data_19502 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19502 _Entry.PDB_ID 2MDR save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 19502 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 713 713 VAL N N 713 120.649 120.649 122.280 -1.631 19502 2 1 1 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.245 -0.125 19502 3 1 1 . 1 1 713 713 VAL CA C 713 63.009 63.009 60.571 2.438 19502 4 1 1 . 1 1 713 713 VAL CB C 713 32.747 32.747 34.826 -2.079 19502 5 1 1 . 1 1 713 713 VAL H H 713 8.051 8.051 8.456 -0.405 19502 6 1 1 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.406 0.075 19502 7 1 1 . 1 1 715 715 LYS CA C 715 56.754 56.754 54.720 2.034 19502 8 1 1 . 1 1 715 715 LYS CB C 715 33.015 33.015 31.514 1.501 19502 9 1 1 . 1 1 716 716 ILE N N 716 121.593 121.593 123.843 -2.250 19502 10 1 1 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.931 0.168 19502 11 1 1 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.398 0.431 19502 12 1 1 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.346 0.820 19502 13 1 1 . 1 1 716 716 ILE H H 716 8.406 8.406 7.951 0.455 19502 14 1 1 . 1 1 717 717 GLY N N 717 108.628 108.628 107.188 1.440 19502 15 1 1 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.882 -0.208 19502 16 1 1 . 1 1 717 717 GLY H H 717 8.476 8.476 8.755 -0.279 19502 17 1 1 . 1 1 718 718 GLU N N 718 119.944 119.944 120.630 -0.686 19502 18 1 1 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.230 0.047 19502 19 1 1 . 1 1 718 718 GLU CA C 718 58.187 58.187 57.954 0.233 19502 20 1 1 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.617 0.420 19502 21 1 1 . 1 1 718 718 GLU H H 718 8.055 8.055 7.705 0.350 19502 22 1 1 . 1 1 719 719 LEU N N 719 118.538 118.538 120.072 -1.534 19502 23 1 1 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.356 0.022 19502 24 1 1 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.355 -0.013 19502 25 1 1 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.943 1.097 19502 26 1 1 . 1 1 719 719 LEU H H 719 8.098 8.098 7.644 0.454 19502 27 1 1 . 1 1 720 720 VAL N N 720 117.613 117.613 118.343 -0.730 19502 28 1 1 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.730 -0.026 19502 29 1 1 . 1 1 720 720 VAL CA C 720 65.619 65.619 65.965 -0.346 19502 30 1 1 . 1 1 720 720 VAL CB C 720 31.924 31.924 30.852 1.071 19502 31 1 1 . 1 1 720 720 VAL H H 720 7.838 7.838 7.639 0.199 19502 32 1 1 . 1 1 721 721 ARG N N 721 118.905 118.905 120.038 -1.133 19502 33 1 1 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.967 0.212 19502 34 1 1 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.412 -0.992 19502 35 1 1 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.377 0.210 19502 36 1 1 . 1 1 721 721 ARG H H 721 7.614 7.614 7.459 0.155 19502 37 1 1 . 1 1 722 722 TYR N N 722 117.574 117.574 118.941 -1.367 19502 38 1 1 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.362 -0.013 19502 39 1 1 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.246 -1.181 19502 40 1 1 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.332 0.499 19502 41 1 1 . 1 1 722 722 TYR H H 722 7.885 7.885 7.523 0.362 19502 42 1 1 . 1 1 723 723 LEU N N 723 120.520 120.520 118.334 2.186 19502 43 1 1 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.071 -0.076 19502 44 1 1 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.976 0.579 19502 45 1 1 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.849 0.189 19502 46 1 1 . 1 1 723 723 LEU H H 723 7.794 7.794 7.527 0.267 19502 47 1 1 . 1 1 724 724 ASN N N 724 115.161 115.161 115.027 0.134 19502 48 1 1 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.721 -0.109 19502 49 1 1 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.002 0.235 19502 50 1 1 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.229 0.048 19502 51 1 1 . 1 1 724 724 ASN H H 724 8.892 8.892 7.764 1.128 19502 52 1 1 . 1 1 725 725 THR N N 725 110.273 110.273 113.594 -3.321 19502 53 1 1 . 1 1 725 725 THR HA H 725 4.527 4.527 4.420 0.107 19502 54 1 1 . 1 1 725 725 THR CA C 725 62.903 62.903 63.644 -0.741 19502 55 1 1 . 1 1 725 725 THR CB C 725 70.619 70.619 69.990 0.629 19502 56 1 1 . 1 1 725 725 THR H H 725 7.874 7.874 7.288 0.586 19502 57 1 1 . 1 1 726 726 ASN N N 726 117.048 117.048 119.086 -2.038 19502 58 1 1 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.122 0.017 19502 59 1 1 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.460 1.378 19502 60 1 1 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.896 -1.989 19502 61 1 1 . 1 1 726 726 ASN H H 726 8.613 8.613 8.062 0.551 19502 62 1 1 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.370 -0.306 19502 63 1 1 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.203 0.306 19502 64 1 1 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.384 -0.939 19502 65 1 1 . 1 1 728 728 VAL N N 728 118.643 118.643 119.017 -0.374 19502 66 1 1 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.691 -0.291 19502 67 1 1 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.487 1.079 19502 68 1 1 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.637 0.789 19502 69 1 1 . 1 1 728 728 VAL H H 728 8.182 8.182 7.607 0.575 19502 70 1 1 . 1 1 729 729 GLY N N 729 105.307 105.307 107.177 -1.870 19502 71 1 1 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.719 0.930 19502 72 1 1 . 1 1 729 729 GLY H H 729 7.297 7.297 8.495 -1.198 19502 73 1 1 . 1 1 730 730 GLY N N 730 109.038 109.038 109.621 -0.583 19502 74 1 1 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.938 0.754 19502 75 1 1 . 1 1 730 730 GLY H H 730 8.080 8.080 7.442 0.638 19502 76 1 1 . 1 1 731 731 LEU N N 731 123.822 123.822 123.633 0.189 19502 77 1 1 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.071 -0.035 19502 78 1 1 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.386 0.210 19502 79 1 1 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.592 0.623 19502 80 1 1 . 1 1 731 731 LEU H H 731 8.287 8.287 8.194 0.093 19502 81 1 1 . 1 1 732 732 LEU N N 732 118.759 118.759 118.628 0.131 19502 82 1 1 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.911 0.175 19502 83 1 1 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.197 0.311 19502 84 1 1 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.373 -0.390 19502 85 1 1 . 1 1 732 732 LEU H H 732 8.412 8.412 8.064 0.348 19502 86 1 1 . 1 1 733 733 GLU N N 733 121.155 121.155 120.211 0.944 19502 87 1 1 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.964 0.309 19502 88 1 1 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.138 -0.064 19502 89 1 1 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.982 -0.002 19502 90 1 1 . 1 1 733 733 GLU H H 733 8.003 8.003 7.864 0.139 19502 91 1 1 . 1 1 734 734 TYR N N 734 122.518 122.518 121.118 1.400 19502 92 1 1 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.967 0.214 19502 93 1 1 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.446 0.513 19502 94 1 1 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.263 -0.419 19502 95 1 1 . 1 1 734 734 TYR H H 734 8.419 8.419 8.383 0.036 19502 96 1 1 . 1 1 735 735 ALA N N 735 122.353 122.353 120.952 1.401 19502 97 1 1 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.811 0.001 19502 98 1 1 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.954 1.218 19502 99 1 1 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.602 0.231 19502 100 1 1 . 1 1 735 735 ALA H H 735 8.777 8.777 7.935 0.842 19502 101 1 1 . 1 1 736 736 ARG N N 736 118.852 118.852 118.304 0.548 19502 102 1 1 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.031 0.142 19502 103 1 1 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.808 0.715 19502 104 1 1 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.740 0.416 19502 105 1 1 . 1 1 736 736 ARG H H 736 8.570 8.570 8.445 0.125 19502 106 1 1 . 1 1 737 737 SER N N 737 115.125 115.125 112.835 2.290 19502 107 1 1 . 1 1 737 737 SER HA H 737 4.149 4.149 4.357 -0.208 19502 108 1 1 . 1 1 737 737 SER CA C 737 61.300 61.300 59.811 1.489 19502 109 1 1 . 1 1 737 737 SER CB C 737 63.166 63.166 63.588 -0.422 19502 110 1 1 . 1 1 737 737 SER H H 737 8.257 8.257 8.064 0.193 19502 111 1 1 . 1 1 738 738 HIS N N 738 117.591 117.591 118.162 -0.571 19502 112 1 1 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.510 -0.170 19502 113 1 1 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.347 1.661 19502 114 1 1 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.417 0.113 19502 115 1 1 . 1 1 738 738 HIS H H 738 7.300 7.300 7.394 -0.094 19502 116 1 1 . 1 1 739 739 GLY N N 739 107.604 107.604 107.935 -0.331 19502 117 1 1 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.377 0.755 19502 118 1 1 . 1 1 739 739 GLY H H 739 7.638 7.638 7.880 -0.242 19502 119 1 1 . 1 1 740 740 PHE N N 740 118.114 118.114 119.463 -1.349 19502 120 1 1 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.685 0.502 19502 121 1 1 . 1 1 740 740 PHE CA C 740 54.403 54.403 55.772 -1.369 19502 122 1 1 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.644 2.338 19502 123 1 1 . 