -3.58 0.16 0.00 0.56 0.00 0.00 36.38 33.32 1wok s VAL 924 CO 0.10 0.38 0.66 0.00 -0.31 0.00 0.00 175.10 175.92 1wok s ALA 925 N -1.29 3.74 -0.04 1.32 0.00 -0.87 -1.38 121.76 123.24 1wok s ALA 925 Ca 0.28 -2.76 -0.16 0.00 0.00 0.00 0.00 51.96 49.31 1wok s ALA 925 Cb -0.14 -3.44 -0.31 0.00 0.00 0.00 0.00 23.12 19.23 1wok s ALA 925 CO 0.16 -2.22 0.78 -0.07 0.00 0.00 0.00 175.76 174.41 1wok h LEU 926 N 8.78 0.58 0.00 0.00 3.38 -1.67 -3.46 115.31 122.92 1wok h LEU 926 Ca -0.14 -0.92 0.00 0.00 0.09 0.00 0.00 57.88 56.92 1wok h LEU 926 Cb 1.07 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1wok h LEU 926 CO 0.96 1.62 0.00 0.61 0.09 0.00 0.00 178.44 181.72 1wok n GLY 927 N 1.74 2.53 3.41 0.83 0.00 0.30 -2.56 105.19 111.44 1wok n GLY 927 Ca -0.20 -0.29 -0.44 0.00 0.00 0.00 0.00 46.02 45.09 1wok n GLY 927 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1wok s ASN 928 N -4.00 6.18 0.07 1.61 3.84 -1.26 -4.72 114.94 116.65 1wok s ASN 928 Ca 0.00 -1.20 -0.30 0.00 0.21 0.00 0.00 52.86 51.57 1wok s ASN 928 Cb 0.00 -2.35 -0.05 0.00 -0.55 0.00 0.00 41.25 38.30 1wok s ASN 928 CO 0.00 -1.25 1.09 -0.04 -2.79 0.00 0.00 177.10 174.11 1wok s MET 929 N 3.30 4.52 -1.07 0.43 -1.94 -1.26 -0.69 119.30 122.58 1wok s MET 929 Ca 0.16 1.62 -0.15 0.00 -1.71 0.00 0.00 55.69 55.62 1wok s MET 929 Cb -0.21 -3.37 0.17 0.00 2.01 0.00 0.00 34.83 33.43 1wok s MET 929 CO 0.08 -0.10 1.23 -0.47 -0.01 0.00 0.00 175.02 175.76 1wok s TYR 930 N 0.73 3.49 -0.15 -0.03 5.04 -1.02 -4.91 117.35 120.50 1wok s TYR 930 Ca 0.54 -1.94 -0.29 0.00 -2.44 0.00 0.00 57.07 52.94 1wok s TYR 930 Cb -0.26 -4.20 -0.02 0.00 0.35 0.00 0.00 41.96 37.82 1wok s TYR 930 CO 0.30 -1.34 1.34 -1.21 -1.34 0.00 0.00 175.55 173.30 1wok s GLU 931 N 1.49 4.21 0.52 4.97 2.02 -1.26 -3.58 118.70 127.07 1wok s GLU 931 Ca 0.36 1.75 0.03 0.00 0.02 0.00 0.00 54.97 57.13 1wok s GLU 931 Cb -0.05 -3.81 0.01 0.00 0.10 0.00 0.00 34.13 30.38 1wok s GLU 931 CO -0.05 -0.75 0.17 -0.51 0.02 0.00 0.00 175.26 174.14 1wok s LEU 932 N 3.64 2.47 0.00 1.80 1.43 -0.61 -4.95 118.68 122.46 1wok s LEU 932 Ca 0.58 -1.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.22 1wok s LEU 932 Cb -0.24 -0.93 0.02 0.00 0.03 0.00 0.00 46.19 45.07 1wok s LEU 932 CO 0.18 -0.95 0.70 2.29 0.23 0.00 0.00 176.35 178.80 1wok n LYS 933 N -1.47 0.00 -3.67 1.70 2.85 -1.26 -2.46 118.16 113.85 1wok n LYS 933 Ca -0.12 -0.44 -0.08 0.00 -1.05 0.00 0.00 58.31 56.63 1wok n LYS 933 Cb 0.66 0.04 -0.09 0.00 -0.65 0.00 0.00 35.03 34.99 1wok n LYS 933 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 177.40 173.97 1wok s HIS 934 N 0.00 -0.84 -0.24 5.58 -3.43 -1.26 -0.67 115.29 114.42 1wok s HIS 934 Ca 0.02 1.64 -0.35 0.00 -0.80 0.00 0.00 55.06 55.57 1wok s HIS 934 Cb 0.02 0.41 -0.16 0.00 -1.43 0.00 0.00 32.58 31.42 1wok s HIS 934 CO -0.01 -0.47 1.10 0.00 -2.00 0.00 0.00 174.74 173.37 1wok n ALA 935 N 4.87 -1.80 -3.67 -1.38 0.00 -1.26 -4.96 120.51 112.31 1wok n ALA 935 Ca -0.16 0.42 -0.08 0.00 0.00 0.00 0.00 53.44 53.62 1wok n ALA 935 Cb 0.53 -1.47 -0.09 0.00 0.00 0.00 0.00 19.45 18.42 1wok n ALA 935 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1wok s SER 936 N 1.47 -0.43 -1.03 0.00 0.15 -0.83 -5.06 113.70 107.97 1wok s SER 936 Ca 0.79 1.03 -0.20 0.00 0.70 0.00 0.00 55.95 58.26 1wok s SER 936 Cb -1.11 1.23 0.09 0.00 -1.71 0.00 0.00 66.02 64.52 1wok s SER 936 CO 0.57 -0.22 1.36 -1.00 1.20 0.00 0.00 173.24 175.15 1wok s HIS 937 N 2.20 2.82 0.68 3.44 3.76 -1.25 -3.69 115.29 123.25 1wok s HIS 937 Ca -0.05 -1.19 -0.17 0.00 -0.15 0.00 0.00 55.06 53.50 1wok s HIS 937 Cb -0.10 -4.53 0.01 0.00 1.11 0.00 0.00 32.58 29.06 1wok s HIS 937 CO -0.14 -1.73 1.24 -0.89 -0.85 0.00 0.00 174.74 172.37 1wok n ILE 938 N 6.21 4.25 0.09 0.60 5.41 -1.24 -4.80 119.36 129.88 1wok n ILE 938 Ca 0.32 -0.44 0.00 0.00 1.00 0.00 0.00 62.75 63.63 1wok n ILE 938 Cb 0.49 -1.40 0.00 0.00 -0.71 0.00 0.00 39.64 38.03 1wok n ILE 938 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 1wok n SER 939 N -2.08 0.47 -4.74 4.38 2.88 -1.26 -4.60 113.62 108.66 1wok n SER 939 Ca 0.15 0.28 -0.31 0.00 -1.33 0.00 0.00 58.87 57.67 1wok n SER 939 Cb 0.48 0.01 -0.07 0.00 -0.75 0.00 0.00 64.21 63.89 1wok n SER 939 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1wok s LYS 940 N -1.91 2.81 -0.34 -1.46 -2.85 -1.26 -5.09 119.74 109.64 1wok s LYS 940 Ca 0.00 -0.69 -0.11 0.00 -1.00 0.00 0.00 55.97 54.17 1wok s LYS 940 Cb 0.00 -2.69 0.01 0.00 -2.06 0.00 0.00 37.83 33.09 1wok s LYS 940 CO 0.00 0.58 0.19 -1.17 0.10 0.00 0.00 175.35 175.05 1wok s LEU 941 N -2.20 4.46 0.04 2.77 2.96 -1.26 -5.04 118.68 120.41 1wok s LEU 941 Ca 0.27 -0.71 -0.27 0.00 -0.22 0.00 0.00 54.13 53.20 1wok s LEU 941 Cb -0.12 -2.04 -0.14 0.00 0.50 0.00 0.00 46.19 44.39 1wok s LEU 941 CO 0.19 -0.29 0.67 -2.65 -1.32 0.00 0.00 176.35 172.95 1wok n PRO 942 N 5.02 0.00 -1.58 0.98 -0.02 -1.26 -4.63 135.00 133.50 1wok n PRO 942 Ca -0.13 0.00 -0.52 0.00 -2.02 0.00 0.00 63.50 60.84 1wok n PRO 942 Cb 0.48 -1.00 -0.06 0.00 -0.02 0.00 0.00 33.50 32.90 1wok n PRO 942 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1wok n LYS 943 N 1.00 1.08 0.00 -0.52 4.01 -1.26 -0.34 118.16 122.14 1wok n LYS 943 Ca 0.14 0.39 0.00 0.00 -0.51 0.00 0.00 58.31 58.33 1wok n LYS 943 Cb 0.10 -1.99 0.00 0.00 -0.51 0.00 0.00 35.03 32.62 1wok n LYS 943 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1wok n GLY 944 N 2.37 2.34 3.80 0.72 0.00 -1.26 -5.04 105.19 108.12 1wok n GLY 944 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 1wok n GLY 944 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wok s LYS 945 N -0.69 4.33 -0.09 1.61 -0.14 0.54 -4.49 119.74 120.81 1wok s LYS 945 Ca 0.00 0.89 -0.06 0.00 -1.36 0.00 0.00 55.97 55.44 1wok s LYS 945 Cb 0.00 -3.20 -0.04 0.00 -1.68 0.00 0.00 37.83 32.91 1wok s LYS 945 CO 0.00 0.59 -0.14 0.72 -0.76 0.00 0.00 175.35 175.75 1wok n HIS 946 N 1.55 0.00 -3.61 3.18 8.25 0.13 -4.82 