#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ovm n LEU 683 N 0.00 0.41 -4.83 1.69 7.94 -1.26 -5.07 117.00 115.88 2ovm n LEU 683 Ca 0.00 0.32 -0.36 0.00 -1.11 0.00 0.00 56.01 54.85 2ovm n LEU 683 Cb 0.00 0.06 -0.07 0.00 0.53 0.00 0.00 43.42 43.94 2ovm n LEU 683 CO 0.00 -0.76 -0.19 -0.63 -1.11 0.00 0.00 177.39 174.71 2ovm s ILE 684 N -2.00 5.37 0.49 1.96 1.01 -1.26 -5.04 121.20 121.74 2ovm s ILE 684 Ca 0.00 0.16 -0.24 0.00 0.00 0.00 0.00 60.65 60.57 2ovm s ILE 684 Cb 0.00 -3.35 -0.07 0.00 0.01 0.00 0.00 42.46 39.05 2ovm s ILE 684 CO 0.00 0.58 1.38 -2.84 0.00 0.00 0.00 174.94 174.06 2ovm s PRO 685 N -0.74 3.46 0.22 2.79 0.02 -1.26 -4.87 135.00 134.62 2ovm s PRO 685 Ca 0.13 2.29 -0.09 0.00 0.02 0.00 0.00 61.00 63.35 2ovm s PRO 685 Cb -0.12 -2.47 0.31 0.00 0.02 0.00 0.00 34.50 32.24 2ovm s PRO 685 CO 0.03 -0.96 1.74 -1.35 -0.33 0.00 0.00 177.00 176.13 2ovm h PRO 686 N 1.94 0.41 -0.29 5.54 0.11 -1.99 -1.81 132.00 135.91 2ovm h PRO 686 Ca -0.51 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.49 2ovm h PRO 686 Cb 1.28 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2ovm h PRO 686 CO 0.59 0.27 -0.21 1.25 -0.21 0.00 0.00 178.00 179.69 2ovm h LEU 687 N 0.42 0.53 -0.77 2.35 5.85 -1.99 -0.60 115.31 121.09 2ovm h LEU 687 Ca 0.33 -0.17 -0.13 0.00 0.84 0.00 0.00 57.88 58.75 2ovm h LEU 687 Cb 0.42 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 2ovm h LEU 687 CO -0.32 0.74 -0.50 0.40 -0.34 0.00 0.00 178.44 178.41 2ovm h ILE 688 N 0.47 1.34 -0.01 4.05 2.04 -1.81 -2.19 117.51 121.41 2ovm h ILE 688 Ca 0.07 -1.74 -0.15 0.00 1.00 0.00 0.00 64.86 64.04 2ovm h ILE 688 Cb 0.63 1.82 -0.02 0.00 -0.74 0.00 0.00 36.82 38.51 2ovm h ILE 688 CO 0.04 0.52 -0.71 -1.13 0.00 0.00 0.00 178.15 176.88 2ovm h ASN 689 N 0.22 0.06 0.03 1.72 -1.24 -0.83 -2.71 115.58 112.83 2ovm h ASN 689 Ca 0.01 -0.04 -0.14 0.00 0.71 0.00 0.00 56.30 56.84 2ovm h ASN 689 Cb 0.96 -0.02 -0.01 0.00 0.73 0.00 0.00 38.32 39.99 2ovm h ASN 689 CO 0.08 0.75 -0.46 0.25 -1.29 0.00 0.00 177.43 176.75 2ovm h LEU 690 N 0.03 0.55 -0.64 0.34 6.46 -0.88 -2.28 115.31 118.90 2ovm h LEU 690 Ca -0.01 -0.26 -0.03 0.00 -0.12 0.00 0.00 57.88 57.45 2ovm h LEU 690 Cb 1.25 -0.16 -0.03 0.00 -0.73 0.00 0.00 40.66 41.00 2ovm h LEU 690 CO 0.10 0.93 0.27 -0.07 -0.62 0.00 0.00 178.44 179.05 2ovm h LEU 691 N 0.41 0.87 -0.78 2.25 3.38 -1.29 -1.21 115.31 118.94 2ovm h LEU 691 Ca 0.02 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 2ovm h LEU 691 Cb 0.97 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.48 2ovm h LEU 691 CO 0.09 0.79 -0.04 -0.03 0.09 0.00 0.00 178.44 179.34 2ovm h MET 692 N 0.89 0.89 0.00 1.13 4.05 -1.38 -2.53 114.93 117.99 2ovm h MET 692 Ca 0.21 -0.27 -0.09 0.00 -0.28 0.00 0.00 59.70 59.27 2ovm h MET 692 Cb 0.18 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 2ovm h MET 692 CO -0.02 0.91 -0.43 0.66 0.23 0.00 0.00 176.91 178.26 2ovm h SER 693 N 0.81 0.00 -0.35 1.39 4.64 -0.98 -2.84 113.55 116.22 2ovm h SER 693 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2ovm h SER 693 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 2ovm h SER 693 CO 0.03 0.43 0.00 2.30 -0.87 0.00 0.00 176.83 178.72 2ovm n ILE 694 N -3.54 0.46 -1.99 0.95 -5.35 -0.50 -4.88 119.36 104.51 2ovm n ILE 694 Ca -0.00 -0.59 -0.42 0.00 -0.27 0.00 0.00 62.75 61.46 2ovm n ILE 694 Cb 0.55 0.57 -0.03 0.00 -1.74 0.00 0.00 39.64 39.00 2ovm n ILE 694 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2ovm s GLU 695 N -1.54 4.19 0.75 6.28 2.56 -0.97 -4.79 118.70 125.18 2ovm s GLU 695 Ca 0.35 2.23 -0.15 0.00 0.00 0.00 0.00 54.97 57.40 2ovm s GLU 695 Cb 0.19 -3.85 0.01 0.00 2.00 0.00 0.00 34.13 32.49 2ovm s GLU 695 CO 0.27 -0.79 0.89 -0.35 -0.56 0.00 0.00 175.26 174.72 2ovm n PRO 696 N 6.55 0.37 -1.25 4.30 -0.04 -1.26 -4.99 135.00 138.69 2ovm n PRO 696 Ca 0.17 0.18 -0.29 0.00 -0.04 0.00 0.00 63.50 63.52 2ovm n PRO 696 Cb 0.42 -2.16 0.17 0.00 -0.04 0.00 0.00 33.50 31.89 2ovm n PRO 696 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2ovm s ASP 697 N -1.70 2.78 0.30 3.54 1.01 -1.26 -4.95 116.67 116.40 2ovm s ASP 697 Ca 0.71 1.12 -0.30 0.00 0.71 0.00 0.00 52.55 54.79 2ovm s ASP 697 Cb -0.33 -1.77 -0.12 0.00 1.01 0.00 0.00 42.92 41.71 2ovm s ASP 697 CO 0.53 -3.02 1.54 0.52 0.21 0.00 0.00 175.17 174.95 2ovm n VAL 698 N -4.10 1.22 -4.58 -1.27 0.31 -1.26 -4.99 118.33 103.66 2ovm n VAL 698 Ca 0.05 -0.31 -0.33 0.00 -0.01 0.00 0.00 64.34 63.75 2ovm n VAL 698 Cb 0.58 -1.89 -0.15 0.00 -0.91 0.00 0.00 33.84 31.46 2ovm n VAL 698 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ovm s ILE 699 N -0.25 2.80 0.22 2.52 1.01 -1.26 -5.11 121.20 121.12 2ovm s ILE 699 Ca 0.62 -0.73 -0.06 0.00 0.00 0.00 0.00 60.65 60.48 2ovm s ILE 699 Cb -0.51 -2.18 -0.06 0.00 0.01 0.00 0.00 42.46 39.72 2ovm s ILE 699 CO 0.52 0.51 0.49 -0.31 0.00 0.00 0.00 174.94 176.15 2ovm s TYR 700 N 0.71 3.46 -0.19 3.97 2.02 -1.26 -4.50 117.35 121.56 2ovm s TYR 700 Ca -0.07 0.68 0.19 0.00 -0.37 0.00 0.00 57.07 57.50 2ovm s TYR 700 Cb -0.15 -2.11 -0.04 0.00 -0.40 0.00 0.00 41.96 39.25 2ovm s TYR 700 CO 0.02 0.30 1.00 0.00 -1.57 0.00 0.00 175.55 175.30 2ovm h ALA 701 N 2.37 0.61 -1.00 3.71 0.00 -1.91 -3.44 119.26 119.59 2ovm h ALA 701 Ca -0.47 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 53.92 2ovm h ALA 701 Cb 1.17 0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2ovm h ALA 701 CO 0.69 0.47 -0.14 0.41 0.00 0.00 0.00 179.25 180.68 2ovm n GLY 702 N 1.28 0.22 3.82 0.00 0.00 -1.26 -4.52 105.19 104.73 2ovm n GLY 702 Ca -0.04 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 2ovm n GLY 702 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2ovm s HIS 703 N -2.40 3.75 -0.52 1.61 5.65 -1.26 -5.05 115.29 117.07 2ovm s HIS 703 Ca 0.02 1.16 -0.17 0.00 0.25 0.00 0.00 55.06 56.33 2ovm s HIS 703 Cb -0.01 -2.42 0.09 0.00 -1.18 0.00 0.00 32.58 29.06 2ovm s HIS 703 CO 0.03 0.57 0.53 0.34 -0.65 0.00 0.00 174.74 175.56 2ovm s ASP 704 N -1.24 6.18 0.00 9.88 2.15 -1.26 -4.93 116.67 127.45 2ovm s ASP 704 Ca 0.30 -1.37 0.10 0.00 0.43 0.00 0.00 52.55 52.01 2ovm s ASP 704 Cb -0.18 -2.24 0.52 0.00 -0.30 0.00 0.00 42.92 40.73 2ovm s ASP 704 CO 0.18 -0.84 1.35 0.59 -0.17 0.00 0.00 175.17 176.28 2ovm n ASN 705 N 5.65 0.36 -0.44 -0.34 3.02 -1.26 -3.26 115.26 118.99 2ovm n ASN 705 Ca -0.11 -1.75 0.13 0.00 -0.03 0.00 0.00 54.58 52.81 2ovm n ASN 705 Cb 0.43 -0.04 0.28 0.00 -0.61 0.00 0.00 39.78 39.85 2ovm n ASN 705 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2ovm n THR 706 N -0.42 0.00 -4.58 3.41 -2.24 -1.26 -4.87 114.28 104.33 2ovm n THR 706 Ca 0.08 -0.23 -0.31 0.00 -2.27 0.00 0.00 64.05 61.32 2ovm n THR 706 Cb 0.09 0.76 -0.12 0.00 -2.10 0.00 0.00 70.33 68.96 2ovm n THR 706 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2ovm s LYS 707 N -2.33 2.32 0.32 -0.78 1.02 -1.20 -5.09 119.74 113.99 2ovm s LYS 707 Ca 0.26 -0.85 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 2ovm s LYS 707 Cb 0.19 -2.34 -0.12 0.00 -0.52 0.00 0.00 37.83 35.04 2ovm s LYS 707 CO 0.47 0.57 1.43 -2.30 -0.92 0.00 0.00 175.35 174.60 2ovm n PRO 708 N 1.58 2.38 -1.55 -1.68 -0.02 -1.26 -4.93 135.00 129.51 2ovm n PRO 708 Ca -0.16 0.84 -0.34 0.00 -2.02 0.00 0.00 63.50 61.82 2ovm n PRO 708 Cb 0.52 -2.52 0.08 0.00 -0.02 0.00 0.00 33.50 31.56 2ovm n PRO 708 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ovm s ASP 709 N 0.02 4.55 0.02 2.55 -0.00 -1.26 -5.05 116.67 117.50 2ovm s ASP 709 Ca 0.59 2.20 -0.05 0.00 -0.00 0.00 0.00 52.55 55.29 2ovm s ASP 709 Cb -0.54 -2.57 -0.01 0.00 -0.00 0.00 0.00 42.92 39.80 2ovm s ASP 709 CO 0.57 -2.02 0.09 0.42 -0.00 0.00 0.00 175.17 174.24 2ovm s THR 710 N -2.15 0.10 0.24 -1.27 -4.23 -1.26 -5.05 115.64 102.02 2ovm s THR 710 Ca 0.71 -0.84 -0.05 0.00 -1.18 0.00 0.00 61.69 60.32 2ovm s THR 710 Cb -0.25 -0.53 0.21 0.00 1.34 0.00 0.00 72.50 73.27 2ovm s THR 710 CO 0.44 -0.46 1.71 -1.28 -0.54 0.00 0.00 174.62 174.49 2ovm h SER 711 N 4.17 0.15 -0.24 3.99 0.87 -1.97 -2.58 113.55 117.95 2ovm h SER 711 Ca -0.31 0.12 -0.19 0.00 -1.23 0.00 0.00 61.79 60.17 2ovm h SER 711 Cb 1.19 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 2ovm h SER 711 CO 0.43 0.04 -0.59 0.77 -0.53 0.00 0.00 176.83 176.95 2ovm h SER 712 N 0.36 0.96 0.31 6.23 4.64 -1.98 -2.55 113.55 121.51 2ovm h SER 712 Ca 0.40 -0.53 -0.03 0.00 -0.47 0.00 0.00 61.79 61.15 2ovm h SER 712 Cb 0.63 -0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.44 2ovm h SER 712 CO -0.44 1.33 -0.17 0.77 -0.87 0.00 0.00 176.83 177.46 2ovm h SER 713 