1 1 740 740 PHE H H 740 8.138 8.138 7.677 0.461 19502 124 1 1 . 1 1 741 741 ALA N N 741 122.577 122.577 122.174 0.403 19502 125 1 1 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.517 0.138 19502 126 1 1 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.945 0.326 19502 127 1 1 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.714 -0.738 19502 128 1 1 . 1 1 741 741 ALA H H 741 8.550 8.550 8.580 -0.030 19502 129 1 1 . 1 1 742 742 ALA N N 742 124.016 124.016 127.142 -3.126 19502 130 1 1 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.565 0.341 19502 131 1 1 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.997 0.032 19502 132 1 1 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.425 0.935 19502 133 1 1 . 1 1 742 742 ALA H H 742 8.511 8.511 8.589 -0.078 19502 134 1 1 . 1 1 743 743 GLU N N 743 120.968 120.968 125.109 -4.141 19502 135 1 1 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.621 -0.071 19502 136 1 1 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.685 0.081 19502 137 1 1 . 1 1 743 743 GLU CB C 743 33.989 33.989 31.960 2.029 19502 138 1 1 . 1 1 743 743 GLU H H 743 8.628 8.628 8.354 0.274 19502 139 1 1 . 1 1 744 744 PHE N N 744 120.078 120.078 125.403 -5.325 19502 140 1 1 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.784 0.031 19502 141 1 1 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.951 -0.780 19502 142 1 1 . 1 1 744 744 PHE CB C 744 40.375 40.375 38.910 1.466 19502 143 1 1 . 1 1 744 744 PHE H H 744 8.792 8.792 9.063 -0.271 19502 144 1 1 . 1 1 745 745 LYS N N 745 124.937 124.937 124.468 0.469 19502 145 1 1 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.780 -0.187 19502 146 1 1 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.239 0.831 19502 147 1 1 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.788 -2.243 19502 148 1 1 . 1 1 745 745 LYS H H 745 9.180 9.180 8.320 0.860 19502 149 1 1 . 1 1 746 746 LEU N N 746 129.002 129.002 124.486 4.516 19502 150 1 1 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.968 -0.044 19502 151 1 1 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.421 0.277 19502 152 1 1 . 1 1 746 746 LEU CB C 746 40.579 40.579 42.291 -1.712 19502 153 1 1 . 1 1 746 746 LEU H H 746 8.687 8.687 8.468 0.219 19502 154 1 1 . 1 1 747 747 VAL N N 747 131.114 131.114 127.326 3.788 19502 155 1 1 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.985 -0.240 19502 156 1 1 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.798 -0.664 19502 157 1 1 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.557 0.414 19502 158 1 1 . 1 1 747 747 VAL H H 747 9.033 9.033 9.066 -0.033 19502 159 1 1 . 1 1 748 748 ASP N N 748 113.346 113.346 115.971 -2.625 19502 160 1 1 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.839 -0.055 19502 161 1 1 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.808 0.526 19502 162 1 1 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.379 2.812 19502 163 1 1 . 1 1 748 748 ASP H H 748 7.426 7.426 7.546 -0.120 19502 164 1 1 . 1 1 749 749 GLN N N 749 120.867 120.867 121.790 -0.923 19502 165 1 1 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.986 0.084 19502 166 1 1 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.733 -0.130 19502 167 1 1 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.050 1.873 19502 168 1 1 . 1 1 749 749 GLN H H 749 7.647 7.647 8.441 -0.794 19502 169 1 1 . 1 1 750 750 SER N N 750 119.661 119.661 118.700 0.961 19502 170 1 1 . 1 1 750 750 SER HA H 750 4.791 4.791 4.688 0.103 19502 171 1 1 . 1 1 750 750 SER CA C 750 57.575 57.575 57.644 -0.069 19502 172 1 1 . 1 1 750 750 SER CB C 750 65.910 65.910 63.225 2.685 19502 173 1 1 . 1 1 750 750 SER H H 750 8.891 8.891 8.139 0.752 19502 174 1 1 . 1 1 751 751 GLY N N 751 106.531 106.531 111.909 -5.378 19502 175 1 1 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.552 -0.338 19502 176 1 1 . 1 1 751 751 GLY H H 751 8.183 8.183 8.082 0.101 19502 177 1 1 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.635 0.213 19502 178 1 1 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.167 0.371 19502 179 1 1 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.891 0.007 19502 180 1 1 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.244 -0.018 19502 181 1 1 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.861 0.484 19502 182 1 1 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.590 0.317 19502 183 1 1 . 1 1 754 754 HIS N N 754 109.780 109.780 112.623 -2.843 19502 184 1 1 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.708 0.050 19502 185 1 1 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.478 -0.249 19502 186 1 1 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.307 0.187 19502 187 1 1 . 1 1 754 754 HIS H H 754 7.707 7.707 7.892 -0.185 19502 188 1 1 . 1 1 755 755 GLU N N 755 122.843 122.843 120.624 2.219 19502 189 1 1 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.822 -0.210 19502 190 1 1 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.287 1.362 19502 191 1 1 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.613 0.201 19502 192 1 1 . 1 1 755 755 GLU H H 755 7.404 7.404 7.122 0.282 19502 193 1 1 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.239 0.378 19502 194 1 1 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.889 0.227 19502 195 1 1 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.807 1.444 19502 196 1 1 . 1 1 757 757 LYS N N 757 119.032 119.032 124.595 -5.563 19502 197 1 1 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.808 -0.204 19502 198 1 1 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.992 0.652 19502 199 1 1 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.825 1.371 19502 200 1 1 . 1 1 757 757 LYS H H 757 8.195 8.195 7.937 0.258 19502 201 1 1 . 1 1 758 758 PHE N N 758 120.288 120.288 126.050 -5.762 19502 202 1 1 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.917 0.123 19502 203 1 1 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.653 0.163 19502 204 1 1 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.482 2.818 19502 205 1 1 . 1 1 758 758 PHE H H 758 8.844 8.844 8.929 -0.085 19502 206 1 1 . 1 1 759 759 VAL N N 759 121.385 121.385 124.951 -3.566 19502 207 1 1 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.694 0.698 19502 208 1 1 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.381 -1.731 19502 209 1 1 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.360 1.878 19502 210 1 1 . 1 1 759 759 VAL H H 759 8.609 8.609 9.287 -0.678 19502 211 1 1 . 1 1 760 760 TYR N N 760 126.374 126.374 129.050 -2.676 19502 212 1 1 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.276 0.521 19502 213 1 1 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.970 -0.050 19502 214 1 1 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.850 4.003 19502 215 1 1 . 1 1 760 760 TYR H H 760 8.903 8.903 9.543 -0.640 19502 216 1 1 . 1 1 761 761 GLN N N 761 115.228 115.228 122.499 -7.271 19502 217 1 1 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.792 -0.968 19502 218 1 1 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.651 1.875 19502 219 1 1 . 1 1 761 761 GLN CB C 761 33.318 33.318 34.069 -0.751 19502 220 1 1 . 1 1 761 761 GLN H H 761 9.016 9.016 8.670 0.346 19502 221 1 1 . 1 1 762 762 ALA N N 762 128.023 128.023 129.189 -1.166 19502 222 1 1 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.660 0.521 19502 223 1 1 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.395 0.480 19502 224 1 1 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.715 0.436 19502 225 1 1 . 1 1 762 762 ALA H H 762 9.500 9.500 8.593 0.907 19502 226 1 1 . 1 1 763 763 LYS N N 763 122.022 122.022 127.423 -5.401 19502 227 1 1 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.522 0.342 19502 228 1 1 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.833 0.312 19502 229 1 1 . 1 1 763 763 LYS CB C 763 36.456 36.456 32.992 3.463 19502 230 1 1 . 1 1 763 763 LYS H H 763 8.347 8.347 8.789 -0.442 19502 231 1 1 . 1 1 764 764 VAL N N 764 123.980 123.980 128.251 -4.271 19502 232 1 1 . 1 1 764 764 VAL HA H 764 4.627 4.627 5.020 -0.393 19502 233 1 1 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.378 0.588 19502 234 1 1 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.268 4.552 19502 235 1 1 . 1 1 764 764 VAL H H 764 8.703 8.703 8.053 0.650 19502 236 1 1 . 1 1 765 765 GLY N N 765 119.292 119.292 118.100 1.192 19502 237 1 1 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.410 0.214 19502 238 1 1 . 1 1 765 765 GLY H H 765 9.151 9.151 8.882 0.269 19502 239 1 1 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.378 0.812 19502 240 1 1 . 1 1 767 767 ARG N N 767 119.571 119.571 120.391 -0.820 19502 241 1 1 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.742 -0.349 19502 242 1 1 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.671 0.678 19502 243 1 1 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.924 -0.605 19502 244 1 1 . 1 1 767 767 ARG H H 767 7.595 7.595 7.575 0.020 19502 245 1 1 . 