115.22 119.90 1wok n HIS 946 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1wok n HIS 946 Cb 0.50 -0.35 0.00 0.00 1.12 0.00 0.00 29.99 31.26 1wok n HIS 946 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1wok n SER 947 N -3.61 1.42 -3.83 0.41 3.41 -1.06 -4.52 113.62 105.84 1wok n SER 947 Ca -0.18 -0.89 -0.12 0.00 -0.26 0.00 0.00 58.87 57.41 1wok n SER 947 Cb 0.54 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.36 1wok n SER 947 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1wok s VAL 948 N -0.24 -0.00 -0.09 -3.33 1.01 -0.67 -2.44 120.40 114.64 1wok s VAL 948 Ca 0.00 0.02 0.02 0.00 0.00 0.00 0.00 61.98 62.01 1wok s VAL 948 Cb 0.00 -0.15 0.02 0.00 0.00 0.00 0.00 36.38 36.24 1wok s VAL 948 CO 0.00 0.01 -0.12 -0.75 0.00 0.00 0.00 175.10 174.23 1wok s LYS 949 N 0.15 1.84 -0.12 2.72 2.36 -1.24 -2.00 119.74 123.45 1wok s LYS 949 Ca -0.01 -0.43 -0.20 0.00 -2.55 0.00 0.00 55.97 52.78 1wok s LYS 949 Cb -0.02 -1.60 -0.04 0.00 -1.05 0.00 0.00 37.83 35.13 1wok s LYS 949 CO -0.00 -0.06 0.57 0.20 1.55 0.00 0.00 175.35 177.61 1wok s GLY 950 N 0.98 2.37 0.03 5.54 0.00 -0.88 -1.58 107.32 113.78 1wok s GLY 950 Ca -0.08 -0.13 -0.21 0.00 0.00 0.00 0.00 44.72 44.30 1wok s GLY 950 CO -0.00 1.01 0.62 1.08 0.00 0.00 0.00 173.10 175.81 1wok s LEU 951 N 0.99 4.45 0.26 0.66 1.43 -1.03 -2.44 118.68 123.00 1wok s LEU 951 Ca 0.30 1.24 0.10 0.00 -1.03 0.00 0.00 54.13 54.74 1wok s LEU 951 Cb -0.16 -2.97 -0.04 0.00 0.03 0.00 0.00 46.19 43.04 1wok s LEU 951 CO 0.12 0.13 -0.07 -0.83 0.23 0.00 0.00 176.35 175.94 1wok s GLY 952 N -0.41 1.72 0.35 -3.19 0.00 -1.26 -4.17 107.32 100.36 1wok s GLY 952 Ca 0.32 -1.69 0.09 0.00 0.00 0.00 0.00 44.72 43.43 1wok s GLY 952 CO 0.19 -1.76 1.83 0.50 0.00 0.00 0.00 173.10 173.86 1wok h LYS 953 N 2.14 0.23 -6.33 2.90 1.57 -1.47 -3.43 116.57 112.17 1wok h LYS 953 Ca -0.43 -0.07 -0.61 0.00 -1.87 0.00 0.00 60.65 57.66 1wok h LYS 953 Cb 1.25 -0.02 -0.25 0.00 0.08 0.00 0.00 32.23 33.29 1wok h LYS 953 CO 0.59 0.46 -0.85 0.95 -0.57 0.00 0.00 179.45 180.04 1wok s THR 954 N -4.48 1.84 -0.06 -0.16 -4.23 -1.19 -2.66 115.64 104.71 1wok s THR 954 Ca -0.05 -1.35 -0.22 0.00 -1.18 0.00 0.00 61.69 58.89 1wok s THR 954 Cb 0.15 -1.61 0.05 0.00 1.34 0.00 0.00 72.50 72.42 1wok s THR 954 CO 0.75 0.19 0.48 0.42 -0.54 0.00 0.00 174.62 175.92 1wok s THR 955 N -0.88 0.03 -0.01 3.99 -4.23 0.51 -4.35 115.64 110.69 1wok s THR 955 Ca 0.09 -0.22 -0.37 0.00 -1.18 0.00 0.00 61.69 60.01 1wok s THR 955 Cb -0.09 -0.78 -0.16 0.00 1.34 0.00 0.00 72.50 72.81 1wok s THR 955 CO 0.03 -0.12 1.53 -2.65 -0.54 0.00 0.00 174.62 172.86 1wok n PRO 956 N 1.37 1.38 -1.36 3.99 -0.02 -1.26 -0.28 135.00 138.82 1wok n PRO 956 Ca -0.19 0.50 -0.62 0.00 -2.02 0.00 0.00 63.50 61.17 1wok n PRO 956 Cb 0.56 -2.19 -0.11 0.00 -0.02 0.00 0.00 33.50 31.74 1wok n PRO 956 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1wok n ASP 957 N 3.75 0.86 -0.06 2.55 -0.08 1.01 -4.79 116.55 119.80 1wok