#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q7l h ILE 672 N 0.00 0.76 0.10 0.52 1.08 -2.05 0.11 117.51 118.03 2q7l h ILE 672 Ca 0.00 -0.09 -0.00 0.00 -0.39 0.00 0.00 64.86 64.38 2q7l h ILE 672 Cb 0.00 0.48 0.00 0.00 -3.07 0.00 0.00 36.82 34.24 2q7l h ILE 672 CO 0.00 0.05 -0.05 0.15 -0.69 0.00 0.00 178.15 177.61 2q7l h PHE 673 N 0.25 -0.13 -0.61 1.37 3.57 -2.03 -2.27 116.94 117.09 2q7l h PHE 673 Ca 0.23 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.69 2q7l h PHE 673 Cb 0.29 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2q7l h PHE 673 CO -0.21 0.15 0.21 -0.07 -2.23 0.00 0.00 178.31 176.17 2q7l h LEU 674 N -0.41 0.85 -0.59 0.59 3.38 -1.95 -1.47 115.31 115.71 2q7l h LEU 674 Ca -0.01 -0.13 0.10 0.00 0.09 0.00 0.00 57.88 57.93 2q7l h LEU 674 Cb 0.34 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.79 2q7l h LEU 674 CO 0.02 0.78 0.17 0.78 0.09 0.00 0.00 178.44 180.28 2q7l h ASN 675 N 0.89 0.10 0.21 -0.43 2.35 -0.88 -1.14 115.58 116.67 2q7l h ASN 675 Ca 0.20 0.09 -0.01 0.00 -0.55 0.00 0.00 56.30 56.04 2q7l h ASN 675 Cb 0.23 0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2q7l h ASN 675 CO -0.01 0.06 -0.10 0.58 -1.65 0.00 0.00 177.43 176.31 2q7l h VAL 676 N 0.32 0.88 -0.60 2.81 2.07 -0.75 -1.15 116.25 119.84 2q7l h VAL 676 Ca 0.30 -0.57 0.10 0.00 0.82 0.00 0.00 66.70 67.36 2q7l h VAL 676 Cb 0.42 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 31.32 2q7l h VAL 676 CO -0.35 0.13 0.18 -0.07 0.02 0.00 0.00 177.57 177.47 2q7l h LEU 677 N -0.57 0.11 -0.46 2.57 3.38 -1.15 -0.41 115.31 118.78 2q7l h LEU 677 Ca -0.03 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2q7l h LEU 677 Cb 0.42 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2q7l h LEU 677 CO 0.05 0.07 0.30 -0.08 0.09 0.00 0.00 178.44 178.86 2q7l h GLU 678 N 0.33 0.61 -0.89 1.13 4.57 -1.18 -2.80 114.58 116.35 2q7l h GLU 678 Ca 0.31 -0.04 0.01 0.00 -1.18 0.00 0.00 59.36 58.45 2q7l h GLU 678 Cb 0.42 -0.13 -0.04 0.00 -0.16 0.00 0.00 28.75 28.83 2q7l h GLU 678 CO -0.35 0.41 0.58 0.00 -1.18 0.00 0.00 179.01 178.47 2q7l h ALA 679 N 1.16 1.35 -0.01 2.92 0.00 0.13 -3.01 119.26 121.79 2q7l h ALA 679 Ca 0.17 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2q7l h ALA 679 Cb -0.05 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.38 2q7l h ALA 679 CO -0.03 0.60 -0.24 0.44 0.00 0.00 0.00 179.25 180.01 2q7l n ILE 680 N -4.39 0.00 -1.87 0.00 -5.35 -0.30 -4.94 119.36 102.50 2q7l n ILE 680 Ca 0.10 -0.15 -0.42 0.00 -0.27 0.00 0.00 62.75 62.01 2q7l n ILE 680 Cb 0.03 0.46 -0.03 0.00 -1.74 0.00 0.00 39.64 38.36 2q7l n ILE 680 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2q7l s GLU 681 N -2.45 4.18 0.67 6.28 2.56 -1.07 -4.78 118.70 124.09 2q7l s GLU 681 Ca 0.25 2.39 -0.17 0.00 0.00 0.00 0.00 54.97 57.44 2q7l s GLU 681 Cb 0.19 -3.74 -0.01 0.00 2.00 0.00 0.00 34.13 32.57 2q7l s GLU 681 CO 0.50 -0.80 1.06 -2.30 -0.56 0.00 0.00 175.26 173.16 2q7l n PRO 682 N 6.14 0.78 -0.04 4.30 -0.02 -1.26 -5.03 135.00 139.87 2q7l n PRO 682 Ca 0.17 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2q7l n PRO 682 Cb 0.41 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2q7l n PRO 682 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q7l n GLY 683 N 1.11 -0.27 3.73 -1.23 0.00 -1.26 -5.02 105.19 102.25 2q7l n GLY 683 Ca 0.14 -1.72 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 2q7l n GLY 683 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2q7l s VAL 684 N 0.20 3.34 -0.14 1.61 1.01 -1.26 -5.03 120.40 120.12 2q7l s VAL 684 Ca 0.00 1.08 0.02 0.00 0.00 0.00 0.00 61.98 63.09 2q7l s VAL 684 Cb 0.00 -3.69 0.01 0.00 0.00 0.00 0.00 36.38 32.70 2q7l s VAL 684 CO 0.00 0.15 -0.21 -0.69 0.00 0.00 0.00 175.10 174.35 2q7l s VAL 685 N 0.23 2.03 0.21 2.92 1.01 -1.26 -5.13 120.40 120.41 2q7l s VAL 685 Ca 0.57 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.55 2q7l s VAL 685 Cb -0.35 -1.80 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 2q7l s VAL 685 CO 0.37 0.54 0.45 0.00 0.00 0.00 0.00 175.10 176.46 2q7l h ALA 687 N 2.23 0.62 0.00 0.00 0.00 -1.90 -3.46 119.26 116.75 2q7l h ALA 687 Ca -0.47 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 53.91 2q7l h ALA 687 Cb 1.18 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.12 2q7l h ALA 687 CO 0.69 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.94 2q7l n GLY 688 N 1.31 0.61 3.75 0.00 0.00 -1.26 -4.47 105.19 105.13 2q7l n GLY 688 Ca -0.05 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.81 2q7l n GLY 688 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2q7l s HIS 689 N -2.00 3.97 -0.68 1.61 5.04 -1.26 -5.00 115.29 116.97 2q7l s HIS 689 Ca 0.00 1.88 -0.23 0.00 -1.54 0.00 0.00 55.06 55.17 2q7l s HIS 689 Cb 0.00 -2.95 0.07 0.00 0.04 0.00 0.00 32.58 29.75 2q7l s HIS 689 CO 0.00 0.47 0.99 0.34 -2.34 0.00 0.00 174.74 174.20 2q7l s ASP 690 N -1.18 6.20 0.00 9.88 3.68 -1.26 -4.87 116.67 129.13 2q7l s ASP 690 Ca 0.40 -1.04 0.27 0.00 2.13 0.00 0.00 52.55 54.31 2q7l s ASP 690 Cb -0.25 -2.43 1.16 0.00 -1.45 0.00 0.00 42.92 39.95 2q7l s ASP 690 CO 0.31 -1.44 1.87 0.59 0.13 0.00 0.00 175.17 176.63 2q7l n ASN 691 N 7.73 0.00 0.12 -0.34 3.02 -1.26 -3.18 115.26 121.35 2q7l n ASN 691 Ca -0.01 0.48 0.13 0.00 -0.03 0.00 0.00 54.58 55.15 2q7l n ASN 691 Cb 0.46 -0.49 0.42 0.00 -0.61 0.00 0.00 39.78 39.56 2q7l n ASN 691 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2q7l n ASN 692 N -1.49 0.82 -4.89 6.41 3.02 -1.26 -4.83 115.26 113.02 2q7l n ASN 692 Ca 0.07 0.60 -0.31 0.00 -0.03 0.00 0.00 54.58 54.90 2q7l n ASN 692 Cb 0.31 -0.81 -0.05 0.00 -0.61 0.00 0.00 39.78 38.62 2q7l n ASN 692 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2q7l s GLN 693 N -3.16 3.64 0.46 3.52 -1.52 -1.19 -5.07 119.66 116.34 2q7l s GLN 693 Ca 0.09 -0.05 -0.24 0.00 -1.95 0.00 0.00 55.36 53.21 2q7l s GLN 693 Cb 0.11 -2.82 -0.08 0.00 -0.22 0.00 0.00 33.01 30.00 2q7l s GLN 693 CO 0.55 0.45 1.26 -2.30 -0.25 0.00 0.00 175.29 175.00 2q7l n PRO 694 N 0.05 1.81 -1.95 2.91 -0.02 -1.26 -4.93 135.00 131.61 2q7l n PRO 694 Ca -0.02 0.65 -0.41 0.00 -2.02 0.00 0.00 63.50 61.70 2q7l n PRO 694 Cb 0.52 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.57 2q7l n PRO 694 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2q7l s ASP 695 N -0.66 6.58 0.08 2.55 1.01 -1.26 -5.03 116.67 119.94 2q7l s ASP 695 Ca 0.64 2.76 0.02 0.00 0.71 0.00 0.00 52.55 56.68 2q7l s ASP 695 Cb -0.48 -2.63 -0.03 0.00 1.01 0.00 0.00 42.92 40.78 2q7l s ASP 695 CO 0.56 -0.75 -0.07 -0.94 0.21 0.00 0.00 175.17 174.17 2q7l s SER 696 N 0.29 1.05 0.17 0.27 1.04 -1.26 -5.05 113.70 110.21 2q7l s SER 696 Ca 0.59 -0.81 -0.15 0.00 0.48 0.00 0.00 55.95 56.06 2q7l s SER 696 Cb -0.43 0.06 0.13 0.00 0.10 0.00 0.00 66.02 65.88 2q7l s SER 696 CO 0.46 -0.34 1.69 0.15 0.98 0.00 0.00 173.24 176.18 2q7l h PHE 697 N 3.63 -0.02 -0.45 5.02 3.57 -1.97 -1.97 116.94 124.75 2q7l h PHE 697 Ca -0.36 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.10 2q7l h PHE 697 Cb 1.18 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.98 2q7l h PHE 697 CO 0.62 -0.09 -0.03 0.00 -2.23 0.00 0.00 178.31 176.58 2q7l h ALA 698 N 1.38 0.61 -0.15 2.41 0.00 -1.89 -1.25 119.26 120.37 2q7l h ALA 698 Ca 0.21 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.81 2q7l h ALA 698 Cb 0.30 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2q7l h ALA 698 CO -0.35 0.43 -0.01 0.00 0.00 0.00 0.00 179.25 179.32 2q7l h ALA 699 N 0.90 0.20 -0.39 0.00 0.00 -1.86 -0.45 119.26 117.67 2q7l h ALA 699 Ca 0.13 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2q7l h ALA 699 Cb 0.54 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2q7l h ALA 699 CO 0.03 -0.08 0.26 -0.07 0.00 0.00 0.00 179.25 179.39 2q7l h LEU 700 N -0.00 0.44 -0.33 0.00 3.38 -1.28 -1.26 115.31 116.26 2q7l h LEU 700 Ca 0.04 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.81 2q7l h LEU 700 Cb 0.40 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.04 2q7l h LEU 700 CO 0.01 0.32 -0.66 -0.07 0.09 0.00 0.00 178.44 178.13 2q7l h LEU 701 N 0.53 0.77 -1.21 1.67 -0.00 -1.21 -0.62 115.31 115.24 2q7l h LEU 701 Ca 0.14 -0.46 -0.02 0.00 -0.00 0.00 0.00 57.88 57.55 2q7l h LEU 701 Cb -0.06 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.35 2q7l h LEU 701 CO -0.03 1.23 0.32 0.28 -0.00 0.00 0.00 178.44 180.23 2q7l h SER 702 N 0.49 0.77 -0.32 -0.43 0.02 -0.98 -0.41 113.55 112.68 2q7l h SER 702 Ca -0.02 -0.07 -0.12 0.00 -0.84 0.00 0.00 61.79 60.74 2q7l h SER 702 Cb 1.25 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 2q7l h SER 702 CO 0.13 0.64 -0.27 0.28 -1.14 0.00 0.00 176.83 176.47 2q7l h SER 703 N 0.87 0.80 -0.95 