1 1 768 768 TRP N N 768 122.976 122.976 122.204 0.772 19502 246 1 1 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.034 -0.464 19502 247 1 1 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.077 0.389 19502 248 1 1 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.121 0.097 19502 249 1 1 . 1 1 768 768 TRP H H 768 8.056 8.056 8.756 -0.700 19502 250 1 1 . 1 1 769 769 PHE N N 769 116.997 116.997 122.650 -5.653 19502 251 1 1 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.828 -0.078 19502 252 1 1 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.543 2.186 19502 253 1 1 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.250 -0.953 19502 254 1 1 . 1 1 769 769 PHE H H 769 7.532 7.532 8.748 -1.216 19502 255 1 1 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.735 -0.011 19502 256 1 1 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.830 2.469 19502 257 1 1 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.724 0.051 19502 258 1 1 . 1 1 771 771 ALA N N 771 125.979 125.979 122.446 3.533 19502 259 1 1 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.409 -0.175 19502 260 1 1 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.407 0.235 19502 261 1 1 . 1 1 771 771 ALA CB C 771 19.655 19.655 20.546 -0.891 19502 262 1 1 . 1 1 771 771 ALA H H 771 9.069 9.069 8.084 0.985 19502 263 1 1 . 1 1 772 772 VAL N N 772 113.901 113.901 119.359 -5.458 19502 264 1 1 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.793 0.018 19502 265 1 1 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.312 -0.163 19502 266 1 1 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.327 -0.081 19502 267 1 1 . 1 1 772 772 VAL H H 772 9.024 9.024 9.386 -0.362 19502 268 1 1 . 1 1 773 773 CYS N N 773 119.222 119.222 120.283 -1.061 19502 269 1 1 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.570 0.037 19502 270 1 1 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.404 1.353 19502 271 1 1 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.545 1.296 19502 272 1 1 . 1 1 773 773 CYS H H 773 8.597 8.597 8.439 0.158 19502 273 1 1 . 1 1 774 774 ALA N N 774 124.328 124.328 127.663 -3.335 19502 274 1 1 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.520 0.283 19502 275 1 1 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.508 0.723 19502 276 1 1 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.584 2.541 19502 277 1 1 . 1 1 774 774 ALA H H 774 9.238 9.238 8.634 0.604 19502 278 1 1 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.161 0.095 19502 279 1 1 . 1 1 775 775 HIS CA C 775 56.529 56.529 56.771 -0.242 19502 280 1 1 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.973 -0.840 19502 281 1 1 . 1 1 776 776 SER N N 776 110.366 110.366 111.008 -0.642 19502 282 1 1 . 1 1 776 776 SER HA H 776 4.766 4.766 4.698 0.068 19502 283 1 1 . 1 1 776 776 SER CA C 776 57.029 57.029 56.970 0.059 19502 284 1 1 . 1 1 776 776 SER H H 776 7.550 7.550 7.630 -0.080 19502 285 1 1 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.875 -0.288 19502 286 1 1 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.270 1.166 19502 287 1 1 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.134 0.070 19502 288 1 1 . 1 1 778 778 LYS N N 778 118.469 118.469 119.267 -0.798 19502 289 1 1 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.860 -0.096 19502 290 1 1 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.604 0.307 19502 291 1 1 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.988 1.697 19502 292 1 1 . 1 1 778 778 LYS H H 778 8.151 8.151 8.189 -0.038 19502 293 1 1 . 1 1 779 779 GLN N N 779 117.975 117.975 117.246 0.729 19502 294 1 1 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.961 0.052 19502 295 1 1 . 1 1 779 779 GLN CA C 779 57.909 57.909 59.065 -1.156 19502 296 1 1 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.360 0.200 19502 297 1 1 . 1 1 779 779 GLN H H 779 7.773 7.773 8.414 -0.641 19502 298 1 1 . 1 1 780 780 GLY N N 780 108.214 108.214 107.506 0.708 19502 299 1 1 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.899 1.112 19502 300 1 1 . 1 1 780 780 GLY H H 780 8.273 8.273 8.021 0.252 19502 301 1 1 . 1 1 781 781 LYS N N 781 120.027 120.027 120.843 -0.816 19502 302 1 1 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.666 -0.577 19502 303 1 1 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.887 0.471 19502 304 1 1 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.821 -0.135 19502 305 1 1 . 1 1 781 781 LYS H H 781 7.307 7.307 7.248 0.059 19502 306 1 1 . 1 1 782 782 GLN N N 782 117.131 117.131 118.188 -1.057 19502 307 1 1 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.931 -0.163 19502 308 1 1 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.534 0.261 19502 309 1 1 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.338 0.215 19502 310 1 1 . 1 1 782 782 GLN H H 782 7.227 7.227 7.550 -0.323 19502 311 1 1 . 1 1 783 783 GLU N N 783 117.958 117.958 119.578 -1.620 19502 312 1 1 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.026 0.177 19502 313 1 1 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.164 -0.200 19502 314 1 1 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.095 -0.136 19502 315 1 1 . 1 1 783 783 GLU H H 783 8.896 8.896 8.679 0.217 19502 316 1 1 . 1 1 784 784 ALA N N 784 124.176 124.176 122.309 1.867 19502 317 1 1 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.069 0.065 19502 318 1 1 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.282 -0.067 19502 319 1 1 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.464 -0.867 19502 320 1 1 . 1 1 784 784 ALA H H 784 8.532 8.532 8.104 0.428 19502 321 1 1 . 1 1 785 785 ALA N N 785 121.847 121.847 120.976 0.871 19502 322 1 1 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.994 0.048 19502 323 1 1 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.326 -0.157 19502 324 1 1 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.207 0.186 19502 325 1 1 . 1 1 785 785 ALA H H 785 8.402 8.402 8.193 0.209 19502 326 1 1 . 1 1 786 786 ASP N N 786 120.625 120.625 119.806 0.819 19502 327 1 1 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.245 -0.093 19502 328 1 1 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.952 0.219 19502 329 1 1 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.903 1.613 19502 330 1 1 . 1 1 786 786 ASP H H 786 8.524 8.524 8.386 0.138 19502 331 1 1 . 1 1 787 787 ALA N N 787 118.408 118.408 121.753 -3.345 19502 332 1 1 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.089 -0.113 19502 333 1 1 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.913 0.203 19502 334 1 1 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.380 -0.110 19502 335 1 1 . 1 1 787 787 ALA H H 787 8.191 8.191 7.800 0.391 19502 336 1 1 . 1 1 788 788 ALA N N 788 118.510 118.510 121.895 -3.385 19502 337 1 1 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.012 -0.308 19502 338 1 1 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.047 -0.154 19502 339 1 1 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.993 0.580 19502 340 1 1 . 1 1 788 788 ALA H H 788 7.533 7.533 8.035 -0.502 19502 341 1 1 . 1 1 789 789 LEU N N 789 117.413 117.413 118.241 -0.828 19502 342 1 1 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.770 -0.080 19502 343 1 1 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.993 0.187 19502 344 1 1 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.318 0.786 19502 345 1 1 . 1 1 789 789 LEU H H 789 8.520 8.520 8.109 0.411 19502 346 1 1 . 1 1 790 790 ARG N N 790 116.360 116.360 119.217 -2.857 19502 347 1 1 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.038 -0.120 19502 348 1 1 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.441 1.362 19502 349 1 1 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.916 -0.155 19502 350 1 1 . 1 1 790 790 ARG H H 790 8.293 8.293 7.675 0.618 19502 351 1 1 . 1 1 791 791 VAL N N 791 120.700 120.700 120.742 -0.042 19502 352 1 1 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.709 0.203 19502 353 1 1 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.185 0.299 19502 354 1 1 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.118 0.618 19502 355 1 1 . 1 1 791 791 VAL H H 791 7.455 7.455 8.115 -0.660 19502 356 1 1 . 1 1 792 792 LEU N N 792 120.706 120.706 119.784 0.922 19502 357 1 1 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.807 0.225 19502 358 1 1 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.132 -0.265 19502 359 1 1 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.067 1.180 19502 360 1 1 . 1 1 792 792 LEU H H 792 8.007 8.007 7.714 0.293 19502 361 1 1 . 1 1 793 793 ILE N N 793 118.876 118.876 118.334 0.542 19502 362 1 1 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.635 0.094 19502 363 1 1 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.486 -0.485 19502 364 1 1 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.492 1.463 19502 365 1 1 . 1 1 793 793 ILE H H 793 8.778 8.778 8.719 0.059 19502 366 1 1 . 1 1 794 794 GLY N N 794 107.008 107.008 107.029 -0.021 19502 367 1 1 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.990 -0.357 19502 368 1 1 . 