N 0.64 0.00 0.33 4.97 4.64 -1.88 0.72 113.55 122.97 2ovm h SER 713 Ca 0.00 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.00 2ovm h SER 713 Cb 1.20 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 63.32 2ovm h SER 713 CO 0.13 0.17 -1.43 -0.07 -0.87 0.00 0.00 176.83 174.75 2ovm h LEU 714 N 0.00 0.77 -0.52 5.97 3.38 -1.46 -2.36 115.31 121.09 2ovm h LEU 714 Ca -0.00 -0.82 -0.15 0.00 0.09 0.00 0.00 57.88 56.99 2ovm h LEU 714 Cb 0.37 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2ovm h LEU 714 CO 0.02 1.64 -0.48 -0.07 0.09 0.00 0.00 178.44 179.65 2ovm h LEU 715 N 0.14 0.72 -0.76 1.67 3.38 -0.97 -0.85 115.31 118.62 2ovm h LEU 715 Ca -0.23 -0.35 -0.08 0.00 0.09 0.00 0.00 57.88 57.30 2ovm h LEU 715 Cb 2.13 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 42.65 2ovm h LEU 715 CO 0.26 1.08 0.03 0.74 0.09 0.00 0.00 178.44 180.64 2ovm h THR 716 N 0.52 1.26 -0.14 0.22 2.02 0.39 -2.31 112.91 114.86 2ovm h THR 716 Ca 0.03 -1.06 -0.19 0.00 0.77 0.00 0.00 66.41 65.95 2ovm h THR 716 Cb 1.02 0.77 0.00 0.00 -1.74 0.00 0.00 68.15 68.21 2ovm h THR 716 CO 0.10 0.39 -0.70 0.28 0.37 0.00 0.00 175.52 175.96 2ovm h SER 717 N 0.91 0.71 -0.48 4.18 0.02 -1.25 -2.50 113.55 115.15 2ovm h SER 717 Ca 0.17 -0.44 -0.05 0.00 -0.84 0.00 0.00 61.79 60.63 2ovm h SER 717 Cb 0.48 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 2ovm h SER 717 CO 0.02 1.20 0.11 -0.07 -1.14 0.00 0.00 176.83 176.96 2ovm h LEU 718 N 0.43 0.77 -0.58 5.07 3.38 -0.99 -0.69 115.31 122.71 2ovm h LEU 718 Ca -0.03 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.65 2ovm h LEU 718 Cb 1.29 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.83 2ovm h LEU 718 CO 0.13 0.77 -0.57 0.78 0.09 0.00 0.00 178.44 179.65 2ovm h ASN 719 N 0.79 0.49 -0.15 -0.43 2.35 -1.40 0.53 115.58 117.77 2ovm h ASN 719 Ca 0.17 -0.27 -0.06 0.00 -0.55 0.00 0.00 56.30 55.60 2ovm h ASN 719 Cb 0.31 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.54 2ovm h ASN 719 CO 0.00 0.95 -0.14 -0.61 -1.65 0.00 0.00 177.43 175.99 2ovm h GLN 720 N 0.33 0.36 -0.47 0.81 4.15 -1.13 -1.72 115.11 117.45 2ovm h GLN 720 Ca 0.00 -0.18 -0.10 0.00 0.77 0.00 0.00 58.65 59.13 2ovm h GLN 720 Cb 1.09 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.77 2ovm h GLN 720 CO 0.10 0.73 -0.13 1.25 -1.93 0.00 0.00 178.83 178.85 2ovm h LEU 721 N -0.00 0.86 -0.57 -2.39 5.85 -1.09 -2.50 115.31 115.47 2ovm h LEU 721 Ca 0.03 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.47 2ovm h LEU 721 Cb 0.66 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 2ovm h LEU 721 CO 0.03 1.00 0.36 1.23 -0.34 0.00 0.00 178.44 180.73 2ovm h GLY 722 N 0.96 0.81 1.13 3.75 0.00 0.18 -1.10 103.07 108.80 2ovm h GLY 722 Ca 0.12 -0.32 -0.11 0.00 0.00 0.00 0.00 47.33 47.03 2ovm h GLY 722 CO 0.04 0.31 -0.09 -2.09 0.00 0.00 0.00 176.54 174.72 2ovm h GLU 723 N 0.77 1.02 -0.11 4.80 4.81 -1.17 -2.55 114.58 122.15 2ovm h GLU 723 Ca 0.21 -0.36 -0.00 0.00 -0.13 0.00 0.00 59.36 59.07 2ovm h GLU 723 Cb -0.06 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 2ovm h GLU 723 CO -0.04 1.05 0.06 0.00 -0.73 0.00 0.00 179.01 179.35 2ovm h ARG 724 N 0.91 0.16 -0.07 1.92 3.08 -1.16 -2.45 114.38 116.77 2ovm h ARG 724 Ca 0.15 -0.02 0.02 0.00 0.07 0.00 0.00 59.98 60.20 2ovm h ARG 724 Cb 0.65 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.66 2ovm h ARG 724 CO 0.04 0.20 0.06 1.96 -1.07 0.00 0.00 179.97 181.17 2ovm h GLN 725 N 0.08 0.00 -0.13 0.04 4.20 -1.09 -1.67 115.11 116.53 2ovm h GLN 725 Ca 0.04 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 2ovm h GLN 725 Cb 0.09 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.87 2ovm h GLN 725 CO -0.01 0.00 -0.09 1.25 -0.67 0.00 0.00 178.83 179.31 2ovm h LEU 726 N 0.00 0.31 -1.58 1.46 5.85 -1.02 0.38 115.31 120.71 2ovm h LEU 726 Ca 0.03 -0.45 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2ovm h LEU 726 Cb 0.15 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2ovm h LEU 726 CO -0.00 0.69 0.31 -0.07 -0.34 0.00 0.00 178.44 179.03 2ovm h LEU 727 N -0.07 0.48 -0.73 2.25 3.38 -1.07 -0.41 115.31 119.15 2ovm h LEU 727 Ca 0.03 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 2ovm h LEU 727 Cb 0.59 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 2ovm h LEU 727 CO 0.02 0.34 -0.13 -1.28 0.09 0.00 0.00 178.44 177.48 2ovm h SER 728 N 0.56 0.84 -0.07 -0.43 0.87 -0.89 -1.61 113.55 112.81 2ovm h SER 728 Ca 0.18 -0.27 -0.03 0.00 -1.23 0.00 0.00 61.79 60.44 2ovm h SER 728 Cb 0.04 -0.23 -0.00 0.00 -0.44 0.00 0.00 62.40 61.77 2ovm h SER 728 CO -0.04 0.98 -0.09 0.58 -0.53 0.00 0.00 176.83 177.73 2ovm h VAL 729 N 0.75 1.38 -0.79 2.23 2.07 0.34 -0.03 116.25 122.20 2ovm h VAL 729 Ca 0.12 -1.28 0.07 0.00 0.82 0.00 0.00 66.70 66.43 2ovm h VAL 729 Cb 0.64 2.06 -0.06 0.00 -1.52 0.00 0.00 31.29 32.41 2ovm h VAL 729 CO 0.04 0.36 0.47 0.58 0.02 0.00 0.00 177.57 179.04 2ovm h VAL 730 N -0.25 0.99 -0.10 2.57 2.07 -1.09 -0.25 116.25 120.19 2ovm h VAL 730 Ca 0.01 -0.29 -0.03 0.00 0.82 0.00 0.00 66.70 67.21 2ovm h VAL 730 Cb 0.62 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2ovm h VAL 730 CO 0.02 0.15 -0.06 0.50 0.02 0.00 0.00 177.57 178.20 2ovm h LYS 731 N 0.85 0.22 -0.64 1.57 3.64 -1.24 -2.92 116.57 118.05 2ovm h LYS 731 Ca 0.36 -0.10 0.12 0.00 -1.27 0.00 0.00 60.65 59.76 2ovm h LYS 731 Cb 0.22 -0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 31.95 2ovm h LYS 731 CO -0.19 0.59 0.18 2.35 -2.27 0.00 0.00 179.45 180.10 2ovm h TRP 732 N -0.15 0.29 -0.38 1.91 7.01 -0.61 -1.19 115.95 122.83 2ovm h TRP 732 Ca 0.02 0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.09 2ovm h TRP 732 Cb 0.53 -0.03 -0.02 0.00 -2.10 0.00 0.00 29.16 27.54 2ovm h TRP 732 CO 0.07 -0.00 0.25 0.66 -2.79 0.00 0.00 178.44 176.63 2ovm h SER 733 N 0.31 0.31 0.25 2.65 4.64 -0.93 -1.57 113.55 119.21 2ovm h SER 733 Ca 0.34 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.66 2ovm h SER 733 Cb 0.51 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2ovm h SER 733 CO -0.40 0.21 0.00 0.29 -0.87 0.00 0.00 176.83 176.06 2ovm n LYS 734 N -4.48 0.05 -0.06 4.77 5.02 -0.45 -1.43 118.16 121.58 2ovm n LYS 734 Ca 0.04 0.29 0.02 0.00 -2.02 0.00 0.00 58.31 56.64 2ovm n LYS 734 Cb 0.18 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.75 2ovm n LYS 734 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2ovm n SER 735 N -1.41 2.19 -4.61 4.39 7.64 -0.60 -4.85 113.62 116.37 2ovm n SER 735 Ca 0.03 -1.82 -0.43 0.00 1.01 0.00 0.00 58.87 57.66 2ovm n SER 735 Cb 0.09 -0.08 -0.04 0.00 -1.01 0.00 0.00 64.21 63.18 2ovm n SER 735 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2ovm s LEU 736 N -0.87 4.00 -0.15 -3.43 2.96 -0.51 -4.97 118.68 115.70 2ovm s LEU 736 Ca 0.09 0.72 -0.38 0.00 -0.22 0.00 0.00 54.13 54.34 2ovm s LEU 736 Cb 0.05 -3.29 -0.15 0.00 0.50 0.00 0.00 46.19 43.30 2ovm s LEU 736 CO 0.07 -0.81 1.69 -2.65 -1.32 0.00 0.00 176.35 173.33 2ovm n PRO 737 N 6.68 1.42 0.00 0.98 -0.02 -1.26 -1.21 135.00 141.59 2ovm n PRO 737 Ca 0.08 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.08 2ovm n PRO 737 Cb 0.48 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2ovm n PRO 737 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ovm n GLY 738 N 3.88 3.08 0.16 -1.23 0.00 -1.26 -4.95 105.19 104.87 2ovm n GLY 738 Ca 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 2ovm n GLY 738 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2ovm h PHE 739 N 0.00 -0.30 0.00 1.61 3.57 -1.44 -3.10 116.94 117.28 2ovm h PHE 739 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 2ovm h PHE 739 Cb 0.00 0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.84 2ovm h PHE 739 CO 0.00 -0.09 -0.05 0.00 -2.23 0.00 0.00 178.31 175.94 2ovm h ARG 740 N -0.45 0.00 0.00 1.11 2.47 -1.82 -1.42 114.38 114.28 2ovm h ARG 740 Ca -0.03 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.69 2ovm h ARG 740 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 2ovm h ARG 740 CO 0.05 0.05 0.00 -1.71 0.56 0.00 0.00 179.97 178.93 2ovm n ASN 741 N -3.64 0.66 -4.82 7.04 5.15 -1.17 -4.75 115.26 113.74 2ovm n ASN 741 Ca -0.02 0.63 -0.33 0.00 -0.60 0.00 0.00 54.58 54.26 2ovm n ASN 741 Cb 0.15 -0.78 -0.04 0.00 -0.53 0.00 0.00 39.78 38.58 2ovm n ASN 741 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2ovm s LEU 742 N -4.40 3.75 0.37 1.20 1.43 -0.54 -4.98 118.68 115.52 2ovm s LEU 742 Ca 0.06 1.74 -0.26 0.00 -1.03 0.00 0.00 54.13 54.64 2ovm s LEU 742 Cb 0.10 -4.53 -0.12 0.00 0.03 0.00 0.00 46.19 41.67 2ovm s LEU 742 