3.07 0.02 -1.04 -2.00 113.55 114.30 2q7l h SER 703 Ca 0.22 -0.45 0.02 0.00 -0.84 0.00 0.00 61.79 60.73 2q7l h SER 703 Cb 0.06 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.33 2q7l h SER 703 CO -0.03 1.09 0.63 -0.07 -1.14 0.00 0.00 176.83 177.30 2q7l h LEU 704 N 0.52 1.07 -0.55 5.07 3.38 -0.76 -0.20 115.31 123.84 2q7l h LEU 704 Ca 0.06 -0.02 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 2q7l h LEU 704 Cb 0.84 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 2q7l h LEU 704 CO 0.07 0.76 -0.07 0.78 0.09 0.00 0.00 178.44 180.07 2q7l h ASN 705 N 1.26 1.02 -0.48 -0.43 2.35 -1.01 -0.42 115.58 117.87 2q7l h ASN 705 Ca 0.36 -0.34 -0.07 0.00 -0.55 0.00 0.00 56.30 55.70 2q7l h ASN 705 Cb -0.10 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 37.98 2q7l h ASN 705 CO -0.09 1.12 0.02 -0.08 -1.65 0.00 0.00 177.43 176.75 2q7l h GLU 706 N 0.91 0.84 -0.81 0.81 4.57 -1.14 -1.99 114.58 117.77 2q7l h GLU 706 Ca 0.15 -0.26 0.03 0.00 -1.18 0.00 0.00 59.36 58.10 2q7l h GLU 706 Cb 0.64 -0.08 -0.05 0.00 -0.16 0.00 0.00 28.75 29.10 2q7l h GLU 706 CO 0.04 0.87 0.52 1.25 -1.18 0.00 0.00 179.01 180.51 2q7l h LEU 707 N 0.70 0.86 -0.73 1.64 5.85 -0.78 -0.71 115.31 122.14 2q7l h LEU 707 Ca 0.14 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.92 2q7l h LEU 707 Cb 0.48 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.26 2q7l h LEU 707 CO 0.02 0.59 0.41 1.23 -0.34 0.00 0.00 178.44 180.35 2q7l h GLY 708 N 1.01 1.09 0.93 3.75 0.00 -0.74 0.13 103.07 109.23 2q7l h GLY 708 Ca 0.32 -0.28 -0.04 0.00 0.00 0.00 0.00 47.33 47.33 2q7l h GLY 708 CO -0.11 0.15 0.07 -2.09 0.00 0.00 0.00 176.54 174.56 2q7l h GLU 709 N 0.73 0.63 -0.55 4.80 4.57 -0.60 -0.23 114.58 123.93 2q7l h GLU 709 Ca 0.33 -0.16 -0.04 0.00 -1.18 0.00 0.00 59.36 58.31 2q7l h GLU 709 Cb 0.24 -0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 2q7l h GLU 709 CO -0.20 0.68 0.20 0.00 -1.18 0.00 0.00 179.01 178.51 2q7l h ARG 710 N 0.48 0.83 -0.10 1.92 3.08 -0.71 -2.77 114.38 117.11 2q7l h ARG 710 Ca 0.12 -0.16 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 2q7l h ARG 710 Cb 0.35 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 2q7l h ARG 710 CO 0.01 0.73 -0.50 1.96 -1.07 0.00 0.00 179.97 181.10 2q7l h GLN 711 N 0.75 0.26 -0.71 0.04 4.20 -0.61 -2.93 115.11 116.11 2q7l h GLN 711 Ca 0.18 -0.15 0.05 0.00 0.06 0.00 0.00 58.65 58.79 2q7l h GLN 711 Cb 0.22 0.01 -0.05 0.00 0.30 0.00 0.00 27.48 27.96 2q7l h GLN 711 CO -0.01 0.70 0.43 -0.07 -0.67 0.00 0.00 178.83 179.20 2q7l h LEU 712 N 0.21 0.67 -0.49 1.46 3.38 -0.77 0.13 115.31 119.89 2q7l h LEU 712 Ca 0.01 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.04 2q7l h LEU 712 Cb 0.95 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 2q7l h LEU 712 CO 0.08 0.44 0.25 0.58 0.09 0.00 0.00 178.44 179.88 2q7l h VAL 713 N 0.80 0.96 -0.38 1.22 2.07 -1.32 -1.45 116.25 118.15 2q7l h VAL 713 Ca 0.30 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.56 2q7l h VAL 713 Cb 0.12 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 2q7l h VAL 713 CO -0.15 0.09 -0.16 0.45 0.02 0.00 0.00 177.57 177.82 2q7l h HIS 714 N 0.49 0.78 -0.84 1.57 3.86 -1.27 -2.88 115.15 116.85 2q7l h HIS 714 Ca 0.22 -0.15 -0.02 0.00 -1.16 0.00 0.00 60.37 59.25 2q7l h HIS 714 Cb 0.12 -0.20 -0.04 0.00 1.06 0.00 0.00 27.41 28.36 2q7l h HIS 714 CO -0.10 0.82 0.45 0.28 0.86 0.00 0.00 177.93 180.23 2q7l h VAL 715 N 0.63 1.25 -0.06 2.45 2.07 -0.30 -0.69 116.25 121.60 2q7l h VAL 715 Ca 0.10 -0.64 -0.00 0.00 0.82 0.00 0.00 66.70 66.98 2q7l h VAL 715 Cb 0.62 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.52 2q7l h VAL 715 CO 0.04 0.29 0.02 0.58 0.02 0.00 0.00 177.57 178.52 2q7l h VAL 716 N 1.18 1.16 -0.83 2.57 2.07 -1.19 0.12 116.25 121.34 2q7l h VAL 716 Ca 0.30 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.32 2q7l h VAL 716 Cb 0.05 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.16 2q7l h VAL 716 CO -0.05 0.13 0.48 0.11 0.02 0.00 0.00 177.57 178.27 2q7l h LYS 717 N -0.09 1.13 0.59 1.57 1.57 -1.41 -1.71 116.57 118.22 2q7l h LYS 717 Ca 0.02 -0.11 -0.03 0.00 -1.87 0.00 0.00 60.65 58.66 2q7l h LYS 717 Cb 0.20 -0.23 0.01 0.00 0.08 0.00 0.00 32.23 32.28 2q7l h LYS 717 CO -0.00 0.81 -0.28 2.35 -0.57 0.00 0.00 179.45 181.76 2q7l h TRP 718 N 1.14 -0.73 -0.63 -1.35 7.01 -1.05 -3.19 115.95 117.15 2q7l h TRP 718 Ca 0.29 -0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.37 2q7l h TRP 718 Cb -0.02 0.24 -0.07 0.00 -2.10 0.00 0.00 29.16 27.21 2q7l h TRP 718 CO -0.00 -0.43 0.25 0.00 -2.79 0.00 0.00 178.44 175.47 2q7l h ALA 719 N -0.44 0.83 -0.22 2.65 0.00 -0.55 -1.32 119.26 120.21 2q7l h ALA 719 Ca -0.08 0.08 0.06 0.00 0.00 0.00 0.00 54.91 54.97 2q7l h ALA 719 Cb 0.62 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 2q7l h ALA 719 CO 0.13 -0.16 0.19 0.87 0.00 0.00 0.00 179.25 180.28 2q7l h LYS 720 N 0.45 0.00 -0.01 0.00 1.57 -1.37 -1.41 116.57 115.80 2q7l h LYS 720 Ca 0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 2q7l h LYS 720 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 2q7l h LYS 720 CO -0.30 0.00 -0.22 0.00 -0.57 0.00 0.00 179.45 178.36 2q7l n ALA 721 N -2.44 3.01 -1.96 3.86 0.00 -0.51 -4.68 120.51 117.78 2q7l n ALA 721 Ca 0.02 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.58 2q7l n ALA 721 Cb 0.33 -1.06 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 2q7l n ALA 721 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2q7l s LEU 722 N -2.35 4.45 -0.01 0.00 1.43 -0.53 -4.94 118.68 116.73 2q7l s LEU 722 Ca 0.27 2.37 -0.37 0.00 -1.03 0.00 0.00 54.13 55.36 2q7l s LEU 722 Cb 0.19 -3.62 -0.16 0.00 0.03 0.00 0.00 46.19 42.64 2q7l s LEU 722 CO 0.47 -0.43 1.49 -2.65 0.23 0.00 0.00 176.35 175.46 2q7l n PRO 723 N 2.15 1.29 -0.36 1.29 -0.02 -1.26 -1.99 135.00 136.10 2q7l n PRO 723 Ca 0.04 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 2q7l n PRO 723 Cb 0.43 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 2q7l n PRO 723 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2q7l n GLY 724 N 3.11 2.00 0.33 -1.23 0.00 -1.26 -4.91 105.19 103.24 2q7l n GLY 724 Ca 0.20 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.18 2q7l n GLY 724 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2q7l h PHE 725 N 0.00 1.10 0.00 1.61 3.57 -1.68 -2.52 116.94 119.02 2q7l h PHE 725 Ca 0.00 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.43 2q7l h PHE 725 Cb 0.00 -0.33 0.00 0.00 2.79 0.00 0.00 35.95 38.41 2q7l h PHE 725 CO 0.00 0.83 0.00 0.54 -2.23 0.00 0.00 178.31 177.45 2q7l n ARG 726 N -4.29 0.07 0.09 1.11 1.74 -1.26 -2.01 116.66 112.11 2q7l n ARG 726 Ca 0.07 0.25 0.13 0.00 -0.77 0.00 0.00 57.85 57.53 2q7l n ARG 726 Cb 0.17 -1.62 0.44 0.00 -1.02 0.00 0.00 32.46 30.43 2q7l n ARG 726 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2q7l n ASN 727 N -1.74 0.69 -4.76 0.55 2.85 -0.95 -4.80 115.26 107.10 2q7l n ASN 727 Ca 0.04 0.57 -0.35 0.00 -0.11 0.00 0.00 54.58 54.72 2q7l n ASN 727 Cb 0.23 -0.75 0.02 0.00 1.24 0.00 0.00 39.78 40.52 2q7l n ASN 727 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2q7l s LEU 728 N -4.30 3.68 0.29 1.20 1.43 -0.85 -4.97 118.68 115.16 2q7l s LEU 728 Ca 0.11 2.29 -0.30 0.00 -1.03 0.00 0.00 54.13 55.20 2q7l s LEU 728 Cb 0.13 -4.59 -0.13 0.00 0.03 0.00 0.00 46.19 41.63 2q7l s LEU 728 CO 0.58 -1.45 1.37 1.57 0.23 0.00 0.00 176.35 178.64 2q7l n HIS 729 N -1.52 2.27 -0.21 0.29 -0.00 -1.26 -4.76 115.22 110.04 2q7l n HIS 729 Ca 0.13 0.47 0.16 0.00 -0.00 0.00 0.00 57.72 58.48 2q7l n HIS 729 Cb 0.50 -2.45 0.49 0.00 -0.00 0.00 0.00 29.99 28.53 2q7l n HIS 729 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.34 176.10 2q7l h VAL 730 N 2.85 0.76 -0.10 3.57 3.04 -1.93 0.22 116.25 124.66 2q7l h VAL 730 Ca -0.46 -0.16 -0.08 0.00 -1.01 0.00 0.00 66.70 65.00 2q7l h VAL 730 Cb 1.27 0.27 -0.01 0.00 -2.01 0.00 0.00 31.29 30.81 2q7l h VAL 730 CO 0.70 0.08 -0.30 0.44 -1.01 0.00 0.00 177.57 177.48 2q7l h ASP 731 N 0.46 0.18 0.62 3.17 3.32 -1.99 -1.17 116.42 121.01 2q7l h ASP 731 Ca 0.41 -0.06 -0.24 0.00 0.02 0.00 0.00 57.03 57.17 2q7l h ASP 731 Cb 0.93 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.43 2q7l h ASP 731 CO -0.15 0.48 -1.06 0.44 -1.72 0.00 0.00 179.24 177.23 2q7l h ASP 732 N 0.16 0.34 -0.23 6.45 3.32 -1.01 -1.55 116.42 123.90 2q7l h ASP 732 Ca 0.02 -0.32 0.02 0.00 0.02 0.00 0.00 57.03 56.77 2q7l h ASP 732 Cb 0.62 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.04 2q7l h ASP 732 CO 0.04 1.19 0.08 1.56 -1.72 0.00 0.00 179.24 180.40 2q7l h GLN 733 N 0.10 0.19 -0.49 3.56 4.20 -0.83 -0.24 115.11 121.59 2q7l h GLN 733 Ca -0.08 -0.01 0.03 0.00 0.06 0.00 0.00 58.65 