n ASP 957 Ca 0.21 0.80 0.11 0.00 -1.51 0.00 0.00 54.79 54.40 1wok n ASP 957 Cb 0.20 -0.89 0.51 0.00 2.34 0.00 0.00 41.12 43.27 1wok n ASP 957 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1wok h PRO 958 N 8.01 0.38 -0.85 -0.67 0.13 -1.88 -2.43 132.00 134.70 1wok h PRO 958 Ca -0.18 -0.02 -0.05 0.00 -0.87 0.00 0.00 66.00 64.87 1wok h PRO 958 Cb 1.40 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.41 1wok h PRO 958 CO 1.06 0.25 0.07 0.43 -0.23 0.00 0.00 178.00 179.58 1wok n SER 959 N -4.47 3.23 -0.12 1.44 7.64 -1.26 -3.58 113.62 116.51 1wok n SER 959 Ca 0.09 -2.50 0.02 0.00 1.01 0.00 0.00 58.87 57.49 1wok n SER 959 Cb 0.34 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.94 1wok n SER 959 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1wok n ALA 960 N 0.17 2.53 -1.45 -0.43 0.00 -0.91 -5.06 120.51 115.35 1wok n ALA 960 Ca 0.16 -0.37 -0.46 0.00 0.00 0.00 0.00 53.44 52.78 1wok n ALA 960 Cb 0.77 -0.17 -0.02 0.00 0.00 0.00 0.00 19.45 20.03 1wok n ALA 960 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1wok n ASN 961 N -0.30 -0.62 -3.71 0.00 5.03 -1.23 -4.37 115.26 110.06 1wok n ASN 961 Ca 0.02 1.10 -0.30 0.00 0.87 0.00 0.00 54.58 56.28 1wok n ASN 961 Cb 0.10 -1.06 -0.13 0.00 -1.02 0.00 0.00 39.78 37.67 1wok n ASN 961 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1wok s ILE 962 N -1.11 1.26 0.56 2.41 -1.09 0.23 -4.94 121.20 118.52 1wok s ILE 962 Ca 0.62 -2.31 -0.19 0.00 -2.23 0.00 0.00 60.65 56.53 1wok s ILE 962 Cb -0.82 -1.89 -0.05 0.00 -1.58 0.00 0.00 42.46 38.12 1wok s ILE 962 CO 0.58 -0.86 1.17 -0.55 -1.23 0.00 0.00 174.94 174.05 1wok s SER 963 N 0.61 5.50 -0.43 3.58 0.15 -1.26 -2.85 113.70 119.00 1wok s SER 963 Ca 0.16 2.29 0.09 0.00 0.70 0.00 0.00 55.95 59.20 1wok s SER 963 Cb -0.23 -2.59 0.31 0.00 -1.71 0.00 0.00 66.02 61.79 1wok s SER 963 CO -0.03 -1.38 0.69 0.18 1.20 0.00 0.00 173.24 173.90 1wok n LEU 964 N -1.38 1.34 -2.50 3.45 4.77 -0.14 -4.93 117.00 117.60 1wok n LEU 964 Ca 0.12 -5.03 -0.00 0.00 -0.03 0.00 0.00 56.01 51.07 1wok n LEU 964 Cb 0.50 0.41 -0.00 0.00 -2.33 0.00 0.00 43.42 41.99 1wok n LEU 964 CO 0.44 2.20 -0.43 -0.67 -1.33 0.00 0.00 177.39 177.60 1wok n ASP 965 N 0.64 -6.40 0.00 -1.43 2.03 -1.26 -3.84 116.55 106.29 1wok n ASP 965 Ca 0.25 1.20 0.00 0.00 0.52 0.00 0.00 54.79 56.76 1wok n ASP 965 Cb 0.56 -4.63 0.00 0.00 -0.72 0.00 0.00 41.12 36.33 1wok n ASP 965 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1wok n GLY 966 N 0.67 0.80 3.52 0.27 0.00 -1.26 -4.88 105.19 104.31 1wok n GLY 966 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 1wok n GLY 966 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wok s VAL 967 N 0.00 4.69 0.38 1.61 1.01 -1.25 -4.22 120.40 122.62 1wok s VAL 967 Ca 0.00 0.22 -0.23 0.00 0.00 0.00 0.00 61.98 61.97 1wok s VAL 967 Cb 0.00 -4.31 -0.10 0.00 0.00 0.00 0.00 36.38 31.97 1wok s VAL 967 CO 0.00 -0.74 0.95 -1.81 0.00 0.00 0.00 175.10 173.50 1wok s ASP 968 N 2.23 