CO 0.44 -0.67 1.11 1.57 0.23 0.00 0.00 176.35 179.03 2ovm n HIS 743 N -1.23 1.58 -0.29 0.29 -0.00 -1.26 -4.75 115.22 109.57 2ovm n HIS 743 Ca 0.08 0.58 0.12 0.00 -0.00 0.00 0.00 57.72 58.50 2ovm n HIS 743 Cb 0.53 -2.30 0.37 0.00 -0.00 0.00 0.00 29.99 28.60 2ovm n HIS 743 CO 0.00 0.00 0.00 0.97 -0.00 0.00 0.00 176.34 177.31 2ovm h ILE 744 N 1.96 0.82 -0.17 3.57 6.09 -1.93 0.70 117.51 128.54 2ovm h ILE 744 Ca -0.44 -0.24 -0.06 0.00 -1.37 0.00 0.00 64.86 62.75 2ovm h ILE 744 Cb 1.32 0.05 -0.01 0.00 0.47 0.00 0.00 36.82 38.64 2ovm h ILE 744 CO 0.59 0.13 -0.16 0.44 -3.07 0.00 0.00 178.15 176.08 2ovm h ASP 745 N 0.71 0.27 -0.07 2.19 5.19 -2.00 -2.19 116.42 120.52 2ovm h ASP 745 Ca 0.47 -0.07 -0.18 0.00 -0.62 0.00 0.00 57.03 56.63 2ovm h ASP 745 Cb 0.75 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.19 2ovm h ASP 745 CO -0.23 0.46 -0.60 0.44 -3.12 0.00 0.00 179.24 176.20 2ovm h ASP 746 N 0.27 0.76 -0.22 6.45 3.32 -1.22 -1.52 116.42 124.26 2ovm h ASP 746 Ca 0.05 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 56.67 2ovm h ASP 746 Cb 0.45 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2ovm h ASP 746 CO 0.03 1.18 0.13 1.56 -1.72 0.00 0.00 179.24 180.42 2ovm h GLN 747 N 0.51 0.31 -0.19 3.56 4.20 -1.01 0.16 115.11 122.64 2ovm h GLN 747 Ca -0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2ovm h GLN 747 Cb 1.17 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.88 2ovm h GLN 747 CO 0.12 0.26 0.12 0.82 -0.67 0.00 0.00 178.83 179.48 2ovm h ILE 748 N 0.27 1.06 -0.65 2.54 2.04 -1.37 -1.86 117.51 119.54 2ovm h ILE 748 Ca 0.08 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.84 2ovm h ILE 748 Cb 0.04 0.81 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 2ovm h ILE 748 CO -0.01 0.06 0.39 0.74 0.00 0.00 0.00 178.15 179.33 2ovm h THR 749 N 0.24 1.05 -0.59 -0.27 2.02 -0.92 -0.06 112.91 114.39 2ovm h THR 749 Ca 0.07 -0.26 -0.10 0.00 0.77 0.00 0.00 66.41 66.89 2ovm h THR 749 Cb -0.01 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 2ovm h THR 749 CO -0.01 0.14 -0.01 -0.07 0.37 0.00 0.00 175.52 175.94 2ovm h LEU 750 N 0.76 1.02 -0.47 2.58 3.38 -0.49 -0.08 115.31 122.01 2ovm h LEU 750 Ca 0.27 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 2ovm h LEU 750 Cb 0.06 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 2ovm h LEU 750 CO -0.12 1.07 0.10 0.40 0.09 0.00 0.00 178.44 179.98 2ovm h ILE 751 N 0.95 1.24 -0.70 1.22 1.08 -1.05 -2.76 117.51 117.50 2ovm h ILE 751 Ca 0.17 -0.87 0.01 0.00 -0.39 0.00 0.00 64.86 63.78 2ovm h ILE 751 Cb 0.56 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 35.18 2ovm h ILE 751 CO 0.03 0.31 0.46 1.56 -0.69 0.00 0.00 178.15 179.82 2ovm h GLN 752 N 0.64 0.91 0.00 2.37 4.20 -0.68 -1.91 115.11 120.64 2ovm h GLN 752 Ca 0.14 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.80 2ovm h GLN 752 Cb 0.35 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2ovm h GLN 752 CO 0.00 0.60 0.00 1.88 -0.67 0.00 0.00 178.83 180.65 2ovm h TYR 753 N 0.94 0.00 0.00 2.96 -1.99 -0.92 -3.37 116.97 114.60 2ovm h TYR 753 Ca 0.26 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.99 2ovm h TYR 753 Cb -0.10 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.63 2ovm h TYR 753 CO -0.03 0.00 0.00 -1.13 -0.00 0.00 0.00 178.16 177.00 2ovm n SER 754 N -2.41 0.20 0.05 3.88 3.41 -1.05 -4.82 113.62 112.89 2ovm n SER 754 Ca 0.03 -1.07 -0.00 0.00 -0.26 0.00 0.00 58.87 57.57 2ovm n SER 754 Cb 0.34 0.00 0.29 0.00 -0.26 0.00 0.00 64.21 64.58 2ovm n SER 754 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2ovm h TRP 755 N 0.00 0.41 -0.31 7.33 5.08 -1.52 -0.45 115.95 126.50 2ovm h TRP 755 Ca 0.00 -0.06 -0.05 0.00 1.08 0.00 0.00 58.89 59.86 2ovm h TRP 755 Cb 0.72 -0.11 -0.01 0.00 -3.00 0.00 0.00 29.16 26.76 2ovm h TRP 755 CO 0.00 0.53 0.00 1.98 -1.28 0.00 0.00 178.44 179.67 2ovm h MET 756 N 0.36 0.55 -0.40 0.12 4.05 -1.87 -0.69 114.93 117.05 2ovm h MET 756 Ca 0.07 -0.17 -0.13 0.00 -0.28 0.00 0.00 59.70 59.18 2ovm h MET 756 Cb 0.49 -0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 2ovm h MET 756 CO 0.03 0.69 -0.27 0.66 0.23 0.00 0.00 176.91 178.25 2ovm h SER 757 N 0.35 0.87 -0.14 1.39 4.64 -1.84 -0.77 113.55 118.05 2ovm h SER 757 Ca 0.09 -0.34 -0.00 0.00 -0.47 0.00 0.00 61.79 61.07 2ovm h SER 757 Cb 0.43 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 2ovm h SER 757 CO 0.02 1.09 0.09 -0.07 -0.87 0.00 0.00 176.83 177.08 2ovm h LEU 758 N 0.72 0.17 -0.27 5.97 3.38 -0.92 -0.48 115.31 123.89 2ovm h LEU 758 Ca 0.09 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2ovm h LEU 758 Cb 0.81 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2ovm h LEU 758 CO 0.07 0.17 0.07 0.24 0.09 0.00 0.00 178.44 179.08 2ovm h MET 759 N 0.16 0.44 0.00 1.13 2.86 -1.01 -0.89 114.93 117.62 2ovm h MET 759 Ca 0.05 -0.11 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 2ovm h MET 759 Cb 0.03 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 2ovm h MET 759 CO -0.01 0.53 -0.19 -0.24 1.06 0.00 0.00 176.91 178.06 2ovm h VAL 760 N 0.27 0.70 -0.16 -2.22 3.04 -1.07 -0.22 116.25 116.60 2ovm h VAL 760 Ca 0.09 -0.81 -0.22 0.00 -1.01 0.00 0.00 66.70 64.75 2ovm h VAL 760 Cb 0.29 1.50 0.01 0.00 -2.01 0.00 0.00 31.29 31.08 2ovm h VAL 760 CO 0.00 0.19 -0.77 0.15 -1.01 0.00 0.00 177.57 176.13 2ovm h PHE 761 N 0.00 1.09 -0.25 3.17 3.57 -0.65 -2.12 116.94 121.75 2ovm h PHE 761 Ca -0.00 -0.48 -0.13 0.00 3.53 0.00 0.00 57.97 60.89 2ovm h PHE 761 Cb 0.49 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 2ovm h PHE 761 CO 0.00 1.31 -0.38 0.78 -2.23 0.00 0.00 178.31 177.79 2ovm h GLY 762 N 0.56 0.63 0.84 2.40 0.00 -0.60 -1.57 103.07 105.32 2ovm h GLY 762 Ca -0.05 -0.61 0.02 0.00 0.00 0.00 0.00 47.33 46.69 2ovm h GLY 762 CO 0.16 0.56 0.08 -2.00 0.00 0.00 0.00 176.54 175.33 2ovm h LEU 763 N 0.48 0.09 -0.56 3.11 5.85 -0.99 -0.54 115.31 122.76 2ovm h LEU 763 Ca 0.05 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.80 2ovm h LEU 763 Cb 0.88 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 2ovm h LEU 763 CO 0.08 0.08 0.35 1.23 -0.34 0.00 0.00 178.44 179.84 2ovm h GLY 764 N 0.18 0.79 0.99 3.75 0.00 -1.04 -0.81 103.07 106.92 2ovm h GLY 764 Ca 0.09 -0.27 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2ovm h GLY 764 CO -0.09 0.25 0.28 -0.25 0.00 0.00 0.00 176.54 176.73 2ovm h TRP 765 N 0.71 0.60 -0.49 5.60 2.91 -0.80 0.16 115.95 124.63 2ovm h TRP 765 Ca 0.21 0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.13 2ovm h TRP 765 Cb -0.03 -0.20 -0.02 0.00 -0.51 0.00 0.00 29.16 28.40 2ovm h TRP 765 CO -0.05 0.41 -0.13 0.00 -1.03 0.00 0.00 178.44 177.64 2ovm h ARG 766 N 0.61 0.92 -0.66 2.65 3.08 -0.84 -1.57 114.38 118.58 2ovm h ARG 766 Ca 0.17 -0.34 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 2ovm h ARG 766 Cb -0.02 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 2ovm h ARG 766 CO -0.03 0.99 0.22 0.77 -1.07 0.00 0.00 179.97 180.85 2ovm h SER 767 N 0.82 0.95 -0.47 7.04 0.02 -0.79 -0.23 113.55 120.89 2ovm h SER 767 Ca 0.13 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 2ovm h SER 767 Cb 0.67 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.95 2ovm h SER 767 CO 0.05 0.89 0.01 0.22 -1.14 0.00 0.00 176.83 176.85 2ovm h TYR 768 N 0.95 0.89 0.04 3.45 3.20 -0.47 0.92 116.97 125.95 2ovm h TYR 768 Ca 0.21 -0.15 -0.32 0.00 3.14 0.00 0.00 58.73 61.61 2ovm h TYR 768 Cb 0.27 -0.23 -0.04 0.00 1.54 0.00 0.00 36.73 38.27 2ovm h TYR 768 CO 0.02 0.85 -1.82 0.36 -1.64 0.00 0.00 178.16 175.93 2ovm n LYS 769 N -4.37 0.68 0.03 1.82 2.85 -0.61 -2.85 118.16 115.71 2ovm n LYS 769 Ca 0.00 0.28 -0.10 0.00 -1.05 0.00 0.00 58.31 57.45 2ovm n LYS 769 Cb 0.30 -1.76 -0.13 0.00 -0.65 0.00 0.00 35.03 32.79 2ovm n LYS 769 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2ovm h HIS 770 N 0.03 0.10 -0.02 5.58 3.86 -1.17 -3.39 115.15 120.13 2ovm h HIS 770 Ca -0.34 -0.07 -0.14 0.00 -1.16 0.00 0.00 60.37 58.66 2ovm h HIS 770 Cb 2.02 -0.00 -0.29 0.00 1.06 0.00 0.00 27.41 30.20 2ovm h HIS 770 CO 0.03 1.08 -0.91 1.33 0.86 0.00 0.00 177.93 180.33 2ovm n VAL 771 N -3.27 0.61 -3.21 2.45 0.24 -1.03 -5.00 118.33 109.12 2ovm n VAL 771 Ca -0.09 -1.65 -0.22 0.00 -2.04 0.00 0.00 64.34 60.34 2ovm n VAL 771 Cb 1.00 0.68 0.00 0.00 -1.47 0.00 0.00 33.84 34.05 2ovm n VAL 771 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2ovm n SER 772 N 0.05 -4.23 -1.56 -1.34 7.64 -1.11 -1.14 113.62 111.94 2ovm n SER 772 Ca 0.10 -0.32 -0.20 0.00 1.01 0.00 0.00 58.87 59.46 2ovm n SER 772 Cb 1.02 -3.49 -0.09 0.00 -1.01 0.00 0.00 64.21 60.65 2ovm n SER 772 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ovm n GLY 773 N -1.22 1.93 0.10 0.23 0.00 0.32 -4.83 105.19 101.72 2ovm n GLY 773 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.09 2ovm n GLY 773 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2ovm h GLN 774 N 0.00 0.00 -4.13 1.61 4.20 -1.31 -3.42 115.11 112.06 2ovm h GLN 774 Ca -0.41 0.00 -0.14 0.00 0.06 0.00 0.00 58.65 58.15 2ovm h GLN 774 Cb 1.35 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 29.00 2ovm h GLN 774 CO 0.61 0.00 -0.44 -1.64 -0.67 0.00 0.00 178.83 176.69 2ovm s MET 775 N -3.26 1.15 -0.42 1.46 -1.94 -1.26 -4.60 119.30 110.44 2ovm s MET 775 Ca 0.03 -1.34 -0.21 0.00 -1.71 0.00 0.00 55.69 52.47 2ovm s MET 775 Cb 0.11 0.33 0.02 0.00 2.01 0.00 0.00 34.83 37.30 2ovm s MET 775 CO 0.75 -0.40 0.65 -0.51 -0.01 0.00 0.00 175.02 175.50 2ovm s LEU 776 N -3.03 4.41 -1.15 -0.03 1.43 -0.57 -4.63 118.68 115.10 2ovm s LEU 776 Ca 0.24 -0.18 -0.08 0.00 -1.03 0.00 0.00 54.13 53.08 2ovm s LEU 776 Cb 0.05 -2.77 0.25 0.00 0.03 0.00 0.00 46.19 43.75 2ovm s LEU 776 CO 0.04 -0.74 1.49 0.00 0.23 0.00 0.00 176.35 177.36 2ovm n TYR 777 N 6.25 3.45 0.05 0.29 4.19 -1.26 -1.27 117.16 128.85 2ovm n TYR 777 Ca -0.01 -3.03 -0.12 0.00 3.31 0.00 0.00 57.90 58.05 2ovm n TYR 777 Cb 0.48 -1.64 -0.06 0.00 0.49 0.00 0.00 39.34 38.61 2ovm n TYR 777 CO 0.00 0.00 0.00 0.74 0.91 0.00 0.00 176.86 178.51 2ovm h PHE 778 N 5.99 -0.08 -3.33 2.98 -1.00 -1.78 -3.41 116.94 116.31 2ovm h PHE 778 Ca 0.25 0.00 -0.04 0.00 2.81 0.00 0.00 57.97 61.00 2ovm h PHE 778 Cb 0.71 0.04 -0.12 0.00 3.61 0.00 0.00 35.95 40.19 2ovm h PHE 778 CO 1.02 -0.05 -0.01 0.00 -1.61 0.00 0.00 178.31 177.66 2ovm s ALA 779 N -6.18 -0.99 0.55 2.45 0.00 -1.13 -4.97 121.76 111.48 2ovm s ALA 779 Ca -0.13 -0.06 0.29 0.00 0.00 0.00 0.00 51.96 52.06 2ovm s ALA 779 Cb 0.07 0.78 1.46 0.00 0.00 0.00 0.00 23.12 25.42 2ovm s ALA 779 CO 0.66 -0.71 1.93 -1.35 0.00 0.00 0.00 175.76 176.29 2ovm h PRO 780 N 2.27 0.00 -0.46 0.00 0.11 -1.89 0.17 132.00 132.19 2ovm h PRO 780 Ca -0.32 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2ovm h PRO 780 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2ovm h PRO 780 CO 0.43 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.82 2ovm n ASP 781 N -4.11 4.25 -3.02 -2.05 5.75 -1.26 -4.69 116.55 111.41 2ovm n ASP 781 Ca 0.12 -2.58 -0.15 0.00 -0.01 0.00 0.00 54.79 52.17 2ovm n ASP 781 Cb 0.75 -0.51 -0.03 0.00 -1.03 0.00 0.00 41.12 40.30 2ovm n ASP 781 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2ovm n LEU 782 N 0.46 -1.75 -4.50 -2.12 7.94 0.60 -4.53 117.00 113.10 2ovm n LEU 782 Ca 0.22 -3.78 -0.34 0.00 -1.11 0.00 0.00 56.01 51.00 2ovm n LEU 782 Cb 0.83 0.69 -0.12 0.00 0.53 0.00 0.00 43.42 45.35 2ovm n LEU 782 CO 0.19 1.96 -0.37 -0.63 -1.11 0.00 0.00 177.39 177.43 2ovm s ILE 783 N 0.17 3.77 -0.23 1.96 1.01 -1.25 -2.26 121.20 124.38 2ovm s ILE 783 Ca 0.32 -0.41 0.02 0.00 0.00 0.00 0.00 60.65 60.58 2ovm s ILE 783 Cb 0.10 -2.63 0.04 0.00 0.01 0.00 0.00 42.46 39.98 2ovm s ILE 783 CO -0.15 0.51 -0.13 -0.76 0.00 0.00 0.00 174.94 174.41 2ovm s LEU 784 N 0.18 2.97 0.00 2.97 1.43 -0.40 -4.98 118.68 120.86 2ovm s LEU 784 Ca -0.03 -1.08 -0.06 0.00 -1.03 0.00 0.00 54.13 51.94 2ovm s LEU 784 Cb -0.14 -1.54 0.15 0.00 0.03 0.00 0.00 46.19 44.69 2ovm s LEU 784 CO 0.03 -0.12 0.99 -0.46 0.23 0.00 0.00 176.35 177.02 2ovm n ASN 785 N 4.53 0.78 -0.12 2.29 0.23 -1.26 -1.51 115.26 120.19 2ovm n ASN 785 Ca -0.17 -1.79 -0.05 0.00 -0.53 0.00 0.00 54.58 52.04 2ovm n ASN 785 Cb 0.45 -0.69 0.01 0.00 -2.08 0.00 0.00 39.78 37.47 2ovm n ASN 785 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2ovm h GLU 786 N 0.00 -0.12 -0.11 -3.83 4.81 -2.00 -0.38 114.58 112.95 2ovm h GLU 786 Ca -0.32 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 58.93 2ovm h GLU 786 Cb 1.07 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.45 2ovm h GLU 786 CO 0.30 -0.08 -0.01 0.37 -0.73 0.00 0.00 179.01 178.85 2ovm h GLN 787 N -0.12 0.02 0.00 1.92 5.75 -2.00 -1.15 115.11 119.53 2ovm h GLN 787 Ca 0.20 -0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.67 2ovm h GLN 787 Cb 0.44 -0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 2ovm h GLN 787 CO -0.49 0.01 -0.12 -0.09 -2.65 0.00 0.00 178.83 175.49 2ovm h ARG 788 N 0.02 0.00 0.33 1.69 2.43 -1.81 -1.79 114.38 115.25 2ovm h ARG 788 Ca 0.05 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 2ovm h ARG 788 Cb 0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.63 2ovm h ARG 788 CO -0.10 0.12 -0.16 0.52 -1.51 0.00 0.00 179.97 178.84 2ovm h MET 789 N 0.00 -0.43 -0.96 0.20 2.86 -0.40 -1.86 114.93 114.34 2ovm h MET 789 Ca -0.00 0.03 0.21 0.00 -2.06 0.00 0.00 59.70 57.88 2ovm h MET 789 Cb 0.32 0.10 -0.11 0.00 0.06 0.00 0.00 31.60 31.96 2ovm h MET 789 CO 0.02 -0.18 0.53 0.87 1.06 0.00 0.00 176.91 179.21 2ovm h LYS 790 N -1.05 0.59 -0.60 1.72 1.57 -1.00 0.33 116.57 118.13 2ovm h LYS 790 Ca -0.05 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2ovm h LYS 790 Cb 0.45 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2ovm h LYS 790 CO 0.08 0.39 0.00 0.39 -0.57 0.00 0.00 179.45 179.73 2ovm n GLU 791 N -4.88 2.86 -3.26 3.15 -0.58 -0.69 -4.71 120.64 112.52 2ovm n GLU 791 Ca 0.23 -2.06 -0.28 0.00 -0.42 0.00 0.00 57.16 54.63 2ovm n GLU 791 Cb 0.63 -1.67 -0.03 0.00 -0.57 0.00 0.00 31.44 29.80 2ovm n GLU 791 CO 0.00 0.00 0.00 -1.54 -0.48 0.00 0.00 177.13 175.11 2ovm s SER 792 N -0.83 6.42 0.65 1.62 1.04 0.12 -4.93 113.70 117.80 2ovm s SER 792 Ca 0.37 0.73 0.43 0.00 0.48 0.00 0.00 55.95 57.96 2ovm s SER 792 Cb 0.23 -2.15 2.33 0.00 0.10 0.00 0.00 66.02 66.53 2ovm s SER 792 CO 0.19 -0.25 2.31 -1.28 0.98 0.00 0.00 173.24 175.20 2ovm h SER 793 N 1.46 0.00 -2.22 7.02 0.87 -1.88 -3.25 113.55 115.55 2ovm h SER 793 Ca -0.48 0.00 -0.57 0.00 -1.23 0.00 0.00 61.79 59.51 2ovm h SER 793 Cb 1.19 0.00 -0.42 0.00 -0.44 0.00 0.00 62.40 62.74 2ovm h SER 793 CO 0.65 0.00 -0.75 2.22 -0.53 0.00 0.00 176.83 178.42 2ovm n PHE 794 N -3.03 3.22 -0.34 2.24 1.16 -1.26 -4.92 117.46 114.53 2ovm n PHE 794 Ca -0.03 -3.97 -0.04 0.00 -1.87 0.00 0.00 57.45 51.54 2ovm n PHE 794 Cb 0.09 -0.48 0.09 0.00 -1.61 0.00 0.00 39.48 37.57 2ovm n PHE 794 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 2ovm h TYR 795 N 3.13 1.24 0.00 2.97 3.20 -1.70 -2.55 116.97 123.27 2ovm h TYR 795 Ca 0.13 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.92 2ovm h TYR 795 Cb 0.61 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.47 2ovm h TYR 795 CO 0.75 0.85 -0.26 1.03 -1.64 0.00 0.00 178.16 178.89 2ovm h SER 796 N 1.28 0.00 0.76 -2.11 0.87 -1.91 -1.89 113.55 110.55 2ovm h SER 796 Ca 0.32 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.73 2ovm h SER 796 Cb 0.00 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 61.94 2ovm h SER 796 CO -0.05 0.26 -0.71 0.25 -0.53 0.00 0.00 176.83 176.04 2ovm h LEU 797 N 0.00 0.00 -0.65 2.23 5.85 -1.88 -2.88 115.31 117.98 2ovm h LEU 797 Ca -0.00 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.58 2ovm h LEU 797 Cb 0.47 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 2ovm h LEU 797 CO 0.03 0.71 -0.46 0.00 -0.34 0.00 0.00 178.44 178.38 2ovm h LEU 799 N 0.40 0.85 -0.02 0.00 3.38 -1.42 -0.45 115.31 118.06 2ovm h LEU 799 Ca 0.03 -0.48 0.02 0.00 0.09 0.00 0.00 57.88 57.54 2ovm h LEU 799 Cb 0.96 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 2ovm h LEU 799 CO 0.09 1.15 -0.07 0.74 0.09 0.00 0.00 178.44 180.44 2ovm h THR 800 N 0.57 0.82 0.00 0.22 2.02 -1.43 -1.95 112.91 113.15 2ovm h THR 800 Ca 0.05 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.16 2ovm h THR 800 Cb 0.92 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2ovm h THR 800 CO 0.08 0.00 -0.30 0.24 0.37 0.00 0.00 175.52 175.91 2ovm h MET 801 N -0.11 0.00 0.00 6.66 2.86 -1.43 -2.45 114.93 120.46 2ovm h MET 801 Ca 0.04 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2ovm h MET 801 Cb 0.16 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.81 2ovm h MET 801 CO -0.09 0.30 -0.08 2.35 1.06 0.00 0.00 176.91 180.45 2ovm h TRP 802 N 0.00 0.00 -0.83 -0.22 2.91 -0.32 -2.92 115.95 114.57 2ovm h TRP 802 Ca -0.00 0.00 0.09 0.00 1.13 0.00 0.00 58.89 60.10 2ovm h TRP 802 Cb 0.64 0.00 -0.07 0.00 -0.51 0.00 0.00 29.16 29.22 2ovm h TRP 802 CO 0.00 0.08 0.49 1.96 -1.03 0.00 0.00 178.44 179.94 2ovm h GLN 803 N 0.00 0.81 -0.15 2.65 4.20 -0.98 -2.74 115.11 118.90 2ovm h GLN 803 Ca -0.00 