58.64 2q7l h GLN 733 Cb 1.76 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 29.46 2q7l h GLN 733 CO 0.17 0.12 0.28 0.52 -0.67 0.00 0.00 178.83 179.25 2q7l h MET 734 N 0.19 0.54 0.18 1.46 2.86 -1.20 -2.88 114.93 116.07 2q7l h MET 734 Ca 0.10 -0.03 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 2q7l h MET 734 Cb 0.06 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.60 2q7l h MET 734 CO -0.10 0.35 -0.09 0.00 1.06 0.00 0.00 176.91 178.14 2q7l h ALA 735 N 1.23 -0.24 -0.62 6.32 0.00 -0.85 -1.89 119.26 123.21 2q7l h ALA 735 Ca 0.20 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 2q7l h ALA 735 Cb 0.05 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2q7l h ALA 735 CO -0.11 -0.59 0.17 -0.39 0.00 0.00 0.00 179.25 178.33 2q7l h VAL 736 N -0.33 1.24 -0.49 0.00 -1.51 -1.06 -1.17 116.25 112.92 2q7l h VAL 736 Ca -0.02 -0.84 -0.03 0.00 -1.23 0.00 0.00 66.70 64.57 2q7l h VAL 736 Cb 0.26 0.58 -0.02 0.00 -2.13 0.00 0.00 31.29 29.98 2q7l h VAL 736 CO 0.04 0.32 0.20 0.40 -1.23 0.00 0.00 177.57 177.30 2q7l h ILE 737 N 0.92 1.21 0.00 7.19 2.04 -1.45 0.15 117.51 127.56 2q7l h ILE 737 Ca 0.20 -0.64 -0.01 0.00 1.00 0.00 0.00 64.86 65.41 2q7l h ILE 737 Cb 0.29 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 2q7l h ILE 737 CO -0.00 0.24 -0.07 1.56 0.00 0.00 0.00 178.15 179.88 2q7l h GLN 738 N 0.65 0.00 0.00 2.37 4.20 -0.68 -2.77 115.11 118.89 2q7l h GLN 738 Ca 0.16 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.52 2q7l h GLN 738 Cb 0.18 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.90 2q7l h GLN 738 CO -0.01 0.07 -2.23 0.66 -0.67 0.00 0.00 178.83 176.65 2q7l n TYR 739 N -3.17 0.28 0.78 2.96 4.01 -0.50 -4.61 117.16 116.91 2q7l n TYR 739 Ca 0.01 0.09 0.12 0.00 -0.16 0.00 0.00 57.90 57.96 2q7l n TYR 739 Cb 0.40 -1.05 0.12 0.00 -0.31 0.00 0.00 39.34 38.50 2q7l n TYR 739 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2q7l n SER 740 N -2.90 0.62 -0.26 7.72 3.41 0.03 -4.54 113.62 117.71 2q7l n SER 740 Ca -0.31 -0.26 -0.02 0.00 -0.26 0.00 0.00 58.87 58.02 2q7l n SER 740 Cb 1.11 0.51 0.10 0.00 -0.26 0.00 0.00 64.21 65.67 2q7l n SER 740 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2q7l h TRP 741 N 0.00 0.81 -0.05 7.33 5.08 -1.70 -1.28 115.95 126.14 2q7l h TRP 741 Ca 0.00 0.02 0.01 0.00 1.08 0.00 0.00 58.89 60.01 2q7l h TRP 741 Cb 0.62 -0.26 -0.01 0.00 -3.00 0.00 0.00 29.16 26.51 2q7l h TRP 741 CO 0.00 0.43 -0.02 1.98 -1.28 0.00 0.00 178.44 179.55 2q7l h MET 742 N 0.82 -0.01 -0.42 0.12 4.05 -1.89 -0.06 114.93 117.55 2q7l h MET 742 Ca 0.31 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.72 2q7l h MET 742 Cb 0.11 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.89 2q7l h MET 742 CO -0.15 -0.01 0.24 0.78 0.23 0.00 0.00 176.91 178.00 2q7l h GLY 743 N -0.01 0.61 0.62 1.39 0.00 -1.76 0.51 103.07 104.43 2q7l h GLY 743 Ca 0.03 -0.27 0.06 0.00 0.00 0.00 0.00 47.33 47.15 2q7l h GLY 743 CO -0.06 0.26 0.26 1.41 0.00 0.00 0.00 176.54 178.41 2q7l h LEU 744 N 0.54 0.34 -0.13 3.11 3.38 -1.02 -1.33 115.31 120.20 2q7l h LEU 744 Ca 0.15 0.04 -0.24 0.00 0.09 0.00 0.00 57.88 57.93 2q7l h LEU 744 Cb 0.03 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.77 2q7l h LEU 744 CO -0.03 0.23 -0.91 0.24 0.09 0.00 0.00 178.44 178.07 2q7l h MET 745 N 0.49 0.63 -0.36 1.13 2.86 -0.64 -2.04 114.93 117.00 2q7l h MET 745 Ca 0.26 -0.61 -0.01 0.00 -2.06 0.00 0.00 59.70 57.27 2q7l h MET 745 Cb 0.21 0.15 -0.02 0.00 0.06 0.00 0.00 31.60 32.01 2q7l h MET 745 CO -0.20 1.22 0.17 0.28 1.06 0.00 0.00 176.91 179.43 2q7l h VAL 746 N 0.39 1.17 -0.25 -2.22 2.07 -0.82 -0.84 116.25 115.75 2q7l h VAL 746 Ca -0.08 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2q7l h VAL 746 Cb 1.54 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 2q7l h VAL 746 CO 0.17 0.18 0.17 0.15 0.02 0.00 0.00 177.57 178.26 2q7l h PHE 747 N 0.44 0.32 -0.69 1.57 3.57 -1.19 0.25 116.94 121.21 2q7l h PHE 747 Ca 0.12 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 2q7l h PHE 747 Cb 0.13 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.73 2q7l h PHE 747 CO -0.01 0.20 0.25 0.00 -2.23 0.00 0.00 178.31 176.52 2q7l h ALA 748 N 1.09 1.14 -0.41 2.41 0.00 -1.28 -1.45 119.26 120.75 2q7l h ALA 748 Ca 0.09 -0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2q7l h ALA 748 Cb -0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2q7l h ALA 748 CO -0.02 0.61 -0.15 1.98 0.00 0.00 0.00 179.25 181.67 2q7l h MET 749 N 1.00 0.83 -0.76 0.00 1.85 -0.78 -0.67 114.93 116.40 2q7l h MET 749 Ca 0.23 -0.34 0.12 0.00 -0.61 0.00 0.00 59.70 59.09 2q7l h MET 749 Cb 0.24 -0.03 -0.08 0.00 0.43 0.00 0.00 31.60 32.15 2q7l h MET 749 CO -0.01 0.97 0.37 0.78 -0.40 0.00 0.00 176.91 178.62 2q7l h GLY 750 N 0.64 1.18 0.72 1.39 0.00 -0.66 0.09 103.07 106.43 2q7l h GLY 750 Ca 0.10 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 2q7l h GLY 750 CO 0.05 0.01 -0.02 -0.25 0.00 0.00 0.00 176.54 176.33 2q7l h TRP 751 N 0.60 -0.05 -0.76 5.60 2.91 -0.89 -1.34 115.95 122.01 2q7l h TRP 751 Ca 0.39 -0.00 0.14 0.00 1.13 0.00 0.00 58.89 60.55 2q7l h TRP 751 Cb 0.48 0.02 -0.09 0.00 -0.51 0.00 0.00 29.16 29.06 2q7l h TRP 751 CO -0.11 0.23 0.32 0.00 -1.03 0.00 0.00 178.44 177.85 2q7l h ARG 752 N -0.34 0.46 -0.67 2.65 3.08 -0.92 0.98 114.38 119.61 2q7l h ARG 752 Ca -0.01 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 2q7l h ARG 752 Cb 0.31 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 2q7l h ARG 752 CO 0.01 0.30 0.33 0.77 -1.07 0.00 0.00 179.97 180.32 2q7l h SER 753 N 0.47 0.87 0.16 7.04 0.02 -0.79 0.17 113.55 121.49 2q7l h SER 753 Ca 0.42 -0.12 -0.01 0.00 -0.84 0.00 0.00 61.79 61.23 2q7l h SER 753 Cb 0.62 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.93 2q7l h SER 753 CO -0.39 0.75 -0.08 0.15 -1.14 0.00 0.00 176.83 176.12 2q7l h PHE 754 N 0.93 -0.21 0.00 3.45 3.57 -0.53 -0.00 116.94 124.15 2q7l h PHE 754 Ca 0.23 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 2q7l h PHE 754 Cb 0.10 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 2q7l h PHE 754 CO 0.00 0.06 -0.55 1.79 -2.23 0.00 0.00 178.31 177.38 2q7l h THR 755 N -0.45 1.26 0.01 4.41 1.35 -0.68 -2.47 112.91 116.34 2q7l h THR 755 Ca -0.02 -1.96 -0.36 0.00 -0.55 0.00 0.00 66.41 63.52 2q7l h THR 755 Cb 0.35 2.09 -0.06 0.00 -1.73 0.00 0.00 68.15 68.81 2q7l h THR 755 CO 0.04 0.53 -2.26 0.59 -0.25 0.00 0.00 175.52 174.17 2q7l n ASN 756 N -3.70 0.92 -0.87 5.36 5.03 0.59 -4.68 115.26 117.92 2q7l n ASN 756 Ca -0.01 0.05 0.03 0.00 0.87 0.00 0.00 54.58 55.53 2q7l n ASN 756 Cb 0.59 0.23 0.04 0.00 -1.02 0.00 0.00 39.78 39.63 2q7l n ASN 756 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2q7l n VAL 757 N -3.02 0.41 -4.35 2.41 0.24 -0.76 -5.01 118.33 108.24 2q7l n VAL 757 Ca -0.34 -0.95 -0.34 0.00 -2.04 0.00 0.00 64.34 60.67 2q7l n VAL 757 Cb 1.08 0.55 -0.08 0.00 -1.47 0.00 0.00 33.84 33.92 2q7l n VAL 757 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2q7l n ASN 758 N -0.05 -0.14 -0.33 -1.34 5.15 -0.93 -1.38 115.26 116.24 2q7l n ASN 758 Ca 0.06 -1.24 -0.04 0.00 -0.60 0.00 0.00 54.58 52.76 2q7l n ASN 758 Cb 0.87 -1.76 -0.02 0.00 -0.53 0.00 0.00 39.78 38.35 2q7l n ASN 758 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2q7l n SER 759 N -2.76 -5.38 0.08 1.20 7.64 -0.09 -4.84 113.62 109.47 2q7l n SER 759 Ca -0.18 0.11 -0.05 0.00 1.01 0.00 0.00 58.87 59.75 2q7l n SER 759 Cb 0.62 -3.25 0.11 0.00 -1.01 0.00 0.00 64.21 60.68 2q7l n SER 759 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2q7l h ARG 760 N 0.13 0.24 -4.64 1.43 3.08 -1.46 -3.46 114.38 109.71 2q7l h ARG 760 Ca -0.09 -0.17 -0.25 0.00 0.07 0.00 0.00 59.98 59.55 2q7l h ARG 760 Cb 0.90 0.03 -0.15 0.00 0.08 0.00 0.00 29.97 30.83 2q7l h ARG 760 CO 0.13 0.78 -0.65 -1.64 -1.07 0.00 0.00 179.97 177.52 2q7l s MET 761 N -3.74 1.07 -0.43 0.04 -1.94 -1.26 -4.91 119.30 108.13 2q7l s MET 761 Ca -0.04 -1.53 -0.21 0.00 -1.71 0.00 0.00 55.69 52.21 2q7l s MET 761 Cb 0.12 -0.01 0.02 0.00 2.01 0.00 0.00 34.83 36.97 2q7l s MET 761 CO 0.80 -0.22 0.66 -0.51 -0.01 0.00 0.00 175.02 175.73 2q7l s LEU 762 N -3.13 4.45 -1.26 -0.03 1.43 -0.63 -4.77 118.68 114.74 2q7l s LEU 762 Ca 0.27 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 52.99 2q7l s LEU 762 Cb 0.07 -2.76 0.17 0.00 0.03 0.00 0.00 46.19 43.70 2q7l s LEU 762 CO 0.05 -0.77 1.71 0.00 0.23 0.00 0.00 176.35 177.57 2q7l n TYR 763 N 6.28 3.72 -0.21 0.29 9.36 -1.26 -0.65 117.16 134.69 2q7l n TYR 763 Ca -0.01 -3.00 -0.07 0.00 3.32 0.00 0.00 57.90 58.14 2q7l n TYR 763 Cb 0.48 -2.05 0.03 0.00 -0.63 0.00 0.00 39.34 37.17 2q7l n TYR 763 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 2q7l h PHE 764 