1 1 794 794 GLY H H 794 7.810 7.810 8.145 -0.335 19502 369 1 1 . 1 1 795 795 GLU N N 795 119.866 119.866 119.457 0.409 19502 370 1 1 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.075 0.281 19502 371 1 1 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.757 -1.053 19502 372 1 1 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.522 0.558 19502 373 1 1 . 1 1 795 795 GLU H H 795 7.978 7.978 8.104 -0.126 19502 374 1 1 . 1 1 796 796 ASN N N 796 118.365 118.365 116.455 1.910 19502 375 1 1 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.721 0.061 19502 376 1 1 . 1 1 796 796 ASN CA C 796 54.582 54.582 54.728 -0.146 19502 377 1 1 . 1 1 796 796 ASN CB C 796 40.045 40.045 40.001 0.044 19502 378 1 1 . 1 1 796 796 ASN H H 796 8.053 8.053 7.487 0.566 19502 379 1 1 . 1 1 797 797 GLU N N 797 120.368 120.368 121.119 -0.751 19502 380 1 1 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.280 0.056 19502 381 1 1 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.056 -0.432 19502 382 1 1 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.421 0.921 19502 383 1 1 . 1 1 797 797 GLU H H 797 8.225 8.225 7.962 0.264 19502 384 1 1 . 1 1 798 798 LYS N N 798 120.614 120.614 118.252 2.362 19502 385 1 1 . 1 1 798 798 LYS H H 798 8.088 8.088 8.627 -0.539 19502 386 1 1 . 1 1 799 799 ALA N N 799 124.642 124.642 122.048 2.594 19502 387 1 1 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.414 0.027 19502 388 1 1 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.805 0.887 19502 389 1 1 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.706 -0.089 19502 390 1 1 . 1 1 799 799 ALA H H 799 8.138 8.138 7.662 0.476 19502 391 1 1 . 1 1 800 800 GLU N N 800 120.408 120.408 120.154 0.254 19502 392 1 1 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.342 0.053 19502 393 1 1 . 1 1 800 800 GLU CA C 800 56.810 56.810 57.041 -0.231 19502 394 1 1 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.432 1.172 19502 395 1 1 . 1 1 800 800 GLU H H 800 8.337 8.337 8.700 -0.363 19502 396 1 2 . 1 1 713 713 VAL N N 713 120.649 120.649 123.185 -2.536 19502 397 1 2 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.286 -0.166 19502 398 1 2 . 1 1 713 713 VAL CA C 713 63.009 63.009 59.878 3.131 19502 399 1 2 . 1 1 713 713 VAL CB C 713 32.747 32.747 35.421 -2.674 19502 400 1 2 . 1 1 713 713 VAL H H 713 8.051 8.051 7.989 0.062 19502 401 1 2 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.382 0.099 19502 402 1 2 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.322 1.433 19502 403 1 2 . 1 1 715 715 LYS CB C 715 33.015 33.015 31.818 1.197 19502 404 1 2 . 1 1 716 716 ILE N N 716 121.593 121.593 124.956 -3.363 19502 405 1 2 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.977 0.122 19502 406 1 2 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.072 0.757 19502 407 1 2 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.517 0.649 19502 408 1 2 . 1 1 716 716 ILE H H 716 8.406 8.406 7.795 0.611 19502 409 1 2 . 1 1 717 717 GLY N N 717 108.628 108.628 107.528 1.100 19502 410 1 2 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.865 -0.191 19502 411 1 2 . 1 1 717 717 GLY H H 717 8.476 8.476 8.722 -0.246 19502 412 1 2 . 1 1 718 718 GLU N N 718 119.944 119.944 121.429 -1.485 19502 413 1 2 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.213 0.064 19502 414 1 2 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.207 -0.020 19502 415 1 2 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.546 0.492 19502 416 1 2 . 1 1 718 718 GLU H H 718 8.055 8.055 7.536 0.519 19502 417 1 2 . 1 1 719 719 LEU N N 719 118.538 118.538 119.713 -1.175 19502 418 1 2 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.320 0.058 19502 419 1 2 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.448 -0.106 19502 420 1 2 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.959 1.081 19502 421 1 2 . 1 1 719 719 LEU H H 719 8.098 8.098 7.491 0.607 19502 422 1 2 . 1 1 720 720 VAL N N 720 117.613 117.613 118.522 -0.909 19502 423 1 2 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.689 0.015 19502 424 1 2 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.607 -0.988 19502 425 1 2 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.348 0.576 19502 426 1 2 . 1 1 720 720 VAL H H 720 7.838 7.838 7.611 0.227 19502 427 1 2 . 1 1 721 721 ARG N N 721 118.905 118.905 120.104 -1.199 19502 428 1 2 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.935 0.244 19502 429 1 2 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.425 -1.005 19502 430 1 2 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.389 0.198 19502 431 1 2 . 1 1 721 721 ARG H H 721 7.614 7.614 7.425 0.189 19502 432 1 2 . 1 1 722 722 TYR N N 722 117.574 117.574 118.126 -0.552 19502 433 1 2 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.358 -0.009 19502 434 1 2 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.102 -1.037 19502 435 1 2 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.362 0.469 19502 436 1 2 . 1 1 722 722 TYR H H 722 7.885 7.885 7.495 0.390 19502 437 1 2 . 1 1 723 723 LEU N N 723 120.520 120.520 117.302 3.218 19502 438 1 2 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.096 -0.101 19502 439 1 2 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.849 0.706 19502 440 1 2 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.772 0.266 19502 441 1 2 . 1 1 723 723 LEU H H 723 7.794 7.794 7.459 0.335 19502 442 1 2 . 1 1 724 724 ASN N N 724 115.161 115.161 115.043 0.118 19502 443 1 2 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.777 -0.165 19502 444 1 2 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.142 0.095 19502 445 1 2 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.200 0.077 19502 446 1 2 . 1 1 724 724 ASN H H 724 8.892 8.892 7.767 1.125 19502 447 1 2 . 1 1 725 725 THR N N 725 110.273 110.273 113.933 -3.660 19502 448 1 2 . 1 1 725 725 THR HA H 725 4.527 4.527 4.338 0.189 19502 449 1 2 . 1 1 725 725 THR CA C 725 62.903 62.903 63.475 -0.572 19502 450 1 2 . 1 1 725 725 THR CB C 725 70.619 70.619 70.029 0.590 19502 451 1 2 . 1 1 725 725 THR H H 725 7.874 7.874 7.689 0.185 19502 452 1 2 . 1 1 726 726 ASN N N 726 117.048 117.048 119.364 -2.316 19502 453 1 2 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.193 -0.054 19502 454 1 2 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.156 1.682 19502 455 1 2 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.816 -1.909 19502 456 1 2 . 1 1 726 726 ASN H H 726 8.613 8.613 8.080 0.533 19502 457 1 2 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.355 -0.291 19502 458 1 2 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.233 0.276 19502 459 1 2 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.534 -1.089 19502 460 1 2 . 1 1 728 728 VAL N N 728 118.643 118.643 118.852 -0.209 19502 461 1 2 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.668 -0.268 19502 462 1 2 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.425 1.141 19502 463 1 2 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.008 0.418 19502 464 1 2 . 1 1 728 728 VAL H H 728 8.182 8.182 7.640 0.542 19502 465 1 2 . 1 1 729 729 GLY N N 729 105.307 105.307 107.177 -1.870 19502 466 1 2 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.680 0.970 19502 467 1 2 . 1 1 729 729 GLY H H 729 7.297 7.297 8.440 -1.143 19502 468 1 2 . 1 1 730 730 GLY N N 730 109.038 109.038 109.781 -0.743 19502 469 1 2 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.182 0.510 19502 470 1 2 . 1 1 730 730 GLY H H 730 8.080 8.080 7.562 0.518 19502 471 1 2 . 1 1 731 731 LEU N N 731 123.822 123.822 123.469 0.353 19502 472 1 2 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.050 -0.014 19502 473 1 2 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.380 0.216 19502 474 1 2 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.544 0.671 19502 475 1 2 . 1 1 731 731 LEU H H 731 8.287 8.287 8.150 0.137 19502 476 1 2 . 1 1 732 732 LEU N N 732 118.759 118.759 118.821 -0.062 19502 477 1 2 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.885 0.201 19502 478 1 2 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.165 0.343 19502 479 1 2 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.409 -0.426 19502 480 1 2 . 1 1 732 732 LEU H H 732 8.412 8.412 8.074 0.338 19502 481 1 2 . 1 1 733 733 GLU N N 733 121.155 121.155 119.791 1.364 19502 482 1 2 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.962 0.311 19502 483 1 2 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.041 0.032 19502 484 1 2 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.144 -0.164 19502 485 1 2 . 1 1 733 733 GLU H H 733 8.003 8.003 8.086 -0.083 19502 486 1 2 . 1 1 734 734 TYR N N 734 122.518 122.518 121.435 1.083 19502 487 1 2 . 1 1 734 734 TYR HA H 734 4.181 4.181 4.011 0.170 19502 488 1 2 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.528 0.431 19502 489 1 2 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.256 -0.412 19502 490 1 2 . 1 1 734 734 TYR H H 734 8.419 8.419 8.375 0.044 19502 491 1 2 . 