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2ovm h GLN 803 Cb 0.40 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 2ovm h GLN 803 CO 0.01 0.54 0.09 0.82 -0.67 0.00 0.00 178.83 179.62 2ovm h ILE 804 N 0.83 1.06 -0.66 2.54 2.04 -1.70 -2.00 117.51 119.61 2ovm h ILE 804 Ca 0.39 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 66.08 2ovm h ILE 804 Cb 0.32 0.89 -0.03 0.00 -0.74 0.00 0.00 36.82 37.25 2ovm h ILE 804 CO -0.23 0.06 0.31 -0.65 0.00 0.00 0.00 178.15 177.64 2ovm h PRO 805 N 0.18 0.95 -0.73 2.37 0.11 -1.69 -1.56 132.00 131.63 2ovm h PRO 805 Ca 0.05 -0.13 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 2ovm h PRO 805 Cb 0.01 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 30.91 2ovm h PRO 805 CO -0.01 0.74 0.34 1.96 -0.21 0.00 0.00 178.00 180.82 2ovm h GLN 806 N 0.94 1.06 -0.22 1.05 4.20 -1.27 -1.02 115.11 119.85 2ovm h GLN 806 Ca 0.23 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.77 2ovm h GLN 806 Cb 0.11 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2ovm h GLN 806 CO -0.03 0.84 0.11 0.93 -0.67 0.00 0.00 178.83 180.01 2ovm h GLU 807 N 1.03 0.31 -0.67 1.46 4.39 -0.90 -0.67 114.58 119.52 2ovm h GLU 807 Ca 0.25 -0.04 0.12 0.00 0.34 0.00 0.00 59.36 60.03 2ovm h GLU 807 Cb 0.13 -0.06 -0.08 0.00 -0.10 0.00 0.00 28.75 28.64 2ovm h GLU 807 CO -0.03 0.30 0.24 0.74 -1.16 0.00 0.00 179.01 179.11 2ovm h PHE 808 N 0.24 0.42 0.33 4.33 0.05 -0.77 0.33 116.94 121.86 2ovm h PHE 808 Ca 0.08 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.89 2ovm h PHE 808 Cb 0.09 -0.08 -0.00 0.00 2.00 0.00 0.00 35.95 37.95 2ovm h PHE 808 CO -0.03 0.07 -0.19 0.28 -0.18 0.00 0.00 178.31 178.25 2ovm h VAL 809 N 0.40 0.60 -0.41 -0.55 2.07 -0.78 0.63 116.25 118.22 2ovm h VAL 809 Ca 0.36 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.93 2ovm h VAL 809 Cb 0.50 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 2ovm h VAL 809 CO -0.36 0.00 0.13 0.11 0.02 0.00 0.00 177.57 177.46 2ovm h LYS 810 N -0.50 0.27 0.00 1.57 1.57 0.03 -2.46 116.57 117.05 2ovm h LYS 810 Ca -0.04 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 2ovm h LYS 810 Cb 0.40 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2ovm h LYS 810 CO 0.05 0.18 0.00 -0.07 -0.57 0.00 0.00 179.45 179.04 2ovm h LEU 811 N 0.28 0.00 -2.56 2.94 3.38 -0.20 -3.48 115.31 115.67 2ovm h LEU 811 Ca 0.19 0.00 -0.37 0.00 0.09 0.00 0.00 57.88 57.80 2ovm h LEU 811 Cb 0.20 0.00 0.12 0.00 0.09 0.00 0.00 40.66 41.07 2ovm h LEU 811 CO -0.22 0.00 -0.88 0.00 0.09 0.00 0.00 178.44 177.43 2ovm n GLN 812 N -2.30 -2.64 -2.03 1.13 1.13 0.22 -4.90 117.38 107.99 2ovm n GLN 812 Ca 0.05 0.64 -0.41 0.00 -1.94 0.00 0.00 57.00 55.34 2ovm n GLN 812 Cb 0.42 -5.00 -0.02 0.00 0.11 0.00 0.00 30.24 25.75 2ovm n GLN 812 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ovm s VAL 813 N -3.49 2.70 0.53 5.09 1.01 -1.09 -5.02 120.40 120.14 2ovm s VAL 813 Ca 0.34 0.59 -0.05 0.00 0.00 0.00 0.00 61.98 62.86 2ovm s VAL 813 Cb -0.09 -3.38 -0.01 0.00 0.00 0.00 0.00 36.38 32.91 2ovm s VAL 813 CO 0.81 0.09 0.83 -0.94 0.00 0.00 0.00 175.10 175.89 2ovm s SER 814 N 0.34 5.82 0.17 3.32 1.04 -1.26 -4.94 113.70 118.19 2ovm s SER 814 Ca 0.59 0.70 -0.12 0.00 0.48 0.00 0.00 55.95 57.60 2ovm s SER 814 Cb -0.41 -1.83 0.06 0.00 0.10 0.00 0.00 66.02 63.94 2ovm s SER 814 CO 0.43 -0.86 1.68 -0.61 0.98 0.00 0.00 173.24 174.86 2ovm h GLN 815 N 0.04 0.91 -0.77 4.02 4.15 -1.99 -0.09 115.11 121.39 2ovm h GLN 815 Ca -0.46 -0.21 -0.04 0.00 0.77 0.00 0.00 58.65 58.71 2ovm h GLN 815 Cb 1.24 -0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.77 2ovm h GLN 815 CO 0.60 0.84 0.33 0.93 -1.93 0.00 0.00 178.83 179.60 2ovm h GLU 816 N 0.82 1.14 -0.49 1.69 3.07 -1.94 -1.46 114.58 117.40 2ovm h GLU 816 Ca 0.18 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.76 2ovm h GLU 816 Cb 0.33 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.03 2ovm h GLU 816 CO -0.00 0.91 -0.03 0.93 -1.40 0.00 0.00 179.01 179.42 2ovm h GLU 817 N 1.10 0.89 0.08 2.33 5.08 -1.79 -2.83 114.58 119.45 2ovm h GLU 817 Ca 0.26 -0.30 -0.00 0.00 -1.00 0.00 0.00 59.36 58.31 2ovm h GLU 817 Cb 0.18 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2ovm h GLU 817 CO -0.02 0.94 -0.04 0.35 -1.00 0.00 0.00 179.01 179.24 2ovm h PHE 818 N 0.75 -0.11 -0.52 4.33 3.57 -0.68 -0.44 116.94 123.84 2ovm h PHE 818 Ca 0.14 -0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.69 2ovm h PHE 818 Cb 0.56 0.03 -0.05 0.00 2.79 0.00 0.00 35.95 39.29 2ovm h PHE 818 CO 0.04 -0.06 0.23 -0.07 -2.23 0.00 0.00 178.31 176.22 2ovm h LEU 819 N -0.12 0.29 -0.68 0.59 3.38 -1.27 0.12 115.31 117.62 2ovm h LEU 819 Ca -0.01 0.05 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2ovm h LEU 819 Cb 0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 2ovm h LEU 819 CO 0.02 0.20 -0.13 0.00 0.09 0.00 0.00 178.44 178.61 2ovm h MET 821 N 0.79 1.04 -0.64 0.00 2.86 -0.23 -2.63 114.93 116.12 2ovm h MET 821 Ca 0.12 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 2ovm h MET 821 Cb 0.66 -0.16 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 2ovm h MET 821 CO 0.05 0.88 0.29 -0.22 1.06 0.00 0.00 176.91 178.96 2ovm h LYS 822 N 0.98 0.91 -0.53 1.72 3.64 -0.59 -1.60 116.57 121.10 2ovm h LYS 822 Ca 0.22 -0.13 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 2ovm h LYS 822 Cb 0.25 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2ovm h LYS 822 CO -0.01 0.72 0.17 0.28 -2.27 0.00 0.00 179.45 178.34 2ovm h VAL 823 N 0.90 1.23 -0.32 2.00 2.07 -1.25 -2.29 116.25 118.59 2ovm h VAL 823 Ca 0.22 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.99 2ovm h VAL 823 Cb 0.12 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 2ovm h VAL 823 CO -0.03 0.28 0.21 -0.07 0.02 0.00 0.00 177.57 177.99 2ovm h LEU 824 N 0.73 0.35 -0.81 2.57 3.38 -1.02 -1.25 115.31 119.25 2ovm h LEU 824 Ca 0.17 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.09 2ovm h LEU 824 Cb 0.26 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 2ovm h LEU 824 CO -0.01 0.25 0.32 -0.07 0.09 0.00 0.00 178.44 179.02 2ovm h LEU 825 N 0.41 1.10 -1.80 1.67 3.38 -0.74 -0.84 115.31 118.49 2ovm h LEU 825 Ca 0.12 -0.17 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2ovm h LEU 825 Cb -0.00 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 2ovm h LEU 825 CO -0.03 0.98 -0.15 0.25 0.09 0.00 0.00 178.44 179.58 2ovm h LEU 826 N 1.16 0.00 -3.59 1.67 5.85 -1.06 -2.78 115.31 116.56 2ovm h LEU 826 Ca 0.27 0.00 -0.32 0.00 0.84 0.00 0.00 57.88 58.66 2ovm h LEU 826 Cb 0.22 0.00 -0.19 0.00 0.37 0.00 0.00 40.66 41.06 2ovm h LEU 826 CO -0.02 0.15 0.14 0.18 -0.34 0.00 0.00 178.44 178.55 2ovm n LEU 827 N -4.00 5.11 -0.14 2.25 4.77 -0.44 -4.62 117.00 119.92 2ovm n LEU 827 Ca -0.02 -3.82 0.10 0.00 -0.03 0.00 0.00 56.01 52.23 2ovm n LEU 827 Cb 0.23 -0.70 -0.08 0.00 -2.33 0.00 0.00 43.42 40.54 2ovm n LEU 827 CO 0.33 1.27 0.06 -3.20 -1.33 0.00 0.00 177.39 174.52 2ovm n ASN 828 N -1.10 1.24 -3.74 -1.43 5.15 -0.52 -4.92 115.26 109.93 2ovm n ASN 828 Ca 0.43 -1.12 -0.14 0.00 -0.60 0.00 0.00 54.58 53.15 2ovm n ASN 828 Cb 1.19 0.84 -0.15 0.00 -0.53 0.00 0.00 39.78 41.14 2ovm n ASN 828 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2ovm s THR 829 N -2.71 -0.07 0.26 -0.44 2.01 -1.26 -0.31 115.64 113.12 2ovm s THR 829 Ca 0.10 0.20 0.03 0.00 0.31 0.00 0.00 61.69 62.34 2ovm s THR 829 Cb 0.16 -0.25 -0.05 0.00 0.01 0.00 0.00 72.50 72.37 2ovm s THR 829 CO 0.73 0.08 0.04 0.27 -0.69 0.00 0.00 174.62 175.05 2ovm s ILE 830 N 1.30 0.94 0.71 1.82 -4.36 -0.85 -4.84 121.20 115.92 2ovm s ILE 830 Ca -0.08 -2.02 -0.15 0.00 -0.26 0.00 0.00 60.65 58.15 2ovm s ILE 830 Cb -0.12 -2.51 0.03 0.00 1.25 0.00 0.00 42.46 41.11 2ovm s ILE 830 CO -0.06 -0.18 1.16 -2.84 0.24 0.00 0.00 174.94 173.26 2ovm s PRO 831 N -3.91 2.36 0.41 0.37 0.02 -1.26 -0.91 135.00 132.08 2ovm s PRO 831 Ca 0.32 1.58 0.11 0.00 0.02 0.00 0.00 61.00 63.04 2ovm s PRO 831 Cb 0.07 -1.88 0.94 0.00 0.02 0.00 0.00 34.50 33.65 2ovm s PRO 831 CO 0.11 -1.62 1.97 -0.07 -0.33 0.00 0.00 177.00 177.06 2ovm h LEU 832 N -0.26 0.46 -0.33 -5.54 3.38 -1.86 0.23 115.31 111.39 2ovm h LEU 832 Ca -0.47 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2ovm h LEU 832 Cb 1.27 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.93 2ovm h LEU 832 CO 0.51 0.28 -0.05 -1.84 0.09 0.00 0.00 178.44 177.44 2ovm n GLU 833 N -4.48 1.02 0.00 1.13 0.00 -1.26 -5.00 120.64 112.05 2ovm n GLU 833 Ca 0.10 -0.33 0.00 0.00 0.00 0.00 0.00 57.16 56.93 2ovm n GLU 833 Cb 0.34 