N 6.28 0.83 -3.03 2.98 0.04 -1.74 -3.42 116.94 118.88 2q7l h PHE 764 Ca 0.37 -0.03 0.02 0.00 2.80 0.00 0.00 57.97 61.13 2q7l h PHE 764 Cb 0.72 -0.26 -0.09 0.00 2.20 0.00 0.00 35.95 38.52 2q7l h PHE 764 CO 1.20 0.62 0.20 0.00 -0.60 0.00 0.00 178.31 179.73 2q7l s ALA 765 N -5.78 -1.37 0.46 2.45 0.00 -0.97 -4.96 121.76 111.59 2q7l s ALA 765 Ca -0.13 0.07 0.16 0.00 0.00 0.00 0.00 51.96 52.06 2q7l s ALA 765 Cb 0.13 0.87 1.11 0.00 0.00 0.00 0.00 23.12 25.23 2q7l s ALA 765 CO 0.78 -0.89 1.99 -1.35 0.00 0.00 0.00 175.76 176.29 2q7l h PRO 766 N 2.02 0.30 -0.66 0.00 0.11 -1.89 -1.08 132.00 130.80 2q7l h PRO 766 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2q7l h PRO 766 Cb 1.28 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2q7l h PRO 766 CO 0.31 0.20 0.00 -0.40 -0.21 0.00 0.00 178.00 177.90 2q7l n ASP 767 N -4.46 4.73 -3.10 -2.05 5.75 -1.26 -4.63 116.55 111.53 2q7l n ASP 767 Ca 0.09 -2.41 -0.17 0.00 -0.01 0.00 0.00 54.79 52.30 2q7l n ASP 767 Cb 0.41 -0.57 -0.05 0.00 -1.03 0.00 0.00 41.12 39.87 2q7l n ASP 767 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2q7l n LEU 768 N 1.19 -1.83 -4.42 -2.12 7.94 -0.41 -4.42 117.00 112.94 2q7l n LEU 768 Ca 0.26 -3.72 -0.35 0.00 -1.11 0.00 0.00 56.01 51.09 2q7l n LEU 768 Cb 0.87 0.65 -0.13 0.00 0.53 0.00 0.00 43.42 45.34 2q7l n LEU 768 CO 0.23 1.90 -0.35 -0.69 -1.11 0.00 0.00 177.39 177.37 2q7l s VAL 769 N 0.41 3.76 -0.35 1.96 1.01 -1.25 -2.04 120.40 123.90 2q7l s VAL 769 Ca 0.32 -0.38 -0.18 0.00 0.00 0.00 0.00 61.98 61.74 2q7l s VAL 769 Cb 0.02 -2.69 -0.00 0.00 0.00 0.00 0.00 36.38 33.71 2q7l s VAL 769 CO -0.13 0.44 0.50 -0.36 0.00 0.00 0.00 175.10 175.54 2q7l s PHE 770 N 1.01 3.18 0.83 5.22 0.40 0.18 -4.94 117.98 123.87 2q7l s PHE 770 Ca 0.01 0.14 -0.09 0.00 -0.60 0.00 0.00 56.93 56.39 2q7l s PHE 770 Cb -0.14 -2.90 0.15 0.00 0.51 0.00 0.00 43.02 40.63 2q7l s PHE 770 CO 0.01 -0.54 1.16 0.54 0.70 0.00 0.00 175.22 177.09 2q7l s ASN 771 N 1.76 3.85 0.45 1.36 2.20 -1.26 -1.60 114.94 121.70 2q7l s ASN 771 Ca 0.18 0.09 0.11 0.00 -0.94 0.00 0.00 52.86 52.30 2q7l s ASN 771 Cb -0.16 -0.35 1.02 0.00 -2.00 0.00 0.00 41.25 39.76 2q7l s ASN 771 CO 0.13 -2.23 2.07 -0.33 -2.94 0.00 0.00 177.10 173.80 2q7l h GLU 772 N -1.07 0.34 -0.37 3.55 4.39 -1.97 -1.29 114.58 118.16 2q7l h GLU 772 Ca -0.42 -0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.25 2q7l h GLU 772 Cb 1.26 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 29.82 2q7l h GLU 772 CO 0.43 0.23 0.19 -0.92 -1.16 0.00 0.00 179.01 177.78 2q7l h TYR 773 N 0.35 0.52 -0.32 4.33 3.20 -1.99 -1.50 116.97 121.56 2q7l h TYR 773 Ca 0.14 -0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.87 2q7l h TYR 773 Cb 0.10 -0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 2q7l h TYR 773 CO -0.00 0.42 -0.28 0.00 -1.64 0.00 0.00 178.16 176.66 2q7l h ARG 774 N 0.47 0.66 -0.89 1.82 3.08 -1.78 0.90 114.38 118.65 2q7l h ARG 774 Ca 0.13 -0.28 0.09 0.00 0.07 0.00 0.00 59.98 59.98 2q7l h ARG 774 Cb 0.08 -0.02 -0.07 0.00 0.08 0.00 0.00 29.97 30.04 2q7l h ARG 774 CO -0.02 0.87 0.54 0.52 -1.07 0.00 0.00 179.97 180.81 2q7l h MET 775 N 0.57 0.90 -0.08 0.04 2.86 -1.09 0.33 114.93 118.45 2q7l h MET 775 Ca 0.07 -0.05 -0.06 0.00 -2.06 0.00 0.00 59.70 57.60 2q7l h MET 775 Cb 0.77 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.23 2q7l h MET 775 CO 0.06 0.59 -0.18 1.25 1.06 0.00 0.00 176.91 179.70 2q7l h HIS 776 N 0.92 0.34 -0.43 -0.22 -0.00 -0.87 -2.82 115.15 112.08 2q7l h HIS 776 Ca 0.42 -0.13 -0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2q7l h HIS 776 Cb 0.31 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 27.64 2q7l h HIS 776 CO -0.03 0.78 0.24 -0.22 -0.00 0.00 0.00 177.93 178.70 2q7l h LYS 777 N -0.20 0.58 0.00 5.26 1.63 -0.62 -1.96 116.57 121.27 2q7l h LYS 777 Ca 0.00 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 2q7l h LYS 777 Cb 0.77 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 32.27 2q7l h LYS 777 CO 0.04 0.42 0.00 -1.13 -3.45 0.00 0.00 179.45 175.33 2q7l n SER 778 N -4.43 0.66 -1.46 4.20 3.41 0.09 -4.18 113.62 111.90 2q7l n SER 778 Ca 0.03 0.68 -0.17 0.00 -0.26 0.00 0.00 58.87 59.15 2q7l n SER 778 Cb 0.09 -0.81 -0.06 0.00 -0.26 0.00 0.00 64.21 63.17 2q7l n SER 778 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2q7l n ARG 779 N -2.24 -1.22 -1.52 4.33 1.74 -0.74 -4.88 116.66 112.13 2q7l n ARG 779 Ca 0.02 1.03 -0.07 0.00 -0.77 0.00 0.00 57.85 58.06 2q7l n ARG 779 Cb 0.20 -5.31 0.10 0.00 -1.02 0.00 0.00 32.46 26.43 2q7l n ARG 779 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 2q7l n MET 780 N -2.54 2.22 -0.05 5.56 2.81 -1.23 -4.90 117.12 119.00 2q7l n MET 780 Ca -0.18 -3.52 -0.09 0.00 -1.81 0.00 0.00 57.70 52.10 2q7l n MET 780 Cb 0.58 -1.69 -0.02 0.00 -0.71 0.00 0.00 33.22 31.38 2q7l n MET 780 CO 0.00 0.00 0.00 -0.92 1.51 0.00 0.00 175.97 176.56 2q7l h TYR 781 N 1.65 0.16 -0.71 2.03 3.20 -1.80 0.13 116.97 121.62 2q7l h TYR 781 Ca 0.10 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.99 2q7l h TYR 781 Cb 1.35 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 39.54 2q7l h TYR 781 CO 0.70 0.08 0.47 0.66 -1.64 0.00 0.00 178.16 178.43 2q7l h SER 782 N 0.20 0.81 -0.48 -2.11 4.64 -1.90 -0.42 113.55 114.28 2q7l h SER 782 Ca 0.09 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.38 2q7l h SER 782 Cb 0.04 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 61.91 2q7l h SER 782 CO -0.08 0.59 0.26 1.56 -0.87 0.00 0.00 176.83 178.29 2q7l h GLN 783 N 0.96 0.68 -0.71 4.77 7.50 -1.87 -2.60 115.11 123.83 2q7l h GLN 783 Ca 0.26 -0.08 0.02 0.00 0.50 0.00 0.00 58.65 59.35 2q7l h GLN 783 Cb -0.10 -0.13 -0.04 0.00 0.05 0.00 0.00 27.48 27.26 2q7l h GLN 783 CO -0.06 0.53 0.46 0.00 -1.50 0.00 0.00 178.83 178.26 2q7l h VAL 785 N 0.91 1.17 -0.65 0.00 2.07 -0.98 0.30 116.25 119.07 2q7l h VAL 785 Ca 0.28 -0.37 -0.03 0.00 0.82 0.00 0.00 66.70 67.40 2q7l h VAL 785 Cb -0.04 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.02 2q7l h VAL 785 CO -0.09 0.18 0.29 0.03 0.02 0.00 0.00 177.57 178.00 2q7l h ARG 786 N 0.83 0.95 -0.46 1.57 3.08 -1.04 0.53 114.38 119.84 2q7l h ARG 786 Ca 0.22 -0.15 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2q7l h ARG 786 Cb -0.04 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.82 2q7l h ARG 786 CO -0.04 0.77 0.07 0.52 -1.07 0.00 0.00 179.97 180.22 2q7l h MET 787 N 0.91 0.71 -0.31 0.04 2.86 -0.54 0.35 114.93 118.93 2q7l h MET 787 Ca 0.22 -0.15 -0.14 0.00 -2.06 0.00 0.00 59.70 57.57 2q7l h MET 787 Cb 0.15 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 2q7l h MET 787 CO -0.02 0.67 -0.38 -0.09 1.06 0.00 0.00 176.91 178.15 2q7l h ARG 788 N 0.68 0.74 -0.17 1.72 2.43 0.04 -0.54 114.38 119.28 2q7l h ARG 788 Ca 0.15 -0.38 0.02 0.00 -0.81 0.00 0.00 59.98 58.96 2q7l h ARG 788 Cb 0.32 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2q7l h ARG 788 CO 0.00 1.00 0.05 1.25 -1.51 0.00 0.00 179.97 180.77 2q7l h HIS 789 N 0.61 0.10 -0.46 2.20 2.76 -0.45 -0.61 115.15 119.30 2q7l h HIS 789 Ca 0.05 0.01 0.09 0.00 -2.20 0.00 0.00 60.37 58.32 2q7l h HIS 789 Cb 0.93 -0.02 -0.09 0.00 1.55 0.00 0.00 27.41 29.78 2q7l h HIS 789 CO 0.05 0.05 -0.11 1.25 -1.30 0.00 0.00 177.93 177.87 2q7l h LEU 790 N 0.13 -0.42 -0.74 0.26 5.85 -0.73 -1.23 115.31 118.44 2q7l h LEU 790 Ca 0.07 0.14 0.08 0.00 0.84 0.00 0.00 57.88 59.01 2q7l h LEU 790 Cb 0.05 0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 2q7l h LEU 790 CO -0.08 -0.15 0.41 -1.28 -0.34 0.00 0.00 178.44 177.00 2q7l h SER 791 N 0.00 0.57 -0.01 1.25 0.87 -0.53 -1.60 113.55 114.11 2q7l h SER 791 Ca 0.22 0.05 -0.04 0.00 -1.23 0.00 0.00 61.79 60.79 2q7l h SER 791 Cb 0.34 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2q7l h SER 791 CO -0.47 0.34 -0.10 1.56 -0.53 0.00 0.00 176.83 177.63 2q7l h GLN 792 N 0.70 0.24 -0.24 2.24 4.20 -0.20 -2.73 115.11 119.33 2q7l h GLN 792 Ca 0.35 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 59.03 2q7l h GLN 792 Cb 0.31 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 2q7l h GLN 792 CO -0.23 0.35 0.16 0.93 -0.67 0.00 0.00 178.83 179.37 2q7l h GLU 793 N 0.23 0.25 -0.51 1.46 4.39 -0.22 0.45 114.58 120.63 2q7l h GLU 793 Ca 0.05 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 2q7l h GLU 793 Cb 0.33 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.90 2q7l h GLU 793 CO 0.02 0.16 0.22 0.74 -1.16 0.00 0.00 179.01 178.99 2q7l h PHE 794 N 0.25 0.72 0.00 4.33 0.04 -1.46 0.84 116.94 121.67 2q7l h PHE 794 Ca 0.10 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 2q7l h PHE 794 Cb 0.07 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.00 2q7l h PHE 794 CO -0.00 0.55 -0.00 