7.12 -0.15 3.32 1.01 -0.62 -0.97 116.67 128.61 1wok s ASP 968 Ca 0.26 1.77 -0.01 0.00 0.71 0.00 0.00 52.55 55.29 1wok s ASP 968 Cb -0.13 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.27 1wok s ASP 968 CO 0.20 -0.23 -0.04 -0.69 0.21 0.00 0.00 175.17 174.62 1wok s VAL 969 N -1.89 0.97 -1.51 -1.27 1.01 -1.13 -2.07 120.40 114.50 1wok s VAL 969 Ca 0.56 -0.49 -0.12 0.00 0.00 0.00 0.00 61.98 61.93 1wok s VAL 969 Cb -0.14 -1.15 -0.02 0.00 0.00 0.00 0.00 36.38 35.07 1wok s VAL 969 CO 0.19 0.15 2.55 -2.65 0.00 0.00 0.00 175.10 175.34 1wok n PRO 970 N 4.93 3.18 -0.26 2.72 -0.02 -1.26 -0.60 135.00 143.69 1wok n PRO 970 Ca -0.11 -2.38 0.10 0.00 -2.02 0.00 0.00 63.50 59.09 1wok n PRO 970 Cb 0.48 -3.05 0.27 0.00 -0.02 0.00 0.00 33.50 31.18 1wok n PRO 970 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1wok n LEU 971 N 4.98 3.19 -4.75 2.45 -0.00 -1.26 -4.86 117.00 116.74 1wok n LEU 971 Ca 0.64 -1.52 -0.40 0.00 -0.00 0.00 0.00 56.01 54.72 1wok n LEU 971 Cb 0.31 -0.34 -0.04 0.00 -0.00 0.00 0.00 43.42 43.35 1wok n LEU 971 CO 0.88 0.76 0.80 -0.83 -0.00 0.00 0.00 177.39 179.00 1wok s GLY 972 N -1.18 3.01 0.91 1.47 0.00 -1.26 -4.69 107.32 105.58 1wok s GLY 972 Ca 0.40 0.88 -0.16 0.00 0.00 0.00 0.00 44.72 45.84 1wok s GLY 972 CO 0.29 1.54 -0.28 -0.37 0.00 0.00 0.00 173.10 174.28 1wok n THR 973 N 1.47 0.18 -3.29 0.90 5.66 -1.26 -3.09 114.28 114.85 1wok n THR 973 Ca -0.00 -0.41 -0.39 0.00 -3.05 0.00 0.00 64.05 60.20 1wok n THR 973 Cb 0.45 -0.24 -0.07 0.00 -1.55 0.00 0.00 70.33 68.92 1wok n THR 973 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1wok s GLY 974 N -1.32 2.07 0.00 1.09 0.00 -1.26 0.33 107.32 108.24 1wok s GLY 974 Ca 0.49 -0.45 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1wok s GLY 974 CO 0.75 1.01 0.00 0.29 0.00 0.00 0.00 173.10 175.14 1wok n ILE 975 N 4.51 0.00 -3.94 0.90 -5.35 0.62 -4.80 119.36 111.30 1wok n ILE 975 Ca -0.06 0.00 -0.31 0.00 -0.27 0.00 0.00 62.75 62.11 1wok n ILE 975 Cb 0.51 0.00 -0.05 0.00 -1.74 0.00 0.00 39.64 38.36 1wok n ILE 975 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1wok s SER 976 N 0.52 6.24 0.18 7.28 1.04 -1.26 0.19 113.70 127.90 1wok s SER 976 Ca 0.00 0.25 0.09 0.00 0.48 0.00 0.00 55.95 56.77 1wok s SER 976 Cb 0.00 -1.90 -0.04 0.00 0.10 0.00 0.00 66.02 64.17 1wok s SER 976 CO 0.00 0.19 -0.14 -0.55 0.98 0.00 0.00 173.24 173.73 1wok s SER 977 N -2.36 4.03 0.34 7.02 0.15 -1.09 -4.82 113.70 116.97 1wok s SER 977 Ca 0.33 -0.65 0.12 0.00 0.70 0.00 0.00 55.95 56.45 1wok s SER 977 Cb -0.13 -0.60 0.98 0.00 -1.71 0.00 0.00 66.02 64.56 1wok s SER 977 CO 0.25 0.11 1.71 1.23 1.20 0.00 0.00 173.24 177.75 1wok h GLY 978 N 3.03 1.86 -5.89 9.45 0.00 -1.93 -3.43 103.07 106.16 1wok h GLY 978 Ca -0.47 -0.28 -0.72 0.00 0.00 0.00 0.00 47.33 45.86 1wok h GLY 978 CO 0.52 -0.30 0.56 -0.62 0.00 0.00 0.00 176.54 176.70 1wok n VAL 979 N -4.89 0.09 0.00 4.60 0.31 -1.26 -4.85 118.33 112.33 1wok n VAL 979 Ca 0.28 