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.28 2ovm n GLU 833 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ovm n GLY 834 N 1.17 -1.79 3.59 -1.84 0.00 0.79 -4.98 105.19 102.12 2ovm n GLY 834 Ca 0.19 -1.69 -0.24 0.00 0.00 0.00 0.00 46.02 44.28 2ovm n GLY 834 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ovm s LEU 835 N 0.00 2.90 0.16 0.99 1.43 -1.26 -4.19 118.68 118.72 2ovm s LEU 835 Ca 0.00 -0.96 -0.10 0.00 -1.03 0.00 0.00 54.13 52.03 2ovm s LEU 835 Cb 0.00 -1.32 0.03 0.00 0.03 0.00 0.00 46.19 44.93 2ovm s LEU 835 CO 0.00 -0.13 1.59 0.03 0.23 0.00 0.00 176.35 178.07 2ovm h ARG 836 N 1.95 0.99 -1.63 1.70 3.08 -1.97 -2.87 114.38 115.62 2ovm h ARG 836 Ca -0.42 -0.36 -0.73 0.00 0.07 0.00 0.00 59.98 58.54 2ovm h ARG 836 Cb 1.25 -0.07 -0.27 0.00 0.08 0.00 0.00 29.97 30.96 2ovm h ARG 836 CO 0.65 1.04 0.98 0.43 -1.07 0.00 0.00 179.97 181.99 2ovm n SER 837 N -4.19 7.57 -0.13 7.04 7.64 -1.26 -4.78 113.62 125.50 2ovm n SER 837 Ca 0.01 -3.80 -0.05 0.00 1.01 0.00 0.00 58.87 56.04 2ovm n SER 837 Cb 0.39 -1.04 0.01 0.00 -1.01 0.00 0.00 64.21 62.56 2ovm n SER 837 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2ovm h GLN 838 N 2.62 -0.11 -0.30 1.43 5.75 -1.91 0.17 115.11 122.76 2ovm h GLN 838 Ca 0.58 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 59.06 2ovm h GLN 838 Cb 0.33 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.89 2ovm h GLN 838 CO 1.48 -0.08 0.09 1.15 -2.65 0.00 0.00 178.83 178.82 2ovm h THR 839 N -0.12 1.20 -0.81 2.39 2.02 -1.89 -0.64 112.91 115.06 2ovm h THR 839 Ca 0.21 -0.66 0.01 0.00 0.77 0.00 0.00 66.41 66.74 2ovm h THR 839 Cb 0.44 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.89 2ovm h THR 839 CO -0.51 0.22 0.54 1.56 0.37 0.00 0.00 175.52 177.70 2ovm h GLN 840 N 0.32 1.05 -0.45 6.66 7.50 -1.83 -1.96 115.11 126.39 2ovm h GLN 840 Ca 0.09 -0.06 -0.07 0.00 0.50 0.00 0.00 58.65 59.11 2ovm h GLN 840 Cb 0.25 -0.24 -0.02 0.00 0.05 0.00 0.00 27.48 27.53 2ovm h GLN 840 CO -0.00 0.69 0.01 0.35 -1.50 0.00 0.00 178.83 178.38 2ovm h PHE 841 N 1.08 0.87 -0.05 2.96 3.04 -0.27 -2.26 116.94 122.31 2ovm h PHE 841 Ca 0.30 -0.15 -0.06 0.00 3.98 0.00 0.00 57.97 62.04 2ovm h PHE 841 Cb -0.10 -0.23 -0.01 0.00 2.56 0.00 0.00 35.95 38.17 2ovm h PHE 841 CO -0.00 0.84 -0.27 0.93 -2.02 0.00 0.00 178.31 177.79 2ovm h GLU 842 N 0.64 0.09 0.00 1.11 5.08 -0.65 -1.94 114.58 118.90 2ovm h GLU 842 Ca 0.13 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 58.32 2ovm h GLU 842 Cb 0.49 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 2ovm h GLU 842 CO 0.02 0.35 -0.70 0.93 -1.00 0.00 0.00 179.01 178.61 2ovm h GLU 843 N 0.08 0.00 -0.05 2.33 4.39 -1.15 -1.78 114.58 118.41 2ovm h GLU 843 Ca 0.01 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.67 2ovm h GLU 843 Cb 0.52 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.17 2ovm h GLU 843 CO 0.04 0.70 -0.15 1.98 -1.16 0.00 0.00 179.01 180.42 2ovm h MET 844 N 0.00 0.19 -0.94 2.33 4.05 -0.98 -2.77 114.93 116.81 2ovm h MET 844 Ca -0.01 -0.14 0.01 0.00 -0.28 0.00 0.00 59.70 59.29 2ovm h MET 844 Cb 1.32 0.02 -0.05 0.00 -0.80 0.00 0.00 31.60 32.10 2ovm h MET 844 CO 0.09 0.76 0.62 -0.09 0.23 0.00 0.00 176.91 178.52 2ovm h ARG 845 N -0.35 1.23 -0.42 0.39 2.43 -1.38 -1.98 114.38 114.30 2ovm h ARG 845 Ca -0.00 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 2ovm h ARG 845 Cb 0.77 -0.28 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 2ovm h ARG 845 CO 0.03 0.81 0.08 0.77 -1.51 0.00 0.00 179.97 180.15 2ovm h SER 846 N 1.27 0.58 -0.20 -3.80 0.02 -1.31 -1.65 113.55 108.46 2ovm h SER 846 Ca 0.35 -0.10 -0.04 0.00 -0.84 0.00 0.00 61.79 61.16 2ovm h SER 846 Cb -0.14 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.24 2ovm h SER 846 CO -0.08 0.60 -0.05 0.28 -1.14 0.00 0.00 176.83 176.45 2ovm h SER 847 N 0.61 0.39 0.78 3.07 0.02 -1.07 -1.78 113.55 115.57 2ovm h SER 847 Ca 0.14 -0.36 -0.03 0.00 -0.84 0.00 0.00 61.79 60.70 2ovm h SER 847 Cb 0.27 -0.11 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 2ovm h SER 847 CO 0.00 0.66 -0.12 1.88 -1.14 0.00 0.00 176.83 178.11 2ovm h TYR 848 N 0.11 0.00 -0.20 3.45 0.05 -1.30 0.21 116.97 119.30 2ovm h TYR 848 Ca 0.05 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.69 2ovm h TYR 848 Cb 0.49 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.23 2ovm h TYR 848 CO 0.05 0.12 -0.41 0.82 -1.05 0.00 0.00 178.16 177.70 2ovm h ILE 849 N 0.00 1.33 -0.37 -2.88 2.04 -1.10 -0.66 117.51 115.87 2ovm h ILE 849 Ca -0.00 -1.64 -0.07 0.00 1.00 0.00 0.00 64.86 64.15 2ovm h ILE 849 Cb 0.55 1.86 -0.02 0.00 -0.74 0.00 0.00 36.82 38.47 2ovm h ILE 849 CO 0.02 0.51 -0.08 0.03 0.00 0.00 0.00 178.15 178.63 2ovm h ARG 850 N 0.31 0.63 -0.36 2.37 3.08 -0.41 -2.50 114.38 117.50 2ovm h ARG 850 Ca 0.01 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 59.78 2ovm h ARG 850 Cb 1.01 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.98 2ovm h ARG 850 CO 0.09 0.71 -0.17 1.49 -1.07 0.00 0.00 179.97 181.01 2ovm h GLU 851 N 0.58 0.67 -0.86 0.04 4.57 -0.41 -2.39 114.58 116.78 2ovm h GLU 851 Ca 0.11 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2ovm h GLU 851 Cb 0.49 -0.05 -0.04 0.00 -0.16 0.00 0.00 28.75 28.99 2ovm h GLU 851 CO 0.03 0.81 0.48 1.25 -1.18 0.00 0.00 179.01 180.39 2ovm h LEU 852 N 0.60 1.07 -1.13 1.64 5.85 -0.70 -0.96 115.31 121.69 2ovm h LEU 852 Ca 0.10 -0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2ovm h LEU 852 Cb 0.63 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 2ovm h LEU 852 CO 0.04 0.86 0.14 0.40 -0.34 0.00 0.00 178.44 179.54 2ovm h ILE 853 N 1.20 1.21 -0.23 4.05 2.04 -1.11 -0.19 117.51 124.48 2ovm h ILE 853 Ca 0.30 -0.73 -0.04 0.00 1.00 0.00 0.00 64.86 65.40 2ovm h ILE 853 Cb 0.02 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2ovm h ILE 853 CO -0.05 0.27 0.01 0.11 0.00 0.00 0.00 178.15 178.49 2ovm h LYS 854 N 0.74 0.40 -0.66 2.37 1.57 -0.90 0.12 116.57 120.21 2ovm h LYS 854 Ca 0.17 -0.12 0.08 0.00 -1.87 0.00 0.00 60.65 58.90 2ovm h LYS 854 Cb 0.25 -0.04 -0.06 0.00 0.08 0.00 0.00 32.23 32.46 2ovm h LYS 854 CO -0.01 0.58 0.34 0.00 -0.57 0.00 0.00 179.45 179.79 2ovm h ALA 855 N 0.81 0.90 -0.56 3.86 0.00 -0.72 -0.82 119.26 122.73 2ovm h ALA 855 Ca 0.07 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.94 2ovm h ALA 855 Cb 0.39 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2ovm h ALA 855 CO 0.01 -0.03 0.06 0.82 0.00 0.00 0.00 179.25 180.10 2ovm h ILE 856 N 0.60 1.26 0.00 0.00 2.04 -0.85 -2.57 117.51 117.99 2ovm h ILE 856 Ca 0.31 -1.03 0.00 0.00 1.00 0.00 0.00 64.86 65.15 2ovm h ILE 856 Cb 0.28 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2ovm h ILE 856 CO -0.23 0.37 0.01 1.23 0.00 0.00 0.00 178.15 179.53 2ovm h GLY 857 N 0.84 0.00 2.00 5.37 0.00 0.66 0.53 103.07 112.47 2ovm h GLY 857 Ca 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.47 2ovm h GLY 857 CO 0.02 0.00 -0.14 1.41 0.00 0.00 0.00 176.54 177.82 2ovm h LEU 858 N 0.00 0.00 0.00 3.11 3.38 -0.95 -3.36 115.31 117.49 2ovm h LEU 858 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2ovm h LEU 858 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2ovm h LEU 858 CO 0.00 0.14 -0.84 0.54 0.09 0.00 0.00 178.44 178.37 2ovm n ARG 859 N -4.12 0.00 -2.87 1.13 1.74 -0.90 -4.92 116.66 106.72 2ovm n ARG 859 Ca -0.02 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.62 2ovm n ARG 859 Cb 0.22 -0.89 -0.02 0.00 -1.02 0.00 0.00 32.46 30.76 2ovm n ARG 859 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2ovm s GLN 860 N -1.85 3.78 0.13 5.56 2.00 0.13 -4.88 119.66 124.52 2ovm s GLN 860 Ca 0.00 -1.97 -0.12 0.00 -2.00 0.00 0.00 55.36 51.26 2ovm s GLN 860 Cb 0.00 -5.05 -0.06 0.00 0.80 0.00 0.00 33.01 28.70 2ovm s GLN 860 CO 0.00 -1.85 1.45 1.57 -0.50 0.00 0.00 175.29 175.97 2ovm h LYS 861 N 8.32 0.86 -7.06 1.67 2.10 -1.83 -3.38 116.57 117.25 2ovm h LYS 861 Ca 0.23 -0.46 -0.54 0.00 -2.00 0.00 0.00 60.65 57.88 2ovm h LYS 861 Cb 0.97 0.02 0.13 0.00 -0.90 0.00 0.00 32.23 32.44 2ovm h LYS 861 CO 1.20 1.10 0.55 0.20 -2.00 0.00 0.00 179.45 180.50 2ovm s GLY 862 N -3.79 2.84 0.13 0.07 0.00 -1.26 -4.86 107.32 100.46 2ovm s GLY 862 Ca -0.11 1.20 -0.16 0.00 0.00 0.00 0.00 44.72 45.65 2ovm s GLY 862 CO 0.86 1.67 1.67 -2.08 0.00 0.00 0.00 173.10 175.23 2ovm h VAL 863 N 1.24 1.20 -0.13 1.40 2.07 -1.99 -0.30 116.25 119.75 2ovm h VAL 863 Ca -0.51 -0.65 -0.15 0.00 0.82 0.00 0.00 66.70 66.22 2ovm h VAL 863 Cb 1.30 0.86 0.01 0.00 -1.52 0.00 0.00 31.29 31.94 2ovm h VAL 863 CO 0.56 0.23 -0.50 0.58 0.02 0.00 