1 1 735 735 ALA N N 735 122.353 122.353 121.279 1.074 19502 492 1 2 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.821 -0.009 19502 493 1 2 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.120 1.052 19502 494 1 2 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.568 0.265 19502 495 1 2 . 1 1 735 735 ALA H H 735 8.777 8.777 8.083 0.694 19502 496 1 2 . 1 1 736 736 ARG N N 736 118.852 118.852 117.471 1.381 19502 497 1 2 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.075 0.098 19502 498 1 2 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.682 0.841 19502 499 1 2 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.861 0.295 19502 500 1 2 . 1 1 736 736 ARG H H 736 8.570 8.570 8.275 0.295 19502 501 1 2 . 1 1 737 737 SER N N 737 115.125 115.125 115.332 -0.207 19502 502 1 2 . 1 1 737 737 SER HA H 737 4.149 4.149 4.312 -0.163 19502 503 1 2 . 1 1 737 737 SER CA C 737 61.300 61.300 61.176 0.124 19502 504 1 2 . 1 1 737 737 SER CB C 737 63.166 63.166 63.444 -0.278 19502 505 1 2 . 1 1 737 737 SER H H 737 8.257 8.257 8.126 0.131 19502 506 1 2 . 1 1 738 738 HIS N N 738 117.591 117.591 116.776 0.815 19502 507 1 2 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.342 -0.002 19502 508 1 2 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.458 1.550 19502 509 1 2 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.124 0.406 19502 510 1 2 . 1 1 738 738 HIS H H 738 7.300 7.300 7.701 -0.401 19502 511 1 2 . 1 1 739 739 GLY N N 739 107.604 107.604 107.687 -0.083 19502 512 1 2 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.127 1.004 19502 513 1 2 . 1 1 739 739 GLY H H 739 7.638 7.638 7.669 -0.031 19502 514 1 2 . 1 1 740 740 PHE N N 740 118.114 118.114 119.965 -1.851 19502 515 1 2 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.609 0.578 19502 516 1 2 . 1 1 740 740 PHE CA C 740 54.403 54.403 55.733 -1.330 19502 517 1 2 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.026 2.956 19502 518 1 2 . 1 1 740 740 PHE H H 740 8.138 8.138 7.605 0.533 19502 519 1 2 . 1 1 741 741 ALA N N 741 122.577 122.577 123.260 -0.683 19502 520 1 2 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.451 0.204 19502 521 1 2 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.797 0.474 19502 522 1 2 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.928 0.048 19502 523 1 2 . 1 1 741 741 ALA H H 741 8.550 8.550 8.529 0.021 19502 524 1 2 . 1 1 742 742 ALA N N 742 124.016 124.016 129.023 -5.007 19502 525 1 2 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.531 0.375 19502 526 1 2 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.451 -0.422 19502 527 1 2 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.091 1.269 19502 528 1 2 . 1 1 742 742 ALA H H 742 8.511 8.511 8.686 -0.175 19502 529 1 2 . 1 1 743 743 GLU N N 743 120.968 120.968 124.475 -3.507 19502 530 1 2 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.643 -0.093 19502 531 1 2 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.746 0.020 19502 532 1 2 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.914 1.075 19502 533 1 2 . 1 1 743 743 GLU H H 743 8.628 8.628 8.551 0.077 19502 534 1 2 . 1 1 744 744 PHE N N 744 120.078 120.078 123.781 -3.703 19502 535 1 2 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.937 -0.122 19502 536 1 2 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.501 -0.330 19502 537 1 2 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.025 0.350 19502 538 1 2 . 1 1 744 744 PHE H H 744 8.792 8.792 8.943 -0.151 19502 539 1 2 . 1 1 745 745 LYS N N 745 124.937 124.937 125.053 -0.116 19502 540 1 2 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.854 -0.261 19502 541 1 2 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.469 0.601 19502 542 1 2 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.606 -2.061 19502 543 1 2 . 1 1 745 745 LYS H H 745 9.180 9.180 8.301 0.879 19502 544 1 2 . 1 1 746 746 LEU N N 746 129.002 129.002 124.660 4.342 19502 545 1 2 . 1 1 746 746 LEU HA H 746 3.924 3.924 4.137 -0.213 19502 546 1 2 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.175 0.523 19502 547 1 2 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.209 -0.630 19502 548 1 2 . 1 1 746 746 LEU H H 746 8.687 8.687 8.479 0.208 19502 549 1 2 . 1 1 747 747 VAL N N 747 131.114 131.114 127.241 3.873 19502 550 1 2 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.793 -0.048 19502 551 1 2 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.516 -0.382 19502 552 1 2 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.305 0.666 19502 553 1 2 . 1 1 747 747 VAL H H 747 9.033 9.033 8.840 0.193 19502 554 1 2 . 1 1 748 748 ASP N N 748 113.346 113.346 117.067 -3.721 19502 555 1 2 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.722 0.062 19502 556 1 2 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.742 0.592 19502 557 1 2 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.753 2.438 19502 558 1 2 . 1 1 748 748 ASP H H 748 7.426 7.426 7.557 -0.131 19502 559 1 2 . 1 1 749 749 GLN N N 749 120.867 120.867 123.606 -2.739 19502 560 1 2 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.122 -0.052 19502 561 1 2 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.851 -0.248 19502 562 1 2 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.244 1.679 19502 563 1 2 . 1 1 749 749 GLN H H 749 7.647 7.647 8.643 -0.996 19502 564 1 2 . 1 1 750 750 SER N N 750 119.661 119.661 121.149 -1.488 19502 565 1 2 . 1 1 750 750 SER HA H 750 4.791 4.791 4.998 -0.207 19502 566 1 2 . 1 1 750 750 SER CA C 750 57.575 57.575 57.221 0.354 19502 567 1 2 . 1 1 750 750 SER CB C 750 65.910 65.910 64.823 1.087 19502 568 1 2 . 1 1 750 750 SER H H 750 8.891 8.891 8.210 0.681 19502 569 1 2 . 1 1 751 751 GLY N N 751 106.531 106.531 108.480 -1.949 19502 570 1 2 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.313 -0.099 19502 571 1 2 . 1 1 751 751 GLY H H 751 8.183 8.183 8.092 0.091 19502 572 1 2 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.723 0.125 19502 573 1 2 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.041 0.497 19502 574 1 2 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.724 0.174 19502 575 1 2 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.254 -0.028 19502 576 1 2 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.743 0.602 19502 577 1 2 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.537 0.370 19502 578 1 2 . 1 1 754 754 HIS N N 754 109.780 109.780 112.355 -2.575 19502 579 1 2 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.786 -0.028 19502 580 1 2 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.179 0.050 19502 581 1 2 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.301 0.193 19502 582 1 2 . 1 1 754 754 HIS H H 754 7.707 7.707 7.764 -0.057 19502 583 1 2 . 1 1 755 755 GLU N N 755 122.843 122.843 120.531 2.312 19502 584 1 2 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.856 -0.244 19502 585 1 2 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.629 1.020 19502 586 1 2 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.182 -0.369 19502 587 1 2 . 1 1 755 755 GLU H H 755 7.404 7.404 7.485 -0.081 19502 588 1 2 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.500 0.117 19502 589 1 2 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.166 0.951 19502 590 1 2 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.543 1.708 19502 591 1 2 . 1 1 757 757 LYS N N 757 119.032 119.032 125.354 -6.322 19502 592 1 2 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.618 -0.014 19502 593 1 2 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.777 0.867 19502 594 1 2 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.066 2.130 19502 595 1 2 . 1 1 757 757 LYS H H 757 8.195 8.195 8.877 -0.682 19502 596 1 2 . 1 1 758 758 PHE N N 758 120.288 120.288 127.789 -7.501 19502 597 1 2 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.923 0.117 19502 598 1 2 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.717 0.099 19502 599 1 2 . 1 1 758 758 PHE CB C 758 43.300 43.300 39.649 3.651 19502 600 1 2 . 1 1 758 758 PHE H H 758 8.844 8.844 9.437 -0.593 19502 601 1 2 . 1 1 759 759 VAL N N 759 121.385 121.385 124.648 -3.263 19502 602 1 2 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.414 0.978 19502 603 1 2 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.867 -1.217 19502 604 1 2 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.531 2.707 19502 605 1 2 . 1 1 759 759 VAL H H 759 8.609 8.609 9.117 -0.508 19502 606 1 2 . 1 1 760 760 TYR N N 760 126.374 126.374 128.370 -1.996 19502 607 1 2 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.163 0.634 19502 608 1 2 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.540 -0.620 19502 609 1 2 . 1 1 760 760 TYR CB C 760 46.853 46.853 41.557 5.296 19502 610 1 2 . 1 1 760 760 TYR H H 760 8.903 8.903 9.436 -0.533 19502 611 1 2 . 1 1 761 761 GLN N N 761 115.228 115.228 122.626 -7.398 19502 612 1 2 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.783 -0.959 19502 613 1 2 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.782 1.744 19502 614 1 2 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.827 -0.509 19502 615 1 2 . 