0.78 -0.60 0.00 0.00 178.31 179.03 2q7l h GLY 795 N 0.85 0.00 0.86 -1.45 0.00 -1.21 -1.05 103.07 101.06 2q7l h GLY 795 Ca 0.18 -0.01 0.04 0.00 0.00 0.00 0.00 47.33 47.54 2q7l h GLY 795 CO -0.02 0.01 0.56 1.49 0.00 0.00 0.00 176.54 178.57 2q7l h TRP 796 N -0.81 1.05 -0.00 5.60 6.55 -0.85 -1.18 115.95 126.32 2q7l h TRP 796 Ca -0.00 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.87 2q7l h TRP 796 Cb 0.81 -0.35 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 2q7l h TRP 796 CO 0.21 0.59 -0.10 1.28 -1.05 0.00 0.00 178.44 179.37 2q7l n LEU 797 N -4.55 0.48 -3.95 -4.49 4.77 0.28 -4.96 117.00 104.58 2q7l n LEU 797 Ca 0.11 -0.01 -0.26 0.00 -0.03 0.00 0.00 56.01 55.83 2q7l n LEU 797 Cb 0.10 -0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2q7l n LEU 797 CO 0.34 0.09 -0.20 0.00 -1.33 0.00 0.00 177.39 176.29 2q7l n GLN 798 N -0.93 -3.48 -1.84 3.23 6.02 -0.45 -4.89 117.38 115.05 2q7l n GLN 798 Ca 0.15 0.42 -0.42 0.00 -0.01 0.00 0.00 57.00 57.14 2q7l n GLN 798 Cb 0.27 -4.65 -0.03 0.00 1.02 0.00 0.00 30.24 26.86 2q7l n GLN 798 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2q7l s ILE 799 N -3.87 2.34 0.55 5.09 -1.09 -0.44 -4.98 121.20 118.80 2q7l s ILE 799 Ca 0.08 0.25 -0.12 0.00 -2.23 0.00 0.00 60.65 58.62 2q7l s ILE 799 Cb -0.04 -3.16 -0.06 0.00 -1.58 0.00 0.00 42.46 37.62 2q7l s ILE 799 CO 0.88 0.02 0.96 0.42 -1.23 0.00 0.00 174.94 176.00 2q7l s THR 800 N 1.02 4.67 0.40 2.92 -4.23 -1.26 -4.90 115.64 114.26 2q7l s THR 800 Ca 0.71 0.91 0.13 0.00 -1.18 0.00 0.00 61.69 62.26 2q7l s THR 800 Cb -0.46 -3.80 0.34 0.00 1.34 0.00 0.00 72.50 69.91 2q7l s THR 800 CO 0.33 -0.89 1.91 -0.65 -0.54 0.00 0.00 174.62 174.78 2q7l h PRO 801 N 0.34 0.52 -0.09 3.99 0.11 -1.99 -0.15 132.00 134.73 2q7l h PRO 801 Ca -0.46 -0.03 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 2q7l h PRO 801 Cb 1.19 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 32.19 2q7l h PRO 801 CO 0.62 0.34 -0.84 1.96 -0.21 0.00 0.00 178.00 179.87 2q7l h GLN 802 N 0.53 0.63 -0.63 1.05 7.50 -2.00 -1.82 115.11 120.38 2q7l h GLN 802 Ca 0.38 -0.56 -0.02 0.00 0.50 0.00 0.00 58.65 58.95 2q7l h GLN 802 Cb 0.73 0.13 -0.03 0.00 0.05 0.00 0.00 27.48 28.37 2q7l h GLN 802 CO -0.14 1.18 0.30 0.93 -1.50 0.00 0.00 178.83 179.60 2q7l h GLU 803 N 0.41 0.91 -0.37 1.46 5.08 -1.85 -2.52 114.58 117.69 2q7l h GLU 803 Ca -0.07 -0.13 0.03 0.00 -1.00 0.00 0.00 59.36 58.19 2q7l h GLU 803 Cb 1.46 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 30.52 2q7l h GLU 803 CO 0.16 0.72 0.18 0.35 -1.00 0.00 0.00 179.01 179.43 2q7l h PHE 804 N 0.86 0.34 -0.43 4.33 3.57 -0.90 -0.82 116.94 123.89 2q7l h PHE 804 Ca 0.22 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 2q7l h PHE 804 Cb 0.12 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 2q7l h PHE 804 CO 0.00 0.18 0.26 -0.07 -2.23 0.00 0.00 178.31 176.45 2q7l h LEU 805 N 0.38 0.51 -0.42 0.59 3.38 -1.20 -0.35 115.31 118.18 2q7l h LEU 805 Ca 0.16 -0.05 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 2q7l h LEU 805 Cb 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 2q7l h LEU 805 CO -0.11 0.40 -0.32 0.00 0.09 0.00 0.00 178.44 178.50 2q7l h MET 807 N 0.80 0.56 -0.56 0.00 2.86 -0.94 -1.02 114.93 116.63 2q7l h MET 807 Ca 0.08 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.67 2q7l h MET 807 Cb 0.91 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.42 2q7l h MET 807 CO 0.08 0.39 0.33 -0.22 1.06 0.00 0.00 176.91 178.56 2q7l h LYS 808 N 0.56 0.76 -0.42 1.72 3.64 -0.99 -1.27 116.57 120.58 2q7l h LYS 808 Ca 0.15 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2q7l h LYS 808 Cb -0.03 -0.16 -0.03 0.00 -0.41 0.00 0.00 32.23 31.60 2q7l h LYS 808 CO -0.03 0.56 0.23 0.00 -2.27 0.00 0.00 179.45 177.94 2q7l h ALA 809 N 1.16 0.52 -0.40 5.00 0.00 -1.16 -1.78 119.26 122.61 2q7l h ALA 809 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2q7l h ALA 809 Cb -0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2q7l h ALA 809 CO -0.04 -0.10 0.27 1.25 0.00 0.00 0.00 179.25 180.63 2q7l h LEU 810 N 0.47 0.38 -2.32 0.00 5.85 -0.73 -1.85 115.31 117.10 2q7l h LEU 810 Ca 0.17 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2q7l h LEU 810 Cb 0.04 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 2q7l h LEU 810 CO -0.09 0.26 -0.02 -0.07 -0.34 0.00 0.00 178.44 178.18 2q7l h LEU 811 N 0.44 0.00 -1.72 2.25 3.38 -0.32 -1.30 115.31 118.04 2q7l h LEU 811 Ca 0.16 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 2q7l h LEU 811 Cb 0.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2q7l h LEU 811 CO -0.04 0.02 -0.16 0.25 0.09 0.00 0.00 178.44 178.60 2q7l h LEU 812 N 0.00 0.00 -3.48 1.67 5.85 -1.33 -3.00 115.31 115.01 2q7l h LEU 812 Ca -0.00 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.46 2q7l h LEU 812 Cb 0.04 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 40.92 2q7l h LEU 812 CO 0.00 0.16 0.02 0.49 -0.34 0.00 0.00 178.44 178.77 2q7l n PHE 813 N -3.70 1.51 -0.16 1.25 3.72 -0.50 -4.61 117.46 114.97 2q7l n PHE 813 Ca -0.02 -1.73 0.02 0.00 -0.05 0.00 0.00 57.45 55.67 2q7l n PHE 813 Cb 0.28 -0.59 0.04 0.00 -0.94 0.00 0.00 39.48 38.28 2q7l n PHE 813 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2q7l n SER 814 N -1.11 2.23 -3.62 4.37 7.64 -1.13 -4.95 113.62 117.05 2q7l n SER 814 Ca 0.39 -2.14 -0.09 0.00 1.01 0.00 0.00 58.87 58.04 2q7l n SER 814 Cb 1.11 -0.09 -0.10 0.00 -1.01 0.00 0.00 64.21 64.12 2q7l n SER 814 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2q7l s ILE 815 N -1.23 -0.60 0.09 0.44 2.07 -1.26 -0.41 121.20 120.29 2q7l s ILE 815 Ca 0.08 0.16 -0.03 0.00 -1.41 0.00 0.00 60.65 59.44 2q7l s ILE 815 Cb 0.06 -0.65 -0.03 0.00 0.13 0.00 0.00 42.46 41.97 2q7l s ILE 815 CO 0.03 0.05 0.06 0.27 -1.91 0.00 0.00 174.94 173.45 2q7l s ILE 816 N 2.57 0.16 0.32 2.00 -4.36 -1.04 -4.73 121.20 116.12 2q7l s ILE 816 Ca 0.01 -1.67 -0.29 0.00 -0.26 0.00 0.00 60.65 58.44 2q7l s ILE 816 Cb -0.12 -1.64 -0.12 0.00 1.25 0.00 0.00 42.46 41.82 2q7l s ILE 816 CO -0.12 -0.73 1.38 -2.65 0.24 0.00 0.00 174.94 173.05 2q7l n PRO 817 N -0.00 2.25 -0.27 0.37 -0.02 -1.26 -1.83 135.00 134.23 2q7l n PRO 817 Ca -0.11 0.79 0.04 0.00 -2.02 0.00 0.00 63.50 62.20 2q7l n PRO 817 Cb 0.62 -2.43 0.27 0.00 -0.02 0.00 0.00 33.50 31.93 2q7l n PRO 817 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2q7l h VAL 818 N 2.79 1.06 -0.03 -1.45 2.07 -0.87 -0.69 116.25 119.14 2q7l h VAL 818 Ca -0.47 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 66.72 2q7l h VAL 818 Cb 1.27 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 31.06 2q7l h VAL 818 CO 0.67 0.18 0.00 0.47 0.02 0.00 0.00 177.57 178.91 2q7l n ASP 819 N -4.48 0.97 -0.47 0.57 8.00 -1.26 -5.01 116.55 114.87 2q7l n ASP 819 Ca 0.13 -2.03 0.06 0.00 0.71 0.00 0.00 54.79 53.65 2q7l n ASP 819 Cb 0.19 -0.39 -0.02 0.00 -0.02 0.00 0.00 41.12 40.88 2q7l n ASP 819 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2q7l n GLY 820 N 0.15 -2.15 3.99 0.44 0.00 -0.27 -5.00 105.19 102.36 2q7l n GLY 820 Ca 0.01 -1.37 -0.23 0.00 0.00 0.00 0.00 46.02 44.43 2q7l n GLY 820 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q7l s LEU 821 N -5.64 3.01 0.11 0.99 1.43 -1.26 -4.69 118.68 112.63 2q7l s LEU 821 Ca 0.00 -0.32 -0.20 0.00 -1.03 0.00 0.00 54.13 52.58 2q7l s LEU 821 Cb 0.00 -2.10 -0.08 0.00 0.03 0.00 0.00 46.19 44.04 2q7l s LEU 821 CO 0.00 -1.75 1.73 0.11 0.23 0.00 0.00 176.35 176.67 2q7l h LYS 822 N -0.43 0.26 -3.04 1.70 6.56 -1.94 -3.33 116.57 116.35 2q7l h LYS 822 Ca -0.37 -0.02 -0.62 0.00 -1.06 0.00 0.00 60.65 58.58 2q7l h LYS 822 Cb 1.27 -0.05 -0.41 0.00 -0.57 0.00 0.00 32.23 32.47 2q7l h LYS 822 CO 0.42 0.22 -0.66 1.21 -2.06 0.00 0.00 179.45 178.58 2q7l s ASN 823 N -5.43 4.14 0.28 0.86 3.84 -1.26 -4.98 114.94 112.39 2q7l s ASN 823 Ca -0.13 -3.42 -0.03 0.00 0.21 0.00 0.00 52.86 49.48 2q7l s ASN 823 Cb 0.08 -1.40 0.37 0.00 -0.55 0.00 0.00 41.25 39.74 2q7l s ASN 823 CO 0.69 -0.15 1.93 -0.61 -2.79 0.00 0.00 177.10 176.18 2q7l h GLN 824 N 5.83 1.14 -0.89 0.43 5.75 -1.97 -2.89 115.11 122.51 2q7l h GLN 824 Ca 0.09 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.51 2q7l h GLN 824 Cb 0.82 -0.25 -0.04 0.00 1.07 0.00 0.00 27.48 29.08 2q7l h GLN 824 CO 0.64 0.79 0.59 0.87 -2.65 0.00 0.00 178.83 179.06 2q7l h LYS 825 N 1.17 1.17 -0.45 1.69 6.56 -1.94 0.11 116.57 124.88 2q7l h LYS 825 Ca 0.31 -0.07 -0.14 0.00 -1.06 0.00 0.00 60.65 59.69 2q7l h LYS 825 Cb -0.08 -0.26 -0.01 0.00 -0.57 0.00 0.00 32.23 31.31 2q7l h LYS 825 CO -0.06 0.77 -0.28 0.74 -2.06 0.00 0.00 179.45 178.57 2q7l h PHE 826 N 1.21 1.13 -0.42 -1.35 -1.00 -1.91 -1.80 116.94 112.79 2q7l h PHE 826 Ca 0.33 -0.30 -0.01 0.00 2.81 0.00 0.00 57.97 60.80 2q7l h PHE 826 Cb -0.13 -0.25 -0.02 0.00 3.61 0.00 0.00 35.95 39.15 2q7l h PHE 826 CO -0.01 1.12 0.24 0.35 -1.61 0.00 0.00 178.31 178.40 2q7l h PHE 827 N 0.82 0.58 -0.75 -0.55 3.57 -1.28 -2.18 116.94 117.15 2q7l h PHE 827 Ca 0.09 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.58 2q7l h PHE 827 Cb 0.86 -0.19 -0.04 0.00 2.79 0.00 0.00 35.95 39.38 2q7l h PHE 827 CO 0.06 0.44 0.46 -0.44 -2.23 0.00 0.00 178.31 176.60 2q7l h ASP 828 N 0.55 0.90 -0.54 0.41 3.32 -0.58 -0.87 116.42 119.61 2q7l h ASP 828 Ca 0.15 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.09 2q7l h ASP 828 Cb 0.05 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 2q7l h ASP 828 CO -0.02 0.69 0.13 -0.33 -1.72 0.00 0.00 179.24 177.99 2q7l h GLU 829 N 1.03 0.85 0.25 3.56 3.07 -1.28 -1.63 114.58 120.43 2q7l h GLU 829 Ca 0.27 -0.20 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 2q7l h GLU 829 Cb -0.05 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 27.74 2q7l h GLU 829 CO -0.05 0.81 -0.12 1.25 -1.40 0.00 0.00 179.01 179.49 2q7l h LEU 830 N 0.75 -0.29 -0.59 1.33 5.85 -0.97 -1.32 115.31 120.07 2q7l h LEU 830 Ca 0.17 -0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.90 2q7l h LEU 830 Cb 0.33 0.07 -0.05 0.00 0.37 0.00 0.00 40.66 41.39 2q7l h LEU 830 CO 0.00 -0.15 0.33 -0.09 -0.34 0.00 0.00 178.44 178.18 2q7l h ARG 831 N -0.40 0.60 -0.74 1.25 2.43 -1.19 -1.83 114.38 114.50 2q7l h ARG 831 Ca -0.03 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.19 2q7l h ARG 831 Cb 0.31 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.65 2q7l h ARG 831 CO 0.06 0.40 0.39 1.98 -1.51 0.00 0.00 179.97 181.29 2q7l h MET 832 N 0.62 0.64 -0.04 0.20 4.05 -1.15 -1.22 114.93 118.04 2q7l h MET 832 Ca 0.26 -0.04 -0.12 0.00 -0.28 0.00 0.00 59.70 59.52 2q7l h MET 832 Cb 0.13 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.77 2q7l h MET 832 CO -0.15 0.42 -0.52 -0.91 0.23 0.00 0.00 176.91 175.98 2q7l h ASN 833 N 0.66 0.12 0.41 1.39 -0.26 -0.54 -1.41 115.58 115.95 2q7l h ASN 833 Ca 0.36 -0.06 -0.16 0.00 -0.56 0.00 0.00 56.30 55.88 2q7l h ASN 833 Cb 0.36 -0.04 -0.01 0.00 -1.06 0.00 0.00 38.32 37.57 2q7l h ASN 833 CO -0.26 0.62 -0.66 1.88 -1.06 0.00 0.00 177.43 177.96 2q7l h TYR 834 N 0.09 0.30 -0.45 1.19 -1.99 -0.88 -1.90 116.97 113.33 2q7l h TYR 834 Ca 0.00 -0.13 -0.04 0.00 2.00 0.00 0.00 58.73 60.56 2q7l h TYR 834 Cb 0.95 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 39.61 2q7l h TYR 834 CO 0.01 0.82 0.11 0.82 -0.00 0.00 0.00 178.16 179.92 2q7l h ILE 835 N 0.16 1.23 -0.72 -2.88 2.04 -1.02 -2.62 117.51 113.71 2q7l h ILE 835 Ca -0.01 -0.82 0.05 0.00 1.00 0.00 0.00 64.86 65.08 2q7l h ILE 835 Cb 1.19 0.91 -0.05 0.00 -0.74 0.00 0.00 36.82 38.12 2q7l h ILE 835 CO 0.10 0.29 0.43 0.11 0.00 0.00 0.00 178.15 179.08 2q7l h LYS 836 N 0.60 0.78 -0.15 2.37 6.56 -1.10 -1.45 116.57 124.19 2q7l h LYS 836 Ca 0.14 -0.05 -0.08 0.00 -1.06 0.00 0.00 60.65 59.61 2q7l h LYS 836 Cb 0.32 -0.18 -0.01 0.00 -0.57 0.00 0.00 32.23 31.79 2q7l h LYS 836 CO 0.00 0.52 -0.24 0.93 -2.06 0.00 0.00 179.45 178.60 2q7l h GLU 837 N 0.81 0.28 -0.17 3.15 4.39 -1.23 -0.79 114.58 121.01 2q7l h GLU 837 Ca 0.31 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.84 2q7l h GLU 837 Cb 0.12 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 28.75 2q7l h GLU 837 CO -0.15 0.51 -0.21 1.25 -1.16 0.00 0.00 179.01 179.25 2q7l h LEU 838 N 0.25 0.49 -0.69 1.33 5.85 -1.08 -1.97 115.31 119.49 2q7l h LEU 838 Ca 0.04 -0.50 0.09 0.00 0.84 0.00 0.00 57.88 58.35 2q7l h LEU 838 Cb 0.57 -0.14 -0.07 0.00 0.37 0.00 0.00 40.66 41.40 2q7l h LEU 838 CO 0.04 0.89 0.33 -0.78 -0.34 0.00 0.00 178.44 178.58 2q7l h ASP 839 N 0.10 0.41 -0.02 1.25 3.58 -1.08 -1.92 116.42 118.74 2q7l h ASP 839 Ca 0.02 0.06 -0.12 0.00 0.42 0.00 0.00 57.03 57.42 2q7l h ASP 839 Cb 0.77 -0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.80 2q7l h ASP 839 CO 0.05 0.24 -0.36 0.08 -2.88 0.00 0.00 179.24 176.36 2q7l h ARG 840 N 0.56 0.52 -0.40 0.28 0.11 -0.99 -1.13 114.38 113.33 2q7l h ARG 840 Ca 0.34 -0.24 -0.08 0.00 0.10 0.00 0.00 59.98 60.10 2q7l h ARG 840 Cb 0.37 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 31.43 2q7l h ARG 840 CO -0.28 0.81 -0.07 0.82 0.10 0.00 0.00 179.97 181.35 2q7l h ILE 841 N 0.43 1.24 -0.49 0.08 2.04 -1.04 -2.36 117.51 117.42 2q7l h ILE 841 Ca 0.05 -1.06 -0.06 0.00 1.00 0.00 0.00 64.86 64.79 2q7l h ILE 841 Cb 0.84 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 2q7l h ILE 841 CO 0.07 0.36 0.08 0.40 0.00 0.00 0.00 178.15 179.06 2q7l h ILE 842 N 0.64 1.25 -3.58 -0.67 2.04 -1.01 -3.50 117.51 112.67 2q7l h ILE 842 Ca 0.12 -0.92 -0.70 0.00 1.00 0.00 0.00 64.86 64.36 2q7l h ILE 842 Cb 0.51 0.89 -0.19 0.00 -0.74 0.00 0.00 36.82 37.28 2q7l h ILE 842 CO 0.03 0.33 -0.37 0.00 0.00 0.00 0.00 178.15 178.13 2q7l s ALA 843 N -5.20 3.48 -0.06 1.87 0.00 -0.46 -4.92 121.76 116.47 2q7l s ALA 843 Ca -0.13 -1.53 -0.03 0.00 0.00 0.00 0.00 51.96 50.28 2q7l s ALA 843 Cb 0.11 -2.87 0.01 0.00 0.00 0.00 0.00 23.12 20.38 2q7l s ALA 843 CO 0.80 -1.32 0.05 0.54 0.00 0.00 0.00 175.76 175.83 2q7l n ARG 846 N 5.27 -1.21 -0.01 0.00 1.74 -1.26 -4.95 116.66 116.25 2q7l n ARG 846 Ca -0.10 1.28 -0.12 0.00 -0.77 0.00 0.00 57.85 58.14 2q7l n ARG 846 Cb 0.48 -2.14 -0.07 0.00 -1.02 0.00 0.00 32.46 29.71 2q7l n ARG 846 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 2q7l h LYS 847 N 1.06 0.12 -6.26 5.56 6.56 -2.03 -3.43 116.57 118.15 2q7l h LYS 847 Ca -0.12 -0.03 -0.55 0.00 -1.06 0.00 0.00 60.65 58.89 2q7l h LYS 847 Cb 0.28 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 31.91 2q7l h LYS 847 CO 0.01 0.29 1.11 1.21 -2.06 0.00 0.00 179.45 180.01 2q7l s ASN 848 N -5.51 6.57 0.47 0.86 2.47 -1.26 -4.92 114.94 113.63 2q7l s ASN 848 Ca -0.14 2.13 0.20 0.00 0.42 0.00 0.00 52.86 55.47 2q7l s ASN 848 Cb 0.05 -2.53 1.16 0.00 -1.45 0.00 0.00 41.25 38.48 2q7l s ASN 848 CO 0.68 -1.02 2.01 -0.65 -3.72 0.00 0.00 177.10 174.40 2q7l h PRO 849 N 9.98 0.00 -0.16 0.43 0.11 -2.00 -2.92 132.00 137.43 2q7l h PRO 849 Ca -0.39 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.64 2q7l h PRO 849 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2q7l h PRO 849 CO 0.96 0.18 -0.25 1.15 -0.21 0.00 0.00 178.00 179.83 2q7l h THR 850 N 0.00 1.25 -0.23 -1.15 2.02 -1.97 0.32 112.91 113.15 2q7l h THR 850 Ca -0.00 -1.16 -0.19 0.00 0.77 0.00 0.00 66.41 65.82 2q7l h THR 850 Cb 0.37 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2q7l h THR 850 CO 0.02 0.36 -0.62 0.77 0.37 0.00 0.00 175.52 176.42 2q7l h SER 851 N 0.27 0.90 -0.80 4.18 4.64 -1.93 -1.92 113.55 118.90 2q7l h SER 851 Ca 0.04 -0.52 -0.04 0.00 -0.47 0.00 0.00 61.79 60.81 2q7l h SER 851 Cb 0.60 -0.26 -0.04 0.00 -0.31 0.00 0.00 62.40 62.39 2q7l h SER 851 CO 0.04 1.31 0.36 0.00 -0.87 0.00 0.00 176.83 177.67 2q7l h SER 853 N 1.15 0.54 -0.84 0.00 0.02 -0.94 -0.55 113.55 112.93 2q7l h SER 853 Ca 0.27 -0.44 -0.02 0.00 -0.84 0.00 0.00 61.79 60.76 2q7l h SER 853 Cb 0.16 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 2q7l h SER 853 CO -0.03 0.87 0.45 0.03 -1.14 0.00 0.00 176.83 177.01 2q7l h ARG 854 N 0.22 1.19 -0.05 3.45 3.08 -1.29 -1.69 114.38 119.29 2q7l h ARG 854 Ca 0.05 -0.15 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 2q7l h ARG 854 Cb 0.69 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 2q7l h ARG 854 CO 0.04 0.88 0.01 -0.09 -1.07 0.00 0.00 179.97 179.74 2q7l h ARG 855 N 1.19 0.09 -0.99 0.04 9.65 -0.95 -0.86 114.38 122.56 2q7l h ARG 855 Ca 0.30 -0.03 0.04 0.00 -1.10 0.00 0.00 59.98 59.19 2q7l h ARG 855 Cb 0.05 -0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 28.57 2q7l h ARG 855 CO -0.04 0.35 0.65 0.35 2.80 0.00 0.00 179.97 184.07 2q7l h PHE 856 N -0.17 1.21 -0.16 2.20 3.57 -1.04 -0.57 116.94 121.99 2q7l h PHE 856 Ca 0.02 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2q7l h PHE 856 Cb 0.30 -0.40 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2q7l h PHE 856 CO 0.02 0.70 0.08 -0.92 -2.23 0.00 0.00 178.31 175.96 2q7l h TYR 857 N 1.25 0.22 -0.19 0.41 5.03 -1.10 -1.06 116.97 121.53 2q7l h TYR 857 Ca 0.39 -0.01 0.01 0.00 2.58 0.00 0.00 58.73 61.70 2q7l h TYR 857 Cb -0.00 -0.07 -0.01 0.00 1.55 0.00 0.00 36.73 38.19 2q7l h TYR 857 CO -0.00 0.25 0.11 1.96 -1.32 0.00 0.00 178.16 179.16 2q7l h GLN 858 N 0.13 0.23 -0.38 1.82 4.20 -0.54 -1.40 115.11 119.16 2q7l h GLN 858 Ca 0.05 -0.01 -0.12 0.00 0.06 0.00 0.00 58.65 58.63 2q7l h GLN 858 Cb 0.11 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2q7l h GLN 858 CO -0.01 0.15 -0.25 -0.07 -0.67 0.00 0.00 178.83 177.99 2q7l h LEU 859 N 0.23 0.79 -0.59 1.46 3.38 -1.05 -1.25 115.31 118.29 2q7l h LEU 859 Ca 0.08 -0.29 -0.13 0.00 0.09 0.00 0.00 57.88 57.62 2q7l h LEU 859 Cb -0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2q7l h LEU 859 CO -0.04 1.00 -0.31 0.71 0.09 0.00 0.00 178.44 179.89 2q7l h THR 860 N 0.67 1.28 -0.67 0.22 1.35 -1.09 -0.42 112.91 114.25 2q7l h THR 860 Ca 0.09 -1.46 0.03 0.00 -0.55 0.00 0.00 66.41 64.52 2q7l h THR 860 Cb 0.76 1.34 -0.04 0.00 -1.73 0.00 0.00 68.15 68.48 2q7l h THR 860 CO 0.06 0.48 0.41 0.11 -0.25 0.00 0.00 175.52 176.34 2q7l h LYS 861 N 0.66 0.79 -0.05 4.72 1.79 -1.05 -0.23 116.57 123.20 2q7l h LYS 861 Ca 0.07 -0.05 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2q7l h LYS 861 Cb 0.85 -0.18 -0.00 0.00 -1.58 0.00 0.00 32.23 31.32 2q7l h LYS 861 CO 0.07 0.52 0.01 1.25 -1.08 0.00 0.00 179.45 180.23 2q7l h LEU 862 N 0.81 0.08 -0.49 2.94 5.85 -0.84 -1.48 115.31 122.18 2q7l h LEU 862 Ca 0.27 -0.23 0.10 0.00 0.84 0.00 0.00 57.88 58.86 2q7l h LEU 862 Cb 0.02 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 40.94 2q7l h LEU 862 CO -0.11 0.29 -0.11 -0.07 -0.34 0.00 0.00 178.44 178.10 2q7l h LEU 863 N -0.14 -0.43 -1.32 2.25 3.38 -0.98 -1.20 115.31 116.88 2q7l h LEU 863 Ca 0.02 0.14 0.09 0.00 0.09 0.00 0.00 57.88 58.22 2q7l h LEU 863 Cb 0.24 0.29 -0.05 0.00 0.09 0.00 0.00 40.66 41.23 2q7l h LEU 863 CO 0.00 -0.15 0.52 0.44 0.09 0.00 0.00 178.44 179.34 2q7l h ASP 864 N 0.01 0.70 0.71 -0.43 3.32 -0.78 -2.44 116.42 117.51 2q7l h ASP 864 Ca 0.24 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.30 2q7l h ASP 864 Cb 0.36 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2q7l h ASP 864 CO -0.49 0.43 0.00 0.77 -1.72 0.00 0.00 179.24 178.22 2q7l h SER 865 N 0.78 0.00 -0.62 6.45 4.64 -0.13 -2.75 113.55 121.91 2q7l h SER 865 Ca 0.36 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.64 2q7l h SER 865 Cb 0.37 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.43 2q7l h SER 865 CO -0.14 0.00 0.24 0.58 -0.87 0.00 0.00 176.83 176.64 2q7l h VAL 866 N 0.00 1.23 -0.19 0.95 2.07 -1.34 -3.32 116.25 115.65 2q7l h VAL 866 Ca 0.00 -0.77 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 2q7l h VAL 866 Cb 0.36 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2q7l h VAL 866 CO 0.00 0.30 -0.17 1.56 0.02 0.00 0.00 177.57 179.28 2q7l h GLN 867 N 0.95 0.46 -0.50 1.57 1.08 -1.64 -0.92 115.11 116.11 2q7l h GLN 867 Ca 0.22 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 2q7l h GLN 867 Cb 0.22 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 2q7l h GLN 867 CO -0.01 0.80 0.30 -1.35 -0.95 0.00 0.00 178.83 177.62 2q7l h PRO 868 N 0.13 0.66 -0.03 1.46 0.11 -1.74 0.64 132.00 133.24 2q7l h PRO 868 Ca 0.03 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 2q7l h PRO 868 Cb 0.71 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 2q7l h PRO 868 CO 0.04 0.46 0.01 0.82 -0.21 0.00 0.00 178.00 179.13 2q7l h ILE 869 N 0.68 1.14 -0.86 4.15 2.04 -1.60 -2.15 117.51 120.91 2q7l h ILE 869 Ca 0.18 -0.41 0.03 0.00 1.00 0.00 0.00 64.86 65.66 2q7l h ILE 869 Cb -0.03 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 2q7l h ILE 869 CO -0.03 0.11 0.57 0.00 0.00 0.00 0.00 178.15 178.79 2q7l h ALA 870 N 0.84 1.45 -0.51 1.87 0.00 -0.72 -1.50 119.26 120.69 2q7l h ALA 870 Ca 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2q7l h ALA 870 Cb 0.17 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2q7l h ALA 870 CO -0.00 0.47 0.15 -0.09 0.00 0.00 0.00 179.25 179.78 2q7l h ARG 871 N 1.09 0.80 -0.83 0.00 2.43 -0.69 0.35 114.38 117.53 2q7l h ARG 871 Ca 0.34 -0.18 -0.04 0.00 -0.81 0.00 0.00 59.98 59.29 2q7l h ARG 871 Cb -0.00 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 2q7l h ARG 871 CO -0.10 0.75 0.38 0.93 -1.51 0.00 0.00 179.97 180.42 2q7l h GLU 872 N 0.69 1.21 -0.48 0.20 5.08 -0.92 0.47 114.58 120.83 2q7l h GLU 872 Ca 0.16 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 2q7l h GLU 872 Cb 0.30 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2q7l h GLU 872 CO -0.00 0.94 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.75 2q7l h LEU 873 N 1.19 0.90 -0.55 1.33 3.38 -0.89 -1.14 115.31 119.52 2q7l h LEU 873 Ca 0.28 -0.29 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2q7l h LEU 873 Cb 0.15 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2q7l h LEU 873 CO -0.03 1.03 0.35 1.88 0.09 0.00 0.00 178.44 181.75 2q7l h TYR 874 N 0.80 0.65 -0.25 1.13 0.99 0.23 -0.74 116.97 119.79 2q7l h TYR 874 Ca 0.13 0.02 0.01 0.00 2.00 0.00 0.00 58.73 60.88 2q7l h TYR 874 Cb 0.65 -0.22 -0.01 0.00 1.00 0.00 0.00 36.73 38.15 2q7l h TYR 874 CO 0.04 0.39 0.16 0.37 -0.00 0.00 0.00 178.16 179.12 2q7l h GLN 875 N 0.70 0.32 -0.28 4.88 5.75 -0.65 -1.31 115.11 124.51 2q7l h GLN 875 Ca 0.22 -0.02 0.01 0.00 -0.15 0.00 0.00 58.65 58.70 2q7l h GLN 875 Cb -0.02 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 2q7l h GLN 875 CO -0.08 0.21 0.18 0.35 -2.65 0.00 0.00 178.83 176.84 2q7l h PHE 876 N 0.33 0.33 -0.13 3.99 3.04 -0.96 -1.06 116.94 122.48 2q7l h PHE 876 Ca 0.09 0.01 -0.16 0.00 3.98 0.00 0.00 57.97 61.89 2q7l h PHE 876 Cb -0.03 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.37 2q7l h PHE 876 CO -0.07 0.21 -0.61 0.00 -2.02 0.00 0.00 178.31 175.82 2q7l h THR 877 N 0.36 1.35 0.34 4.41 1.03 -1.05 -0.15 112.91 119.20 2q7l h THR 877 Ca 0.11 -1.93 -0.02 0.00 -0.01 0.00 0.00 66.41 64.56 2q7l h THR 877 Cb -0.03 1.92 0.00 0.00 -1.07 0.00 0.00 68.15 68.97 2q7l h THR 877 CO -0.03 0.59 -0.17 0.15 -0.01 0.00 0.00 175.52 176.04 2q7l h PHE 878 N 0.33 -0.45 -0.71 0.00 3.57 -1.06 0.24 116.94 118.86 2q7l h PHE 878 Ca -0.01 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.55 2q7l h PHE 878 Cb 1.16 0.15 -0.06 0.00 2.79 0.00 0.00 35.95 39.99 2q7l h PHE 878 CO 0.04 -0.27 0.40 -0.44 -2.23 0.00 0.00 178.31 175.81 2q7l h ASP 879 N -0.47 0.59 -0.73 0.41 3.32 -1.10 -1.15 116.42 117.29 2q7l h ASP 879 Ca -0.04 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 2q7l h ASP 879 Cb 0.37 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.80 2q7l h ASP 879 CO 0.07 0.38 0.26 0.25 -1.72 0.00 0.00 179.24 178.48 2q7l h LEU 880 N 0.73 1.05 -0.09 1.55 5.85 -0.88 -2.40 115.31 121.12 2q7l h LEU 880 Ca 0.32 -0.18 0.01 0.00 0.84 0.00 0.00 57.88 58.87 2q7l h LEU 880 Cb 0.21 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 2q7l h LEU 880 CO -0.19 0.95 0.04 0.25 -0.34 0.00 0.00 178.44 179.15 2q7l h LEU 881 N 1.09 0.06 -1.59 2.25 5.85 0.32 0.28 115.31 123.57 2q7l h LEU 881 Ca 0.24 0.00 0.08 0.00 0.84 0.00 0.00 57.88 59.05 2q7l h LEU 881 Cb 0.26 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 2q7l h LEU 881 CO -0.01 0.05 0.40 0.40 -0.34 0.00 0.00 178.44 178.93 2q7l h ILE 882 N 0.09 0.94 -0.38 4.05 1.08 -0.99 -2.38 117.51 119.91 2q7l h ILE 882 Ca 0.04 -0.16 0.00 0.00 -0.39 0.00 0.00 64.86 64.34 2q7l h ILE 882 Cb 0.01 0.42 0.00 0.00 -3.07 0.00 0.00 36.82 34.18 2q7l h ILE 882 CO -0.03 0.09 0.00 2.29 -0.69 0.00 0.00 178.15 179.81 2q7l n LYS 883 N -4.47 2.96 -0.08 2.37 2.85 -0.93 -4.78 118.16 116.07 2q7l n LYS 883 Ca 0.09 -2.34 0.02 0.00 -1.05 0.00 0.00 58.31 55.03 2q7l n LYS 883 Cb 0.32 -1.47 0.34 0.00 -0.65 0.00 0.00 35.03 33.56 2q7l n LYS 883 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2q7l h SER 884 N 2.30 0.63 -0.00 -5.58 4.64 0.11 -0.63 113.55 115.02 2q7l h SER 884 Ca 0.00 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.29 2q7l h SER 884 Cb 0.97 -0.16 -0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2q7l h SER 884 CO 0.07 0.49 0.00 1.12 -0.87 0.00 0.00 176.83 177.64 2q7l h HIS 885 N 0.72 0.00 0.02 4.77 2.07 -1.82 -1.89 115.15 119.02 2q7l h HIS 885 Ca 0.19 0.00 -0.21 0.00 -2.85 0.00 0.00 60.37 57.50 2q7l h HIS 885 Cb -0.02 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.95 2q7l h HIS 885 CO 0.00 0.00 -0.94 0.52 -3.07 0.00 0.00 177.93 174.44 2q7l h MET 886 N 0.00 0.18 -0.33 5.12 2.07 -1.48 -3.35 114.93 117.14 2q7l h MET 886 Ca 0.00 -0.22 0.00 0.00 -2.07 0.00 0.00 59.70 57.41 2q7l h MET 886 Cb 0.00 0.07 0.00 0.00 -1.87 0.00 0.00 31.60 29.80 2q7l h MET 886 CO -0.00 0.99 0.00 1.33 1.07 0.00 0.00 176.91 180.30 2q7l n VAL 887 N -3.60 0.67 -3.14 -2.22 0.24 -1.04 -4.99 118.33 104.25 2q7l n VAL 887 Ca -0.04 -0.84 -0.22 0.00 -2.04 0.00 0.00 64.34 61.21 2q7l n VAL 887 Cb 0.85 0.77 0.05 0.00 -1.47 0.00 0.00 33.84 34.04 2q7l n VAL 887 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2q7l n SER 888 N 0.88 -6.05 -4.65 -1.34 7.64 -0.74 -4.68 113.62 104.68 2q7l n SER 888 Ca 0.14 -0.34 -0.37 0.00 1.01 0.00 0.00 58.87 59.31 2q7l n SER 888 Cb 0.45 -4.82 -0.10 0.00 -1.01 0.00 0.00 64.21 58.74 2q7l n SER 888 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2q7l