0.00 177.57 178.46 2ovm h VAL 864 N 0.52 1.35 0.62 2.57 2.07 -1.98 -2.47 116.25 118.93 2ovm h VAL 864 Ca 0.13 -1.80 -0.03 0.00 0.82 0.00 0.00 66.70 65.83 2ovm h VAL 864 Cb 0.21 2.11 0.01 0.00 -1.52 0.00 0.00 31.29 32.10 2ovm h VAL 864 CO -0.01 0.55 -0.30 0.28 0.02 0.00 0.00 177.57 178.11 2ovm h SER 865 N 0.19 -0.70 0.02 0.57 0.02 -1.92 0.15 113.55 111.87 2ovm h SER 865 Ca -0.03 -0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2ovm h SER 865 Cb 1.14 0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.86 2ovm h SER 865 CO 0.11 -0.45 -0.01 0.77 -1.14 0.00 0.00 176.83 176.10 2ovm h SER 866 N -0.91 0.00 -0.05 3.07 4.64 -1.17 0.18 113.55 119.31 2ovm h SER 866 Ca -0.08 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.03 2ovm h SER 866 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2ovm h SER 866 CO 0.14 0.01 -0.71 -1.28 -0.87 0.00 0.00 176.83 174.12 2ovm h SER 867 N 0.00 0.81 -0.02 4.97 0.87 -1.11 -2.15 113.55 116.91 2ovm h SER 867 Ca -0.00 -0.51 -0.16 0.00 -1.23 0.00 0.00 61.79 59.89 2ovm h SER 867 Cb 0.02 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.74 2ovm h SER 867 CO 0.00 1.29 -0.54 -0.61 -0.53 0.00 0.00 176.83 176.44 2ovm h GLN 868 N 0.49 0.60 -0.32 2.24 5.75 0.19 -2.80 115.11 121.26 2ovm h GLN 868 Ca -0.03 -0.38 -0.16 0.00 -0.15 0.00 0.00 58.65 57.93 2ovm h GLN 868 Cb 1.32 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 29.91 2ovm h GLN 868 CO 0.14 0.99 -0.43 -0.09 -2.65 0.00 0.00 178.83 176.79 2ovm h ARG 869 N 0.47 0.83 -0.80 1.69 2.43 -0.76 -1.80 114.38 116.43 2ovm h ARG 869 Ca 0.01 -0.46 0.08 0.00 -0.81 0.00 0.00 59.98 58.80 2ovm h ARG 869 Cb 1.09 0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 30.60 2ovm h ARG 869 CO 0.11 1.09 0.47 0.35 -1.51 0.00 0.00 179.97 180.47 2ovm h PHE 870 N 0.66 0.85 -0.24 2.20 3.57 -1.33 0.92 116.94 123.57 2ovm h PHE 870 Ca 0.04 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2ovm h PHE 870 Cb 1.01 -0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.48 2ovm h PHE 870 CO 0.06 0.38 0.11 -0.92 -2.23 0.00 0.00 178.31 175.71 2ovm h TYR 871 N 0.81 0.36 -0.67 0.41 3.20 -1.24 -1.17 116.97 118.67 2ovm h TYR 871 Ca 0.37 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.23 2ovm h TYR 871 Cb 0.28 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 2ovm h TYR 871 CO -0.06 0.35 0.44 1.96 -1.64 0.00 0.00 178.16 179.21 2ovm h GLN 872 N 0.26 0.89 -0.27 1.82 4.20 -0.34 0.16 115.11 121.83 2ovm h GLN 872 Ca 0.08 -0.06 -0.18 0.00 0.06 0.00 0.00 58.65 58.55 2ovm h GLN 872 Cb 0.13 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.71 2ovm h GLN 872 CO -0.01 0.59 -0.55 -0.07 -0.67 0.00 0.00 178.83 178.12 2ovm h LEU 873 N 0.92 0.95 -0.42 1.46 3.38 -0.79 -2.40 115.31 118.41 2ovm h LEU 873 Ca 0.25 -0.54 -0.18 0.00 0.09 0.00 0.00 57.88 57.50 2ovm h LEU 873 Cb -0.10 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.36 2ovm h LEU 873 CO -0.05 1.32 -0.78 0.71 0.09 0.00 0.00 178.44 179.72 2ovm h THR 874 N 0.63 1.47 -0.60 0.22 1.35 -1.11 -2.38 112.91 112.49 2ovm h THR 874 Ca 0.01 -2.44 -0.02 0.00 -0.55 0.00 0.00 66.41 63.41 2ovm h THR 874 Cb 1.17 2.33 -0.03 0.00 -1.73 0.00 0.00 68.15 69.89 2ovm h THR 874 CO 0.12 0.71 0.29 0.50 -0.25 0.00 0.00 175.52 176.90 2ovm h LYS 875 N 0.11 0.85 0.01 4.72 1.63 -0.69 -0.06 116.57 123.15 2ovm h LYS 875 Ca -0.03 -0.12 0.02 0.00 -0.85 0.00 0.00 60.65 59.67 2ovm h LYS 875 Cb 1.37 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 32.82 2ovm h LYS 875 CO 0.12 0.69 -0.13 1.25 -3.45 0.00 0.00 179.45 177.92 2ovm h LEU 876 N 0.81 -0.38 -0.82 5.20 6.46 -1.27 -0.84 115.31 124.47 2ovm h LEU 876 Ca 0.21 0.06 0.08 0.00 -0.12 0.00 0.00 57.88 58.10 2ovm h LEU 876 Cb 0.11 0.16 -0.07 0.00 -0.73 0.00 0.00 40.66 40.13 2ovm h LEU 876 CO -0.03 -0.18 0.49 -0.07 -0.62 0.00 0.00 178.44 178.03 2ovm h LEU 877 N -0.22 0.74 -1.52 2.25 3.38 -1.04 0.31 115.31 119.20 2ovm h LEU 877 Ca 0.04 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.05 2ovm h LEU 877 Cb 0.28 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 2ovm h LEU 877 CO -0.12 0.45 0.32 0.44 0.09 0.00 0.00 178.44 179.62 2ovm h ASP 878 N 0.86 0.56 0.92 -0.43 3.45 -0.33 -1.88 116.42 119.58 2ovm h ASP 878 Ca 0.38 -0.01 -0.02 0.00 0.43 0.00 0.00 57.03 57.80 2ovm h ASP 878 Cb 0.26 -0.14 -0.00 0.00 -0.56 0.00 0.00 39.33 38.89 2ovm h ASP 878 CO -0.21 0.40 -0.11 0.78 -1.57 0.00 0.00 179.24 178.53 2ovm h ASN 879 N 0.66 0.00 0.71 6.45 2.35 0.47 -3.05 115.58 123.16 2ovm h ASN 879 Ca 0.18 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.92 2ovm h ASN 879 Cb -0.08 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 2ovm h ASN 879 CO -0.04 0.11 -0.03 -0.07 -1.65 0.00 0.00 177.43 175.75 2ovm h LEU 880 N 0.00 0.00 -0.93 1.61 3.38 -0.97 -2.87 115.31 115.54 2ovm h LEU 880 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 2ovm h LEU 880 Cb 0.60 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.30 2ovm h LEU 880 CO 0.01 0.03 0.62 0.45 0.09 0.00 0.00 178.44 179.64 2ovm h HIS 881 N 0.00 1.16 -0.02 1.13 3.86 -1.66 0.30 115.15 119.93 2ovm h HIS 881 Ca -0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2ovm h HIS 881 Cb 0.39 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2ovm h HIS 881 CO 0.00 0.72 -0.04 -0.44 0.86 0.00 0.00 177.93 179.03 2ovm h ASP 882 N 1.24 0.06 -0.88 2.45 3.32 -1.73 -3.21 116.42 117.68 2ovm h ASP 882 Ca 0.35 -0.60 0.03 0.00 0.02 0.00 0.00 57.03 56.83 2ovm h ASP 882 Cb -0.11 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 39.38 2ovm h ASP 882 CO -0.09 0.65 0.58 0.25 -1.72 0.00 0.00 179.24 178.91 2ovm h LEU 883 N -0.52 0.96 -0.87 1.55 6.46 -1.49 -2.89 115.31 118.51 2ovm h LEU 883 Ca -0.00 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.74 2ovm h LEU 883 Cb 0.64 -0.23 -0.04 0.00 -0.73 0.00 0.00 40.66 40.30 2ovm h LEU 883 CO 0.01 0.67 0.53 0.58 -0.62 0.00 0.00 178.44 179.61 2ovm h VAL 884 N 1.13 1.24 -0.08 1.05 2.07 -0.99 -2.01 116.25 118.65 2ovm h VAL 884 Ca 0.34 -0.52 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 2ovm h VAL 884 Cb -0.03 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 29.74 2ovm h VAL 884 CO -0.09 0.25 -0.38 0.07 0.02 0.00 0.00 177.57 177.43 2ovm h LYS 885 N 1.19 0.17 -0.83 1.57 2.10 -1.51 -1.54 116.57 117.72 2ovm h LYS 885 Ca 0.31 -0.08 0.07 0.00 -2.00 0.00 0.00 60.65 58.96 2ovm h LYS 885 Cb -0.06 -0.01 -0.07 0.00 -0.90 0.00 0.00 32.23 31.20 2ovm h LYS 885 CO -0.06 0.54 0.50 1.96 -2.00 0.00 0.00 179.45 180.38 2ovm h GLN 886 N 0.15 0.86 -0.37 0.07 4.20 -1.27 0.35 115.11 119.09 2ovm h GLN 886 Ca 0.02 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.55 2ovm h GLN 886 Cb 0.75 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 2ovm h GLN 886 CO 0.06 0.57 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.45 2ovm h LEU 887 N 0.88 0.86 -0.72 1.46 3.38 -0.97 -1.64 115.31 118.57 2ovm h LEU 887 Ca 0.38 -0.44 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2ovm h LEU 887 Cb 0.25 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2ovm h LEU 887 CO -0.20 1.11 0.19 0.45 0.09 0.00 0.00 178.44 180.08 2ovm h HIS 888 N 0.62 1.20 -0.49 1.13 3.86 -0.78 -0.51 115.15 120.18 2ovm h HIS 888 Ca 0.07 -0.14 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2ovm h HIS 888 Cb 0.83 -0.34 -0.02 0.00 1.06 0.00 0.00 27.41 28.93 2ovm h HIS 888 CO 0.06 0.97 0.33 1.25 0.86 0.00 0.00 177.93 181.40 2ovm h LEU 889 N 1.09 0.57 -1.35 2.43 5.85 -0.84 -0.63 115.31 122.43 2ovm h LEU 889 Ca 0.23 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.87 2ovm h LEU 889 Cb 0.36 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 2ovm h LEU 889 CO 0.00 0.41 -0.21 0.22 -0.34 0.00 0.00 178.44 178.52 2ovm h TYR 890 N 0.67 0.17 -0.09 1.25 5.03 -0.90 -1.19 116.97 121.92 2ovm h TYR 890 Ca 0.18 -0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.45 2ovm h TYR 890 Cb -0.08 -0.05 -0.00 0.00 1.55 0.00 0.00 36.73 38.15 2ovm h TYR 890 CO -0.04 0.37 -0.01 0.00 -1.32 0.00 0.00 178.16 177.16 2ovm h LEU 892 N -0.14 0.09 -0.75 0.00 5.85 -0.78 -2.09 115.31 117.47 2ovm h LEU 892 Ca 0.02 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.68 2ovm h LEU 892 Cb 0.40 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2ovm h LEU 892 CO 0.01 0.15 0.49 0.78 -0.34 0.00 0.00 178.44 179.52 2ovm h ASN 893 N 0.02 0.82 -0.59 1.25 2.35 -1.25 0.66 115.58 118.84 2ovm h ASN 893 Ca 0.02 -0.01 0.09 0.00 -0.55 0.00 0.00 56.30 55.85 2ovm h ASN 893 Cb 0.08 -0.19 -0.04 0.00 0.05 0.00 0.00 38.32 38.22 2ovm h ASN 893 CO -0.00 0.58 