1 1 761 761 GLN H H 761 9.016 9.016 8.569 0.447 19502 616 1 2 . 1 1 762 762 ALA N N 762 128.023 128.023 129.893 -1.870 19502 617 1 2 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.472 0.709 19502 618 1 2 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.861 0.014 19502 619 1 2 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.623 0.528 19502 620 1 2 . 1 1 762 762 ALA H H 762 9.500 9.500 8.461 1.039 19502 621 1 2 . 1 1 763 763 LYS N N 763 122.022 122.022 127.099 -5.077 19502 622 1 2 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.414 0.450 19502 623 1 2 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.913 0.233 19502 624 1 2 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.216 3.240 19502 625 1 2 . 1 1 763 763 LYS H H 763 8.347 8.347 8.820 -0.473 19502 626 1 2 . 1 1 764 764 VAL N N 764 123.980 123.980 127.595 -3.615 19502 627 1 2 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.426 0.201 19502 628 1 2 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.144 0.822 19502 629 1 2 . 1 1 764 764 VAL CB C 764 34.820 34.820 32.211 2.609 19502 630 1 2 . 1 1 764 764 VAL H H 764 8.703 8.703 8.672 0.031 19502 631 1 2 . 1 1 765 765 GLY N N 765 119.292 119.292 116.984 2.308 19502 632 1 2 . 1 1 765 765 GLY CA C 765 46.623 46.623 45.836 0.787 19502 633 1 2 . 1 1 765 765 GLY H H 765 9.151 9.151 8.556 0.595 19502 634 1 2 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.689 0.501 19502 635 1 2 . 1 1 767 767 ARG N N 767 119.571 119.571 121.898 -2.327 19502 636 1 2 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.608 -0.215 19502 637 1 2 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.168 1.181 19502 638 1 2 . 1 1 767 767 ARG CB C 767 32.319 32.319 30.929 1.390 19502 639 1 2 . 1 1 767 767 ARG H H 767 7.595 7.595 7.423 0.172 19502 640 1 2 . 1 1 768 768 TRP N N 768 122.976 122.976 125.804 -2.828 19502 641 1 2 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.100 -0.530 19502 642 1 2 . 1 1 768 768 TRP CA C 768 56.466 56.466 55.969 0.497 19502 643 1 2 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.120 1.098 19502 644 1 2 . 1 1 768 768 TRP H H 768 8.056 8.056 8.908 -0.852 19502 645 1 2 . 1 1 769 769 PHE N N 769 116.997 116.997 122.667 -5.670 19502 646 1 2 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.860 -0.110 19502 647 1 2 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.187 2.542 19502 648 1 2 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.470 -1.173 19502 649 1 2 . 1 1 769 769 PHE H H 769 7.532 7.532 8.614 -1.082 19502 650 1 2 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.718 0.006 19502 651 1 2 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.819 2.480 19502 652 1 2 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.743 0.032 19502 653 1 2 . 1 1 771 771 ALA N N 771 125.979 125.979 122.782 3.197 19502 654 1 2 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.159 0.075 19502 655 1 2 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.576 0.066 19502 656 1 2 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.124 0.531 19502 657 1 2 . 1 1 771 771 ALA H H 771 9.069 9.069 8.252 0.817 19502 658 1 2 . 1 1 772 772 VAL N N 772 113.901 113.901 118.494 -4.593 19502 659 1 2 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.823 -0.012 19502 660 1 2 . 1 1 772 772 VAL CA C 772 59.149 59.149 60.076 -0.927 19502 661 1 2 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.185 1.061 19502 662 1 2 . 1 1 772 772 VAL H H 772 9.024 9.024 9.118 -0.094 19502 663 1 2 . 1 1 773 773 CYS N N 773 119.222 119.222 124.076 -4.854 19502 664 1 2 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.335 0.272 19502 665 1 2 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.886 0.872 19502 666 1 2 . 1 1 773 773 CYS CB C 773 29.841 29.841 26.124 3.717 19502 667 1 2 . 1 1 773 773 CYS H H 773 8.597 8.597 8.850 -0.253 19502 668 1 2 . 1 1 774 774 ALA N N 774 124.328 124.328 127.642 -3.314 19502 669 1 2 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.839 -0.036 19502 670 1 2 . 1 1 774 774 ALA CA C 774 51.231 51.231 51.037 0.194 19502 671 1 2 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.677 2.448 19502 672 1 2 . 1 1 774 774 ALA H H 774 9.238 9.238 9.024 0.214 19502 673 1 2 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.015 0.241 19502 674 1 2 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.101 1.428 19502 675 1 2 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.807 0.326 19502 676 1 2 . 1 1 776 776 SER N N 776 110.366 110.366 113.354 -2.988 19502 677 1 2 . 1 1 776 776 SER HA H 776 4.766 4.766 4.695 0.071 19502 678 1 2 . 1 1 776 776 SER CA C 776 57.029 57.029 55.828 1.201 19502 679 1 2 . 1 1 776 776 SER H H 776 7.550 7.550 7.660 -0.110 19502 680 1 2 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.684 -0.097 19502 681 1 2 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.307 1.129 19502 682 1 2 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.918 0.286 19502 683 1 2 . 1 1 778 778 LYS N N 778 118.469 118.469 118.235 0.234 19502 684 1 2 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.830 -0.066 19502 685 1 2 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.778 1.133 19502 686 1 2 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.750 1.935 19502 687 1 2 . 1 1 778 778 LYS H H 778 8.151 8.151 7.906 0.245 19502 688 1 2 . 1 1 779 779 GLN N N 779 117.975 117.975 117.837 0.138 19502 689 1 2 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.991 0.022 19502 690 1 2 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.731 -0.822 19502 691 1 2 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.493 0.067 19502 692 1 2 . 1 1 779 779 GLN H H 779 7.773 7.773 7.836 -0.063 19502 693 1 2 . 1 1 780 780 GLY N N 780 108.214 108.214 108.241 -0.027 19502 694 1 2 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.177 0.834 19502 695 1 2 . 1 1 780 780 GLY H H 780 8.273 8.273 8.350 -0.077 19502 696 1 2 . 1 1 781 781 LYS N N 781 120.027 120.027 121.433 -1.406 19502 697 1 2 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.518 -0.429 19502 698 1 2 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.495 0.863 19502 699 1 2 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.771 -0.085 19502 700 1 2 . 1 1 781 781 LYS H H 781 7.307 7.307 7.087 0.220 19502 701 1 2 . 1 1 782 782 GLN N N 782 117.131 117.131 118.545 -1.414 19502 702 1 2 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.873 -0.105 19502 703 1 2 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.279 0.516 19502 704 1 2 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.632 -0.079 19502 705 1 2 . 1 1 782 782 GLN H H 782 7.227 7.227 7.459 -0.232 19502 706 1 2 . 1 1 783 783 GLU N N 783 117.958 117.958 119.160 -1.202 19502 707 1 2 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.063 0.140 19502 708 1 2 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.944 0.020 19502 709 1 2 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.038 -0.079 19502 710 1 2 . 1 1 783 783 GLU H H 783 8.896 8.896 8.810 0.085 19502 711 1 2 . 1 1 784 784 ALA N N 784 124.176 124.176 122.845 1.331 19502 712 1 2 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.045 0.089 19502 713 1 2 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.366 -0.151 19502 714 1 2 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.385 -0.788 19502 715 1 2 . 1 1 784 784 ALA H H 784 8.532 8.532 7.836 0.696 19502 716 1 2 . 1 1 785 785 ALA N N 785 121.847 121.847 120.630 1.217 19502 717 1 2 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.970 0.072 19502 718 1 2 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.356 -0.187 19502 719 1 2 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.192 0.201 19502 720 1 2 . 1 1 785 785 ALA H H 785 8.402 8.402 8.019 0.383 19502 721 1 2 . 1 1 786 786 ASP N N 786 120.625 120.625 119.859 0.766 19502 722 1 2 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.257 -0.105 19502 723 1 2 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.780 0.391 19502 724 1 2 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.881 1.635 19502 725 1 2 . 1 1 786 786 ASP H H 786 8.524 8.524 8.358 0.166 19502 726 1 2 . 1 1 787 787 ALA N N 787 118.408 118.408 121.408 -3.000 19502 727 1 2 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.152 -0.176 19502 728 1 2 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.697 0.419 19502 729 1 2 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.400 -0.130 19502 730 1 2 . 1 1 787 787 ALA H H 787 8.191 8.191 8.184 0.007 19502 731 1 2 . 1 1 788 788 ALA N N 788 118.510 118.510 122.015 -3.505 19502 732 1 2 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.087 -0.383 19502 733 1 2 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.926 -0.033 19502 734 1 2 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.051 0.522 19502 735 1 2 . 1 1 788 788 ALA H H 788 7.533 7.533 8.043 -0.510 19502 736 1 2 . 