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.60 1wok n VAL 979 Cb 0.84 -0.82 0.00 0.00 -0.91 0.00 0.00 33.84 32.95 1wok n VAL 979 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1wok n ASN 980 N 3.36 0.81 -0.37 4.52 3.02 -1.26 -4.65 115.26 120.68 1wok n ASN 980 Ca 0.22 -0.17 0.11 0.00 -0.03 0.00 0.00 54.58 54.71 1wok n ASN 980 Cb 0.14 0.49 0.03 0.00 -0.61 0.00 0.00 39.78 39.84 1wok n ASN 980 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1wok n ASP 981 N -0.58 1.71 -4.70 6.41 5.75 -1.26 -4.96 116.55 118.92 1wok n ASP 981 Ca 0.00 -1.33 -0.38 0.00 -0.01 0.00 0.00 54.79 53.08 1wok n ASP 981 Cb 0.00 0.52 0.06 0.00 -1.03 0.00 0.00 41.12 40.67 1wok n ASP 981 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1wok n THR 982 N -0.37 4.36 0.54 2.12 5.66 -1.26 -4.91 114.28 120.42 1wok n THR 982 Ca 0.09 -0.50 0.12 0.00 -3.05 0.00 0.00 64.05 60.71 1wok n THR 982 Cb 0.43 -1.45 0.25 0.00 -1.55 0.00 0.00 70.33 68.02 1wok n THR 982 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1wok h SER 983 N 0.75 0.00 -3.25 1.09 0.02 -1.18 -3.47 113.55 107.51 1wok h SER 983 Ca -0.50 -0.10 -0.50 0.00 -0.84 0.00 0.00 61.79 59.84 1wok h SER 983 Cb 1.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.88 1wok h SER 983 CO 0.53 0.05 -0.08 -0.76 -1.14 0.00 0.00 176.83 175.43 1wok s LEU 984 N -4.55 3.97 -0.03 5.07 1.43 -1.26 -5.01 118.68 118.29 1wok s LEU 984 Ca 0.08 0.75 0.21 0.00 -1.03 0.00 0.00 54.13 54.14 1wok s LEU 984 Cb 0.12 -3.60 -0.28 0.00 0.03 0.00 0.00 46.19 42.46 1wok s LEU 984 CO 0.67 -0.29 0.48 -0.11 0.23 0.00 0.00 176.35 177.33 1wok n LEU 985 N -1.29 0.13 -3.90 1.79 7.94 -1.26 -2.93 117.00 117.48 1wok n LEU 985 Ca -0.01 0.05 -0.09 0.00 -1.11 0.00 0.00 56.01 54.85 1wok n LEU 985 Cb 0.54 0.09 -0.08 0.00 0.53 0.00 0.00 43.42 44.50 1wok n LEU 985 CO 0.49 0.08 -0.15 -0.31 -1.11 0.00 0.00 177.39 176.39 1wok s TYR 986 N -3.29 0.19 1.36 1.96 2.02 -1.26 -3.12 117.35 115.22 1wok s TYR 986 Ca -0.07 -0.59 -0.23 0.00 -0.37 0.00 0.00 57.07 55.81 1wok s TYR 986 Cb 0.12 -0.11 0.35 0.00 -0.40 0.00 0.00 41.96 41.92 1wok s TYR 986 CO 0.88 -0.47 0.83 0.09 -1.57 0.00 0.00 175.55 175.31 1wok n ASN 987 N 0.22 -3.89 -3.51 2.29 3.02 -1.26 -4.11 115.26 108.02 1wok n ASN 987 Ca -0.16 -0.85 -0.10 0.00 -0.03 0.00 0.00 54.58 53.44 1wok n ASN 987 Cb 0.61 -0.93 -0.03 0.00 -0.61 0.00 0.00 39.78 38.82 1wok n ASN 987 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1wok s GLU 988 N -4.98 0.83 -0.04 3.52 2.12 -1.02 -4.81 118.70 114.31 1wok s GLU 988 Ca 0.63 -0.17 -0.02 0.00 0.36 0.00 0.00 54.97 55.78 1wok s GLU 988 Cb -0.11 0.38 0.03 0.00 0.26 0.00 0.00 34.13 34.69 1wok s GLU 988 CO 0.53 -0.33 0.08 0.71 -0.54 0.00 0.00 175.26 175.70 1wok s TYR 989 N -2.56 -0.07 -0.03 5.30 1.51 -0.57 -2.07 117.35 118.87 1wok s TYR 989 Ca 0.02 0.27 0.02 0.00 -1.01 0.00 0.00 57.07 56.37 1wok s TYR 989 Cb -0.01 -0.12 0.01 0.00 -0.11 0.00 0.00 41.96 41.73 1wok s TYR 989 CO -0.05 -0.11 -0.05 0.42 -1.11 