0.40 0.74 -1.65 0.00 0.00 177.43 177.50 2ovm h THR 894 N 0.97 0.92 -0.08 2.81 2.02 -1.11 -1.54 112.91 116.91 2ovm h THR 894 Ca 0.29 -0.15 -0.21 0.00 0.77 0.00 0.00 66.41 67.11 2ovm h THR 894 Cb -0.05 0.43 0.01 0.00 -1.74 0.00 0.00 68.15 66.81 2ovm h THR 894 CO -0.09 0.08 -0.77 0.15 0.37 0.00 0.00 175.52 175.26 2ovm h PHE 895 N 0.45 0.92 -0.58 3.16 3.57 -0.26 -2.86 116.94 121.34 2ovm h PHE 895 Ca 0.27 -0.45 0.04 0.00 3.53 0.00 0.00 57.97 61.37 2ovm h PHE 895 Cb 0.48 -0.13 -0.05 0.00 2.79 0.00 0.00 35.95 39.04 2ovm h PHE 895 CO -0.00 1.27 0.33 0.82 -2.23 0.00 0.00 178.31 178.49 2ovm h ILE 896 N 0.32 0.99 0.00 1.41 2.04 -0.06 -2.26 117.51 119.94 2ovm h ILE 896 Ca -0.07 -0.21 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 2ovm h ILE 896 Cb 1.42 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2ovm h ILE 896 CO 0.16 0.11 -0.24 1.56 0.00 0.00 0.00 178.15 179.74 2ovm h GLN 897 N 0.62 0.00 -0.67 2.37 4.20 -1.36 -3.00 115.11 117.27 2ovm h GLN 897 Ca 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.95 2ovm h GLN 897 Cb 0.12 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2ovm h GLN 897 CO -0.15 0.24 0.39 0.66 -0.67 0.00 0.00 178.83 179.30 2ovm h SER 898 N 0.00 0.81 -3.72 1.46 4.64 -1.16 -3.37 113.55 112.21 2ovm h SER 898 Ca -0.00 -0.05 -0.67 0.00 -0.47 0.00 0.00 61.79 60.60 2ovm h SER 898 Cb 0.61 -0.21 -0.37 0.00 -0.31 0.00 0.00 62.40 62.12 2ovm h SER 898 CO 0.03 0.64 -0.72 0.00 -0.87 0.00 0.00 176.83 175.91 2ovm s ARG 899 N -5.66 1.89 -0.38 4.77 3.03 -1.13 -5.13 118.95 116.33 2ovm s ARG 899 Ca -0.10 -1.64 0.06 0.00 2.03 0.00 0.00 55.73 56.07 2ovm s ARG 899 Cb 0.17 -3.17 0.17 0.00 -1.03 0.00 0.00 34.95 31.09 2ovm s ARG 899 CO 0.78 -0.81 0.51 0.00 -1.13 0.00 0.00 175.30 174.65 2ovm s ALA 900 N 1.04 -1.46 0.00 7.88 0.00 -1.26 -4.92 121.76 123.03 2ovm s ALA 900 Ca 0.03 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.70 2ovm s ALA 900 Cb -0.20 -2.40 0.00 0.00 0.00 0.00 0.00 23.12 20.52 2ovm s ALA 900 CO -0.06 -2.15 0.00 -1.33 0.00 0.00 0.00 175.76 172.22 2ovm n MET 909 N 4.41 0.00 0.07 0.00 2.81 -1.26 -5.18 117.12 117.98 2ovm n MET 909 Ca 0.10 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 55.97 2ovm n MET 909 Cb 0.51 0.00 -0.06 0.00 -0.71 0.00 0.00 33.22 32.96 2ovm n MET 909 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2ovm h SER 910 N 0.12 0.00 0.59 7.83 0.87 -2.06 -3.02 113.55 117.88 2ovm h SER 910 Ca 0.00 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.33 2ovm h SER 910 Cb 0.00 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 61.96 2ovm h SER 910 CO 0.00 0.74 -1.04 1.05 -0.53 0.00 0.00 176.83 177.05 2ovm h GLU 911 N 0.00 0.25 -0.09 2.24 4.11 -2.06 -2.65 114.58 116.38 2ovm h GLU 911 Ca -0.07 -0.34 -0.12 0.00 0.07 0.00 0.00 59.36 58.89 2ovm h GLU 911 Cb 1.63 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.98 2ovm h GLU 911 CO 0.08 1.09 -0.48 0.28 0.07 0.00 0.00 179.01 180.05 2ovm h VAL 912 N 0.11 1.34 0.00 -1.06 2.07 -2.01 -2.70 116.25 114.00 2ovm h VAL 912 Ca -0.08 -1.70 0.00 0.00 0.82 0.00 0.00 66.70 65.74 2ovm h VAL 912 Cb 1.73 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.31 2ovm h VAL 912 CO 0.17 0.50 0.00 0.40 0.02 0.00 0.00 177.57 178.66 2ovm h ILE 913 N 0.17 0.00 0.00 4.57 2.04 -1.51 -3.15 117.51 119.63 2ovm h ILE 913 Ca 0.01 -0.75 -0.08 0.00 1.00 0.00 0.00 64.86 65.04 2ovm h ILE 913 Cb 0.92 1.74 -0.01 0.00 -0.74 0.00 0.00 36.82 38.73 2ovm h ILE 913 CO 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 178.15 177.85 2ovm h ALA 914 N 2.24 0.76 -0.01 1.87 0.00 -1.13 -3.04 119.26 119.96 2ovm h ALA 914 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2ovm h ALA 914 Cb 0.87 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2ovm h ALA 914 CO 0.00 0.47 -0.65 0.00 0.00 0.00 0.00 179.25 179.07 2ovm n ALA 915 N -2.20 3.95 -0.09 0.00 0.00 -1.18 -4.30 120.51 116.70 2ovm n ALA 915 Ca 0.02 -0.58 -0.10 0.00 0.00 0.00 0.00 53.44 52.78 2ovm n ALA 915 Cb 0.68 -0.85 -0.15 0.00 0.00 0.00 0.00 19.45 19.13 2ovm n ALA 915 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ovm n GLN 916 N -0.74 0.68 -0.12 0.00 1.13 -1.19 -4.40 117.38 112.74 2ovm n GLN 916 Ca 0.07 0.05 0.11 0.00 -1.94 0.00 0.00 57.00 55.29 2ovm n GLN 916 Cb 0.40 -1.56 0.46 0.00 0.11 0.00 0.00 30.24 29.64 2ovm n GLN 916 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2ovm h LEU 917 N 0.00 0.46 0.00 1.08 3.38 -1.72 0.07 115.31 118.58 2ovm h LEU 917 Ca -0.51 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2ovm h LEU 917 Cb 2.19 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.86 2ovm h LEU 917 CO 0.03 0.28 0.00 -0.81 0.09 0.00 0.00 178.44 178.03 2ovm n PRO 918 N -4.48 0.53 -0.00 1.13 -0.04 -1.26 0.26 135.00 131.13 2ovm n PRO 918 Ca 0.10 0.01 0.04 0.00 -0.04 0.00 0.00 63.50 63.61 2ovm n PRO 918 Cb 0.34 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.24 2ovm n PRO 918 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2ovm n LYS 919 N -1.01 1.55 0.00 0.54 5.02 -0.01 -4.58 118.16 119.67 2ovm n LYS 919 Ca 0.13 -0.05 0.03 0.00 -2.02 0.00 0.00 58.31 56.40 2ovm n LYS 919 Cb 0.06 -1.09 -0.04 0.00 -0.02 0.00 0.00 35.03 33.94 2ovm n LYS 919 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2ovm n ILE 920 N -1.60 0.00 -4.19 -0.18 -5.35 -0.79 -4.39 119.36 102.86 2ovm n ILE 920 Ca -0.01 -0.34 -0.28 0.00 -0.27 0.00 0.00 62.75 61.85 2ovm n ILE 920 Cb 0.18 1.01 -0.08 0.00 -1.74 0.00 0.00 39.64 39.01 2ovm n ILE 920 CO 0.00 0.00 0.00 -0.22 -1.76 0.00 0.00 176.55 174.57 2ovm s LEU 921 N -2.25 3.28 0.32 7.28 2.96 0.14 -4.87 118.68 125.54 2ovm s LEU 921 Ca 0.03 -0.35 -0.12 0.00 -0.22 0.00 0.00 54.13 53.47 2ovm s LEU 921 Cb 0.05 -1.98 -0.08 0.00 0.50 0.00 0.00 46.19 44.69 2ovm s LEU 921 CO 0.28 0.13 0.69 0.00 -1.32 0.00 0.00 176.35 176.12 2ovm s ALA 922 N -1.52 3.41 0.00 5.97 0.00 -1.26 -4.37 121.76 123.98 2ovm s ALA 922 Ca 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.07 2ovm s ALA 922 Cb -0.10 -2.64 0.00 0.00 0.00 0.00 0.00 23.12 20.38 2ovm s ALA 922 CO 0.17 0.27 0.00 0.41 0.00 0.00 0.00 175.76 176.61 2ovm n GLY 923 N -0.63 0.75 0.03 0.00 0.00 -1.26 -4.95 105.19 99.15 2ovm n GLY 923 Ca 0.02 -0.09 -0.04 0.00 0.00 0.00 0.00 46.02 45.91 2ovm n GLY 923 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ovm n MET 924 N -2.47 1.97 -4.64 1.61 2.81 -1.26 -5.05 117.12 110.09 2ovm n MET 924 Ca 0.00 0.01 -0.32 0.00 -1.81 0.00 0.00 57.70 55.58 2ovm n MET 924 Cb 0.00 -1.16 -0.06 0.00 -0.71 0.00 0.00 33.22 31.29 2ovm n MET 924 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2ovm n VAL 925 N -2.41 0.00 -3.96 2.03 0.24 -1.26 -4.38 118.33 108.58 2ovm n VAL 925 Ca -0.12 -2.40 -0.31 0.00 -2.04 0.00 0.00 64.34 59.48 2ovm n VAL 925 Cb 0.68 0.45 -0.15 0.00 -1.47 0.00 0.00 33.84 33.35 2ovm n VAL 925 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2ovm s LYS 926 N -3.88 1.69 0.21 7.34 2.20 -0.09 -4.75 119.74 122.47 2ovm s LYS 926 Ca 0.02 -1.14 -0.30 0.00 -0.36 0.00 0.00 55.97 54.19 2ovm s LYS 926 Cb -0.00 -2.67 -0.08 0.00 -1.51 0.00 0.00 37.83 33.56 2ovm s LYS 926 CO 0.01 -0.64 0.98 -2.14 -0.36 0.00 0.00 175.35 173.20 2ovm s PRO 927 N 1.30 4.78 -0.66 4.03 0.02 -1.26 -2.01 135.00 141.21 2ovm s PRO 927 Ca -0.04 1.54 -0.16 0.00 0.02 0.00 0.00 61.00 62.35 2ovm s PRO 927 Cb -0.19 -3.29 0.15 0.00 0.02 0.00 0.00 34.50 31.19 2ovm s PRO 927 CO -0.07 0.38 0.66 -0.51 -0.33 0.00 0.00 177.00 177.13 2ovm s LEU 928 N -0.90 6.12 0.20 -5.54 1.43 0.58 -4.99 118.68 115.58 2ovm s LEU 928 Ca 0.43 -1.99 -0.24 0.00 -1.03 0.00 0.00 54.13 51.31 2ovm s LEU 928 Cb -0.26 -2.24 -0.08 0.00 0.03 0.00 0.00 46.19 43.63 2ovm s LEU 928 CO 0.33 -0.85 0.78 -0.76 0.23 0.00 0.00 176.35 176.09 2ovm s LEU 929 N 1.49 4.51 0.32 1.79 1.43 -1.26 -4.93 118.68 122.02 2ovm s LEU 929 Ca 0.11 1.61 0.20 0.00 -1.03 0.00 0.00 54.13 55.02 2ovm s LEU 929 Cb -0.22 -3.45 0.15 0.00 0.03 0.00 0.00 46.19 42.71 2ovm s LEU 929 CO -0.00 0.14 1.41 -0.26 0.23 0.00 0.00 176.35 177.86 2ovm h PHE 930 N 3.97 0.00 -4.12 0.29 -1.00 -1.97 -3.45 116.94 110.66 2ovm h PHE 930 Ca -0.47 0.00 -0.47 0.00 2.81 0.00 0.00 57.97 59.84 2ovm h PHE 930 Cb 1.20 0.00 -0.29 0.00 3.61 0.00 0.00 35.95 40.47 2ovm h PHE 930 CO 0.64 0.23 -0.81 -1.01 -1.61 0.00 0.00 178.31 175.75 2ovm s HIS 931 N -3.12 1.20 -2.00 -0.55 3.76 -1.26 -5.08 115.29 108.24 2ovm s HIS 931 Ca 0.04 -0.25 0.20 0.00 -0.15 0.00 0.00 55.06 54.91 2ovm s HIS 931 Cb 0.07 -0.79 1.20 0.00 1.11 0.00 0.00 32.58 34.17 2ovm s HIS 931 CO 0.73 -0.04 1.59 0.36 -0.85 0.00 0.00 174.74 176.52