1 1 789 789 LEU N N 789 117.413 117.413 118.036 -0.623 19502 737 1 2 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.850 -0.160 19502 738 1 2 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.673 0.507 19502 739 1 2 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.154 0.950 19502 740 1 2 . 1 1 789 789 LEU H H 789 8.520 8.520 7.889 0.631 19502 741 1 2 . 1 1 790 790 ARG N N 790 116.360 116.360 119.379 -3.019 19502 742 1 2 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.019 -0.101 19502 743 1 2 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.626 2.177 19502 744 1 2 . 1 1 790 790 ARG CB C 790 29.761 29.761 28.991 0.770 19502 745 1 2 . 1 1 790 790 ARG H H 790 8.293 8.293 7.849 0.444 19502 746 1 2 . 1 1 791 791 VAL N N 791 120.700 120.700 120.016 0.684 19502 747 1 2 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.684 0.228 19502 748 1 2 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.561 -0.077 19502 749 1 2 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.416 0.320 19502 750 1 2 . 1 1 791 791 VAL H H 791 7.455 7.455 7.624 -0.169 19502 751 1 2 . 1 1 792 792 LEU N N 792 120.706 120.706 118.946 1.760 19502 752 1 2 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.816 0.216 19502 753 1 2 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.909 -0.042 19502 754 1 2 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.286 0.961 19502 755 1 2 . 1 1 792 792 LEU H H 792 8.007 8.007 7.485 0.522 19502 756 1 2 . 1 1 793 793 ILE N N 793 118.876 118.876 118.509 0.367 19502 757 1 2 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.694 0.035 19502 758 1 2 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.364 -0.363 19502 759 1 2 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.560 1.395 19502 760 1 2 . 1 1 793 793 ILE H H 793 8.778 8.778 8.636 0.142 19502 761 1 2 . 1 1 794 794 GLY N N 794 107.008 107.008 107.713 -0.705 19502 762 1 2 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.919 -0.285 19502 763 1 2 . 1 1 794 794 GLY H H 794 7.810 7.810 8.405 -0.595 19502 764 1 2 . 1 1 795 795 GLU N N 795 119.866 119.866 118.242 1.624 19502 765 1 2 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.149 0.207 19502 766 1 2 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.326 -0.622 19502 767 1 2 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.904 0.176 19502 768 1 2 . 1 1 795 795 GLU H H 795 7.978 7.978 7.681 0.297 19502 769 1 2 . 1 1 796 796 ASN N N 796 118.365 118.365 116.338 2.027 19502 770 1 2 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.785 -0.003 19502 771 1 2 . 1 1 796 796 ASN CA C 796 54.582 54.582 53.379 1.203 19502 772 1 2 . 1 1 796 796 ASN CB C 796 40.045 40.045 40.375 -0.330 19502 773 1 2 . 1 1 796 796 ASN H H 796 8.053 8.053 7.603 0.450 19502 774 1 2 . 1 1 797 797 GLU N N 797 120.368 120.368 123.522 -3.154 19502 775 1 2 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.178 0.158 19502 776 1 2 . 1 1 797 797 GLU CA C 797 57.624 57.624 57.525 0.099 19502 777 1 2 . 1 1 797 797 GLU CB C 797 30.342 30.342 28.800 1.542 19502 778 1 2 . 1 1 797 797 GLU H H 797 8.225 8.225 8.241 -0.016 19502 779 1 2 . 1 1 798 798 LYS N N 798 120.614 120.614 121.016 -0.402 19502 780 1 2 . 1 1 798 798 LYS H H 798 8.088 8.088 8.486 -0.398 19502 781 1 2 . 1 1 799 799 ALA N N 799 124.642 124.642 121.261 3.381 19502 782 1 2 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.586 -0.145 19502 783 1 2 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.410 1.282 19502 784 1 2 . 1 1 799 799 ALA CB C 799 19.617 19.617 21.278 -1.661 19502 785 1 2 . 1 1 799 799 ALA H H 799 8.138 8.138 7.603 0.535 19502 786 1 2 . 1 1 800 800 GLU N N 800 120.408 120.408 121.798 -1.390 19502 787 1 2 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.506 -0.111 19502 788 1 2 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.834 0.977 19502 789 1 2 . 1 1 800 800 GLU CB C 800 30.604 30.604 28.803 1.801 19502 790 1 2 . 1 1 800 800 GLU H H 800 8.337 8.337 8.546 -0.209 19502 791 1 3 . 1 1 713 713 VAL N N 713 120.649 120.649 122.435 -1.786 19502 792 1 3 . 1 1 713 713 VAL HA H 713 4.120 4.120 3.884 0.236 19502 793 1 3 . 1 1 713 713 VAL CA C 713 63.009 63.009 63.755 -0.746 19502 794 1 3 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.021 0.726 19502 795 1 3 . 1 1 713 713 VAL H H 713 8.051 8.051 8.245 -0.194 19502 796 1 3 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.068 0.413 19502 797 1 3 . 1 1 715 715 LYS CA C 715 56.754 56.754 57.297 -0.543 19502 798 1 3 . 1 1 715 715 LYS CB C 715 33.015 33.015 31.314 1.701 19502 799 1 3 . 1 1 716 716 ILE N N 716 121.593 121.593 118.131 3.462 19502 800 1 3 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.121 -0.022 19502 801 1 3 . 1 1 716 716 ILE CA C 716 62.829 62.829 63.029 -0.200 19502 802 1 3 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.149 1.017 19502 803 1 3 . 1 1 716 716 ILE H H 716 8.406 8.406 8.243 0.163 19502 804 1 3 . 1 1 717 717 GLY N N 717 108.628 108.628 108.314 0.314 19502 805 1 3 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.104 -0.430 19502 806 1 3 . 1 1 717 717 GLY H H 717 8.476 8.476 8.679 -0.203 19502 807 1 3 . 1 1 718 718 GLU N N 718 119.944 119.944 121.235 -1.291 19502 808 1 3 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.173 0.104 19502 809 1 3 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.491 -0.304 19502 810 1 3 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.114 0.923 19502 811 1 3 . 1 1 718 718 GLU H H 718 8.055 8.055 7.719 0.336 19502 812 1 3 . 1 1 719 719 LEU N N 719 118.538 118.538 119.461 -0.923 19502 813 1 3 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.378 -0.000 19502 814 1 3 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.853 0.489 19502 815 1 3 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.828 1.212 19502 816 1 3 . 1 1 719 719 LEU H H 719 8.098 8.098 7.784 0.314 19502 817 1 3 . 1 1 720 720 VAL N N 720 117.613 117.613 118.962 -1.349 19502 818 1 3 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.650 0.054 19502 819 1 3 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.673 -1.054 19502 820 1 3 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.234 0.690 19502 821 1 3 . 1 1 720 720 VAL H H 720 7.838 7.838 7.590 0.248 19502 822 1 3 . 1 1 721 721 ARG N N 721 118.905 118.905 120.021 -1.116 19502 823 1 3 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.965 0.214 19502 824 1 3 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.221 -0.802 19502 825 1 3 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.617 -0.031 19502 826 1 3 . 1 1 721 721 ARG H H 721 7.614 7.614 7.650 -0.036 19502 827 1 3 . 1 1 722 722 TYR N N 722 117.574 117.574 117.295 0.279 19502 828 1 3 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.379 -0.030 19502 829 1 3 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.915 -0.850 19502 830 1 3 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.376 0.455 19502 831 1 3 . 1 1 722 722 TYR H H 722 7.885 7.885 7.536 0.349 19502 832 1 3 . 1 1 723 723 LEU N N 723 120.520 120.520 117.569 2.951 19502 833 1 3 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.097 -0.102 19502 834 1 3 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.907 0.648 19502 835 1 3 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.895 0.143 19502 836 1 3 . 1 1 723 723 LEU H H 723 7.794 7.794 7.594 0.200 19502 837 1 3 . 1 1 724 724 ASN N N 724 115.161 115.161 115.939 -0.778 19502 838 1 3 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.668 -0.056 19502 839 1 3 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.212 0.025 19502 840 1 3 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.176 0.101 19502 841 1 3 . 1 1 724 724 ASN H H 724 8.892 8.892 7.724 1.168 19502 842 1 3 . 1 1 725 725 THR N N 725 110.273 110.273 114.962 -4.689 19502 843 1 3 . 1 1 725 725 THR HA H 725 4.527 4.527 4.290 0.237 19502 844 1 3 . 1 1 725 725 THR CA C 725 62.903 62.903 64.685 -1.782 19502 845 1 3 . 1 1 725 725 THR CB C 725 70.619 70.619 69.655 0.964 19502 846 1 3 . 1 1 725 725 THR H H 725 7.874 7.874 7.762 0.112 19502 847 1 3 . 1 1 726 726 ASN N N 726 117.048 117.048 117.819 -0.771 19502 848 1 3 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.080 0.059 19502 849 1 3 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.751 1.087 19502 850 1 3 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.901 -1.994 19502 851 1 3 . 1 1 726 726 ASN H H 726 8.613 8.613 7.924 0.689 19502 852 1 3 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.362 -0.298 19502 853 1 3 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.229 0.280 19502 854 1 3 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.329 -0.884 19502 855 1 3 . 1 1 728 728 VAL N N 728 118.643 118.643 118.962 -0.319 19502 856 1 3 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.695 -0.295 19502 857 1 3 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.487 1.079 19502 858 1 3 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.634 0.793 19502 859 1 3 . 1 1 728 728 VAL H H 728 8.182 8.182 7.760 0.422 19502 860 1 3 . 