0.00 0.00 175.55 174.65 1wok s ILE 990 N 0.87 0.53 0.00 2.71 1.01 -0.85 -0.94 121.20 124.54 1wok s ILE 990 Ca -0.07 -0.19 0.06 0.00 0.00 0.00 0.00 60.65 60.45 1wok s ILE 990 Cb -0.10 -0.51 -0.02 0.00 0.01 0.00 0.00 42.46 41.84 1wok s ILE 990 CO -0.03 0.19 -0.19 0.68 0.00 0.00 0.00 174.94 175.59 1wok s VAL 991 N 0.46 1.47 -0.31 2.92 -7.23 -1.06 -1.66 120.40 114.99 1wok s VAL 991 Ca -0.06 -0.89 0.09 0.00 -1.81 0.00 0.00 61.98 59.31 1wok s VAL 991 Cb -0.10 -1.24 0.59 0.00 0.56 0.00 0.00 36.38 36.19 1wok s VAL 991 CO 0.00 0.33 1.61 -1.22 -0.31 0.00 0.00 175.10 175.51 1wok n TYR 992 N 2.39 1.72 -3.69 2.82 4.02 -1.26 -1.49 117.16 121.67 1wok n TYR 992 Ca -0.16 -1.48 -0.13 0.00 -0.01 0.00 0.00 57.90 56.12 1wok n TYR 992 Cb 0.54 -0.60 -0.13 0.00 -0.02 0.00 0.00 39.34 39.13 1wok n TYR 992 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1wok s ASP 993 N -1.93 0.13 0.47 7.72 2.15 -1.26 -5.03 116.67 118.92 1wok s ASP 993 Ca 0.49 0.53 0.21 0.00 0.43 0.00 0.00 52.55 54.20 1wok s ASP 993 Cb 0.42 0.52 1.16 0.00 -0.30 0.00 0.00 42.92 44.72 1wok s ASP 993 CO 0.06 -0.21 1.99 0.16 -0.17 0.00 0.00 175.17 177.00 1wok h ILE 994 N 6.13 0.85 0.00 4.11 3.07 -1.90 -2.35 117.51 127.42 1wok h ILE 994 Ca -0.26 -0.73 0.00 0.00 1.55 0.00 0.00 64.86 65.42 1wok h ILE 994 Cb 1.13 1.43 0.00 0.00 -0.27 0.00 0.00 36.82 39.11 1wok h ILE 994 CO 0.24 0.19 0.00 0.00 -1.05 0.00 0.00 178.15 177.53 1wok n ALA 995 N -2.37 2.01 -0.20 0.16 0.00 -1.26 -2.79 120.51 116.05 1wok n ALA 995 Ca -0.02 -0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.35 1wok n ALA 995 Cb 0.28 -1.30 0.23 0.00 0.00 0.00 0.00 19.45 18.67 1wok n ALA 995 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1wok n GLN 996 N -1.26 3.20 -3.65 0.00 7.27 -0.88 -4.18 117.38 117.87 1wok n GLN 996 Ca 0.09 -1.94 -0.17 0.00 0.07 0.00 0.00 57.00 55.06 1wok n GLN 996 Cb 0.14 -1.94 -0.15 0.00 2.41 0.00 0.00 30.24 30.69 1wok n GLN 996 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1wok s VAL 997 N -2.08 -0.28 -0.46 1.69 0.11 -1.12 -2.04 120.40 116.22 1wok s VAL 997 Ca 0.34 0.31 -0.04 0.00 -2.93 0.00 0.00 61.98 59.66 1wok s VAL 997 Cb 0.26 -0.34 0.12 0.00 -1.53 0.00 0.00 36.38 34.89 1wok s VAL 997 CO 0.09 0.12 0.27 0.21 -3.33 0.00 0.00 175.10 172.46 1wok s ASN 998 N 2.31 5.33 0.53 3.54 2.47 -0.83 -4.96 114.94 123.32 1wok s ASN 998 Ca 0.03 -2.15 -0.21 0.00 0.42 0.00 0.00 52.86 50.95 1wok s ASN 998 Cb -0.12 -1.86 -0.07 0.00 -1.45 0.00 0.00 41.25 37.74 1wok s ASN 998 CO -0.07 -0.54 0.95 0.18 -3.72 0.00 0.00 177.10 173.90 1wok n LEU 999 N 4.46 3.04 0.04 3.21 4.77 -1.26 -2.06 117.00 129.19 1wok n LEU 999 Ca -0.01 0.89 0.00 0.00 -0.03 0.00 0.00 56.01 56.85 1wok n LEU 999 Cb 0.41 -1.