s VAL 889 N -3.20 5.35 -0.07 0.44 1.01 -1.03 -4.85 120.40 118.05 2q7l s VAL 889 Ca 0.37 0.20 -0.21 0.00 0.00 0.00 0.00 61.98 62.34 2q7l s VAL 889 Cb -0.16 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.66 2q7l s VAL 889 CO 0.45 0.33 0.59 -1.81 0.00 0.00 0.00 175.10 174.66 2q7l s ASP 890 N 1.17 6.87 -0.20 3.32 1.01 -1.26 -4.65 116.67 122.93 2q7l s ASP 890 Ca 0.08 1.04 -0.03 0.00 0.71 0.00 0.00 52.55 54.34 2q7l s ASP 890 Cb -0.14 -2.35 -0.01 0.00 1.01 0.00 0.00 42.92 41.43 2q7l s ASP 890 CO 0.06 -0.01 -0.06 -0.36 0.21 0.00 0.00 175.17 175.00 2q7l s PHE 891 N 0.47 2.94 1.10 4.23 0.40 -1.26 -4.62 117.98 121.24 2q7l s PHE 891 Ca 0.31 -0.84 -0.13 0.00 -0.60 0.00 0.00 56.93 55.67 2q7l s PHE 891 Cb -0.17 -2.05 0.24 0.00 0.51 0.00 0.00 43.02 41.56 2q7l s PHE 891 CO 0.15 -0.45 1.06 -2.14 0.70 0.00 0.00 175.22 174.54 2q7l s PRO 892 N 1.18 -0.37 0.01 0.24 0.02 -1.26 -4.69 135.00 130.14 2q7l s PRO 892 Ca 0.02 0.55 -0.02 0.00 0.02 0.00 0.00 61.00 61.57 2q7l s PRO 892 Cb -0.14 -1.64 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 2q7l s PRO 892 CO -0.01 -3.28 1.04 1.49 -0.33 0.00 0.00 177.00 175.91 2q7l h GLU 893 N -2.29 -0.02 -0.45 5.54 4.81 -1.99 -0.87 114.58 119.31 2q7l h GLU 893 Ca -0.57 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 58.60 2q7l h GLU 893 Cb 1.33 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.70 2q7l h GLU 893 CO 0.53 -0.01 0.02 0.52 -0.73 0.00 0.00 179.01 179.34 2q7l h MET 894 N -0.02 0.72 -0.30 1.92 2.86 -1.99 -2.62 114.93 115.50 2q7l h MET 894 Ca 0.01 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 2q7l h MET 894 Cb 0.04 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.59 2q7l h MET 894 CO -0.05 0.72 0.07 0.52 1.06 0.00 0.00 176.91 179.24 2q7l h MET 895 N 0.68 0.48 -0.58 1.72 2.86 -1.89 -0.05 114.93 118.16 2q7l h MET 895 Ca 0.14 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.62 2q7l h MET 895 Cb 0.39 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 31.96 2q7l h MET 895 CO 0.01 0.56 0.18 0.00 1.06 0.00 0.00 176.91 178.72 2q7l h ALA 896 N 0.90 1.24 -0.05 6.32 0.00 -0.98 -0.68 119.26 126.01 2q7l h ALA 896 Ca 0.09 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2q7l h ALA 896 Cb 0.29 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2q7l h ALA 896 CO 0.00 0.54 -0.24 1.49 0.00 0.00 0.00 179.25 181.05 2q7l h GLU 897 N 0.84 0.26 -0.71 0.00 4.81 -1.25 -2.70 114.58 115.83 2q7l h GLU 897 Ca 0.19 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2q7l h GLU 897 Cb 0.24 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.60 2q7l h GLU 897 CO -0.01 0.85 0.41 0.82 -0.73 0.00 0.00 179.01 180.34 2q7l h ILE 898 N -0.27 0.98 0.00 2.32 2.04 -0.91 -1.04 117.51 120.63 2q7l h ILE 898 Ca -0.01 -0.26 -0.06 0.00 1.00 0.00 0.00 64.86 65.53 2q7l h ILE 898 Cb 0.89 0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 2q7l h ILE 898 CO 0.05 0.14 -0.29 0.40 0.00 0.00 0.00 178.15 178.44 2q7l h ILE 899 N 0.75 0.72 0.00 -0.67 2.04 -1.13 0.12 117.51 119.33 2q7l h ILE 899 Ca 0.32 -1.28 -0.15 0.00 1.00 0.00 0.00 64.86 64.75 2q7l h ILE 899 Cb 0.19 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.06 2q7l h ILE 899 CO -0.18 0.29 -1.62 -1.54 0.00 0.00 0.00 178.15 175.09 2q7l n SER 900 N -3.48 0.57 -0.10 1.72 3.41 -1.02 -4.17 113.62 110.54 2q7l n SER 900 Ca -0.00 0.24 -0.19 0.00 -0.26 0.00 0.00 58.87 58.66 2q7l n SER 900 Cb 0.46 0.67 -0.08 0.00 -0.26 0.00 0.00 64.21 65.00 2q7l n SER 900 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2q7l n VAL 901 N -2.72 1.11 -0.08 -3.33 0.31 -0.42 -4.69 118.33 108.51 2q7l n VAL 901 Ca -0.11 -0.33 -0.23 0.00 -0.01 0.00 0.00 64.34 63.66 2q7l n VAL 901 Cb 0.80 -1.57 -0.12 0.00 -0.91 0.00 0.00 33.84 32.04 2q7l n VAL 901 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2q7l n GLN 902 N -3.62 0.63 -0.37 5.55 1.13 0.31 -4.36 117.38 116.65 2q7l n GLN 902 Ca -0.38 0.40 0.04 0.00 -1.94 0.00 0.00 57.00 55.11 2q7l n GLN 902 Cb 0.81 -1.68 0.19 0.00 0.11 0.00 0.00 30.24 29.67 2q7l n GLN 902 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2q7l h VAL 903 N -0.59 1.05 0.00 5.09 2.07 -1.46 -1.89 116.25 120.52 2q7l h VAL 903 Ca -0.45 -0.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 2q7l h VAL 903 Cb 1.62 -0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.21 2q7l h VAL 903 CO -0.15 0.21 -0.02 -0.65 0.02 0.00 0.00 177.57 176.98 2q7l h PRO 904 N 1.13 0.00 -0.29 1.57 0.11 -1.77 -0.57 132.00 132.19 2q7l h PRO 904 Ca 0.45 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.51 2q7l h PRO 904 Cb 0.24 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.34 2q7l h PRO 904 CO -0.20 0.02 -0.02 0.87 -0.21 0.00 0.00 178.00 178.47 2q7l h LYS 905 N 0.00 0.44 -0.04 1.05 1.57 -1.54 0.44 116.57 118.50 2q7l h LYS 905 Ca -0.00 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 2q7l h LYS 905 Cb 0.04 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2q7l h LYS 905 CO 0.00 0.49 -0.03 0.82 -0.57 0.00 0.00 179.45 180.16 2q7l h ILE 906 N 0.43 1.35 0.00 1.86 2.04 -1.16 0.73 117.51 122.77 2q7l h ILE 906 Ca 0.09 -1.10 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 2q7l h ILE 906 Cb 0.31 2.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.40 2q7l h ILE 906 CO 0.01 0.30 -0.20 -0.07 0.00 0.00 0.00 178.15 178.19 2q7l h LEU 907 N -0.34 0.00 -1.08 1.44 3.38 -0.63 -2.06 115.31 116.02 2q7l h LEU 907 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2q7l h LEU 907 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2q7l h LEU 907 CO 0.01 0.20 0.00 -1.54 0.09 0.00 0.00 178.44 177.20 2q7l n SER 908 N -4.01 1.67 0.00 -0.43 3.41 0.15 -4.95 113.62 109.47 2q7l n SER 908 Ca -0.02 -1.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 2q7l n SER 908 Cb 0.28 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 2q7l n SER 908 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2q7l n GLY 909 N 1.19 0.67 0.17 5.00 0.00 -0.78 -4.92 105.19 106.52 2q7l n GLY 909 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.23 2q7l n GLY 909 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2q7l h LYS 910 N 1.79 0.00 -5.24 1.61 1.57 -1.16 -3.43 116.57 111.71 2q7l h LYS 910 Ca 0.00 0.00 -0.63 0.00 -1.87 0.00 0.00 60.65 58.15 2q7l h LYS 910 Cb 0.00 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 31.98 2q7l h LYS 910 CO 0.00 0.48 -0.86 0.08 -0.57 0.00 0.00 179.45 178.58 2q7l s VAL 911 N -3.64 1.77 0.03 0.50 1.01 -0.30 -0.17 120.40 119.59 2q7l s VAL 911 Ca -0.01 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2q7l s VAL 911 Cb 0.12 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2q7l s VAL 911 CO 0.72 0.50 -0.06 -0.54 0.00 0.00 0.00 175.10 175.72 2q7l s LYS 912 N 0.31 0.42 0.70 2.72 1.02 -0.76 -4.29 119.74 119.86 2q7l s LYS 912 Ca -0.14 -0.57 -0.16 0.00 0.02 0.00 0.00 55.97 55.11 2q7l s LYS 912 Cb -0.16 -0.19 0.02 0.00 -0.52 0.00 0.00 37.83 36.98 2q7l s LYS 912 CO 0.06 0.03 1.27 -2.14 -0.92 0.00 0.00 175.35 173.65 2q7l s PRO 913 N -1.20 2.22 -0.45 -1.68 0.02 -1.26 -2.50 135.00 130.14 2q7l s PRO 913 Ca -0.09 1.97 -0.18 0.00 0.02 0.00 0.00 61.00 62.71 2q7l s PRO 913 Cb -0.08 -1.82 0.04 0.00 0.02 0.00 0.00 34.50 32.66 2q7l s PRO 913 CO -0.00 -1.83 0.54 0.42 -0.33 0.00 0.00 177.00 175.80 2q7l s ILE 914 N -1.65 4.98 0.09 2.83 1.01 0.45 -4.89 121.20 124.01 2q7l s ILE 914 Ca 0.79 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.99 2q7l s ILE 914 Cb -0.35 -4.16 -0.06 0.00 0.01 0.00 0.00 42.46 37.90 2q7l s ILE 914 CO 0.44 -0.59 0.42 -0.31 0.00 0.00 0.00 174.94 174.89 2q7l s TYR 915 N 2.40 3.59 -0.02 3.97 2.02 -1.26 -4.89 117.35 123.15 2q7l s TYR 915 Ca 0.15 0.82 -0.24 0.00 -0.37 0.00 0.00 57.07 57.42 2q7l s TYR 915 Cb -0.18 -2.18 -0.20 0.00 -0.40 0.00 0.00 41.96 39.00 2q7l s TYR 915 CO 0.14 0.51 1.20 0.74 -1.57 0.00 0.00 175.55 176.56 2q7l h PHE 916 N 3.71 0.17 -2.22 2.71 0.04 -1.97 -3.46 116.94 115.91 2q7l h PHE 916 Ca -0.49 -0.06 -0.55 0.00 2.80 0.00 0.00 57.97 59.67 2q7l h PHE 916 Cb 1.19 -0.03 -0.08 0.00 2.20 0.00 0.00 35.95 39.23 2q7l h PHE 916 CO 0.66 0.69 -0.62 -1.01 -0.60 0.00 0.00 178.31 177.44 2q7l s HIS 917 N -3.86 2.79 0.18 -0.55 3.76 -1.26 -5.10 115.29 111.25 2q7l s HIS 917 Ca -0.16 -0.20 -0.25 0.00 -0.15 0.00 0.00 55.06 54.31 2q7l s HIS 917 Cb 0.02 -1.24 -0.08 0.00 1.11 0.00 0.00 32.58 32.39 2q7l s HIS 917 CO 0.71 0.60 0.78 0.99 -0.85 0.00 0.00 174.74 176.97 2q7l s THR 918 N -2.27 4.37 -1.77 1.30 2.01 -1.26 -5.11 115.64 112.91 2q7l s THR 918 Ca 0.32 1.68 0.14 0.00 0.31 0.00 0.00 61.69 64.14 2q7l s THR 918 Cb -0.07 -4.11 0.11 0.00 0.01 0.00 0.00 72.50 68.45 2q7l s THR 918 CO 0.21 0.47 0.95 0.00 -0.69 0.00 0.00 174.62 175.56