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1wok n LEU 999 CO 0.35 -1.80 -0.14 0.29 -1.33 0.00 0.00 177.39 174.76 1wok n LYS 1000N -0.47 0.00 -4.35 3.23 4.76 -0.55 -4.82 118.16 115.96 1wok n LYS 1000Ca 0.12 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.37 1wok n LYS 1000Cb 0.44 -0.20 -0.10 0.00 -1.84 0.00 0.00 35.03 33.33 1wok n LYS 1000CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1wok s TYR 1001N -2.00 1.68 -0.12 2.13 2.02 -0.94 -1.94 117.35 118.19 1wok s TYR 1001Ca 0.00 -0.68 -0.03 0.00 -0.37 0.00 0.00 57.07 55.99 1wok s TYR 1001Cb 0.00 -0.86 0.05 0.00 -0.40 0.00 0.00 41.96 40.74 1wok s TYR 1001CO 0.00 0.25 0.06 -1.17 -1.57 0.00 0.00 175.55 173.12 1wok s LEU 1002N -3.32 0.41 -0.04 -1.29 0.20 0.35 -2.47 118.68 112.52 1wok s LEU 1002Ca 0.24 -0.34 -0.04 0.00 0.69 0.00 0.00 54.13 54.69 1wok s LEU 1002Cb 0.02 -0.28 -0.04 0.00 -0.43 0.00 0.00 46.19 45.46 1wok s LEU 1002CO 0.07 -0.29 0.15 -0.76 -0.29 0.00 0.00 176.35 175.23 1wok s LEU 1003N 2.09 4.26 -0.28 -0.68 1.02 -0.87 -0.49 118.68 123.75 1wok s LEU 1003Ca 0.03 0.34 -0.03 0.00 0.02 0.00 0.00 54.13 54.49 1wok s LEU 1003Cb -0.14 -2.37 0.03 0.00 0.02 0.00 0.00 46.19 43.73 1wok s LEU 1003CO -0.06 0.31 -0.01 -0.75 0.02 0.00 0.00 176.35 175.85 1wok s LYS 1004N -1.60 2.72 0.05 1.70 2.20 -0.28 -2.85 119.74 121.68 1wok s LYS 1004Ca 0.22 -1.07 0.03 0.00 -0.36 0.00 0.00 55.97 54.79 1wok s LYS 1004Cb -0.12 -3.13 -0.03 0.00 -1.51 0.00 0.00 37.83 33.05 1wok s LYS 1004CO 0.13 -0.49 -0.09 -0.48 -0.36 0.00 0.00 175.35 174.06 1wok s LEU 1005N 1.33 2.27 -0.15 5.43 0.05 -0.77 -0.79 118.68 126.04 1wok s LEU 1005Ca -0.01 -0.57 -0.12 0.00 0.05 0.00 0.00 54.13 53.47 1wok s LEU 1005Cb -0.18 -0.22 -0.05 0.00 -2.05 0.00 0.00 46.19 43.69 1wok s LEU 1005CO -0.02 -0.19 0.24 -0.75 -0.55 0.00 0.00 176.35 175.09 1wok s LYS 1006N -1.67 4.10 0.49 1.48 2.20 -0.69 -1.45 119.74 124.20 1wok s LYS 1006Ca -0.08 0.02 -0.05 0.00 -0.36 0.00 0.00 55.97 55.50 1wok s LYS 1006Cb -0.10 -3.37 -0.03 0.00 -1.51 0.00 0.00 37.83 32.82 1wok s LYS 1006CO 0.01 0.37 0.80 -0.06 -0.36 0.00 0.00 175.35 176.10 1wok s PHE 1007N 0.11 3.54 -0.38 4.03 0.40 -0.27 -2.68 117.98 122.73 1wok s PHE 1007Ca 0.15 0.80 0.02 0.00 -0.60 0.00 0.00 56.93 57.30 1wok s PHE 1007Cb -0.13 -2.33 0.15 0.00 0.51 0.00 0.00 43.02 41.22 1wok s PHE 1007CO 0.03 -0.32 0.26 -0.80 0.70 0.00 0.00 175.22 175.10 1wok s ASN 1008N -4.12 2.37 0.56 1.36 -0.87 -1.15 -4.91 114.94 108.18 1wok s ASN 1008Ca 0.48 -2.54 -0.10 0.00 -1.57 0.00 0.00 52.86 49.14 1wok s ASN 1008Cb -0.10 -0.42 -0.04 0.00 -0.02 0.00 0.00 41.25 40.66 1wok s ASN 1008CO 0.45 -0.25 0.95 -0.36 -2.57 0.00 0.00 177.10 175.31 1wok s PHE 1009N 0.67 3.59 -0.36 2.20 0.40 -1.26 -2.39 117.98 120.83 1wok s PHE 1009Ca 0.24 1.16 0.14 0.00 -0.60 0.00 0.00 56.93 57.86 1wok s PHE 1009Cb -0.13 -2.59 0.37 0.00 0.51 0.00 0.00 43.02 41.19 1wok s PHE 1009CO -0.07 -0.52 1.29 1.63 0.70 0.00 0.00 175.22 178.24 1wok n LYS 1010N -2.46 2.66 0.00 0.44 4.01 -1.26 -5.01 118.16 116.54 1wok n LYS 1010Ca 0.04 -2.44 0.13 0.00 -0.51 0.00 0.00 58.31 55.53 1wok n LYS 1010Cb 0.54 -1.54 0.33 0.00 -0.51 0.00 0.00 35.03 33.85 1wok n LYS 1010CO 0.00 0.00 0.00 -2.37 -1.11 0.00 0.00 177.40 173.92