1 1 729 729 GLY N N 729 105.307 105.307 107.205 -1.898 19502 861 1 3 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.689 0.961 19502 862 1 3 . 1 1 729 729 GLY H H 729 7.297 7.297 8.460 -1.163 19502 863 1 3 . 1 1 730 730 GLY N N 730 109.038 109.038 109.553 -0.515 19502 864 1 3 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.899 0.793 19502 865 1 3 . 1 1 730 730 GLY H H 730 8.080 8.080 7.429 0.651 19502 866 1 3 . 1 1 731 731 LEU N N 731 123.822 123.822 123.585 0.237 19502 867 1 3 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.039 -0.003 19502 868 1 3 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.474 0.123 19502 869 1 3 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.603 0.612 19502 870 1 3 . 1 1 731 731 LEU H H 731 8.287 8.287 8.343 -0.056 19502 871 1 3 . 1 1 732 732 LEU N N 732 118.759 118.759 118.158 0.601 19502 872 1 3 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.949 0.137 19502 873 1 3 . 1 1 732 732 LEU CA C 732 58.508 58.508 57.981 0.527 19502 874 1 3 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.383 -0.399 19502 875 1 3 . 1 1 732 732 LEU H H 732 8.412 8.412 8.020 0.392 19502 876 1 3 . 1 1 733 733 GLU N N 733 121.155 121.155 120.224 0.931 19502 877 1 3 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.965 0.308 19502 878 1 3 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.050 0.023 19502 879 1 3 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.097 -0.117 19502 880 1 3 . 1 1 733 733 GLU H H 733 8.003 8.003 7.924 0.079 19502 881 1 3 . 1 1 734 734 TYR N N 734 122.518 122.518 121.329 1.189 19502 882 1 3 . 1 1 734 734 TYR HA H 734 4.181 4.181 4.011 0.170 19502 883 1 3 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.513 0.446 19502 884 1 3 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.220 -0.376 19502 885 1 3 . 1 1 734 734 TYR H H 734 8.419 8.419 8.526 -0.107 19502 886 1 3 . 1 1 735 735 ALA N N 735 122.353 122.353 121.117 1.236 19502 887 1 3 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.805 0.007 19502 888 1 3 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.955 1.217 19502 889 1 3 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.599 0.235 19502 890 1 3 . 1 1 735 735 ALA H H 735 8.777 8.777 7.814 0.963 19502 891 1 3 . 1 1 736 736 ARG N N 736 118.852 118.852 118.228 0.624 19502 892 1 3 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.022 0.151 19502 893 1 3 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.784 0.739 19502 894 1 3 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.776 0.380 19502 895 1 3 . 1 1 736 736 ARG H H 736 8.570 8.570 8.451 0.119 19502 896 1 3 . 1 1 737 737 SER N N 737 115.125 115.125 113.451 1.674 19502 897 1 3 . 1 1 737 737 SER HA H 737 4.149 4.149 4.368 -0.219 19502 898 1 3 . 1 1 737 737 SER CA C 737 61.300 61.300 60.255 1.045 19502 899 1 3 . 1 1 737 737 SER CB C 737 63.166 63.166 63.470 -0.304 19502 900 1 3 . 1 1 737 737 SER H H 737 8.257 8.257 8.264 -0.007 19502 901 1 3 . 1 1 738 738 HIS N N 738 117.591 117.591 116.518 1.073 19502 902 1 3 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.512 -0.172 19502 903 1 3 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.774 1.234 19502 904 1 3 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.753 -0.223 19502 905 1 3 . 1 1 738 738 HIS H H 738 7.300 7.300 7.635 -0.335 19502 906 1 3 . 1 1 739 739 GLY N N 739 107.604 107.604 107.425 0.179 19502 907 1 3 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.055 1.076 19502 908 1 3 . 1 1 739 739 GLY H H 739 7.638 7.638 7.933 -0.295 19502 909 1 3 . 1 1 740 740 PHE N N 740 118.114 118.114 120.358 -2.244 19502 910 1 3 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.538 0.649 19502 911 1 3 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.547 -2.144 19502 912 1 3 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.330 2.652 19502 913 1 3 . 1 1 740 740 PHE H H 740 8.138 8.138 7.821 0.317 19502 914 1 3 . 1 1 741 741 ALA N N 741 122.577 122.577 123.135 -0.558 19502 915 1 3 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.487 0.168 19502 916 1 3 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.807 0.464 19502 917 1 3 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.724 0.252 19502 918 1 3 . 1 1 741 741 ALA H H 741 8.550 8.550 8.561 -0.011 19502 919 1 3 . 1 1 742 742 ALA N N 742 124.016 124.016 129.133 -5.117 19502 920 1 3 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.193 -0.287 19502 921 1 3 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.782 0.247 19502 922 1 3 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.051 0.309 19502 923 1 3 . 1 1 742 742 ALA H H 742 8.511 8.511 8.631 -0.120 19502 924 1 3 . 1 1 743 743 GLU N N 743 120.968 120.968 123.145 -2.177 19502 925 1 3 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.747 -0.197 19502 926 1 3 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.862 -0.097 19502 927 1 3 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.800 1.189 19502 928 1 3 . 1 1 743 743 GLU H H 743 8.628 8.628 8.637 -0.009 19502 929 1 3 . 1 1 744 744 PHE N N 744 120.078 120.078 122.334 -2.256 19502 930 1 3 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.282 -0.467 19502 931 1 3 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.117 0.054 19502 932 1 3 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.210 0.165 19502 933 1 3 . 1 1 744 744 PHE H H 744 8.792 8.792 8.861 -0.069 19502 934 1 3 . 1 1 745 745 LYS N N 745 124.937 124.937 124.493 0.444 19502 935 1 3 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.809 -0.216 19502 936 1 3 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.529 0.541 19502 937 1 3 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.809 -2.264 19502 938 1 3 . 1 1 745 745 LYS H H 745 9.180 9.180 8.498 0.682 19502 939 1 3 . 1 1 746 746 LEU N N 746 129.002 129.002 124.522 4.480 19502 940 1 3 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.946 -0.022 19502 941 1 3 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.521 0.177 19502 942 1 3 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.724 -1.145 19502 943 1 3 . 1 1 746 746 LEU H H 746 8.687 8.687 8.400 0.287 19502 944 1 3 . 1 1 747 747 VAL N N 747 131.114 131.114 128.225 2.889 19502 945 1 3 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.932 -0.187 19502 946 1 3 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.353 -0.219 19502 947 1 3 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.492 0.479 19502 948 1 3 . 1 1 747 747 VAL H H 747 9.033 9.033 9.084 -0.051 19502 949 1 3 . 1 1 748 748 ASP N N 748 113.346 113.346 115.307 -1.961 19502 950 1 3 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.874 -0.090 19502 951 1 3 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.830 0.504 19502 952 1 3 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.220 2.971 19502 953 1 3 . 1 1 748 748 ASP H H 748 7.426 7.426 7.629 -0.203 19502 954 1 3 . 1 1 749 749 GLN N N 749 120.867 120.867 121.871 -1.004 19502 955 1 3 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.092 -0.022 19502 956 1 3 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.326 0.277 19502 957 1 3 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.927 0.996 19502 958 1 3 . 1 1 749 749 GLN H H 749 7.647 7.647 8.475 -0.828 19502 959 1 3 . 1 1 750 750 SER N N 750 119.661 119.661 119.717 -0.056 19502 960 1 3 . 1 1 750 750 SER HA H 750 4.791 4.791 4.799 -0.008 19502 961 1 3 . 1 1 750 750 SER CA C 750 57.575 57.575 57.716 -0.141 19502 962 1 3 . 1 1 750 750 SER CB C 750 65.910 65.910 64.414 1.496 19502 963 1 3 . 1 1 750 750 SER H H 750 8.891 8.891 8.724 0.167 19502 964 1 3 . 1 1 751 751 GLY N N 751 106.531 106.531 108.647 -2.116 19502 965 1 3 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.500 -0.286 19502 966 1 3 . 1 1 751 751 GLY H H 751 8.183 8.183 8.107 0.076 19502 967 1 3 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.701 0.147 19502 968 1 3 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.298 0.240 19502 969 1 3 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.532 0.366 19502 970 1 3 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.216 0.010 19502 971 1 3 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.915 0.430 19502 972 1 3 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.467 0.440 19502 973 1 3 . 1 1 754 754 HIS N N 754 109.780 109.780 112.065 -2.285 19502 974 1 3 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.716 0.042 19502 975 1 3 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.243 -0.014 19502 976 1 3 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.961 0.533 19502 977 1 3 . 1 1 754 754 HIS H H 754 7.707 7.707 7.901 -0.194 19502 978 1 3 . 1 1 755 755 GLU N N 755 122.843 122.843 120.420 2.423 19502 979 1 3 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.916 -0.304 19502 980 1 3 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.419 1.230 19502 981 1 3 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.060 -0.247 19502 982 1 3 . 1 1 755 755 GLU H H 755 7.404 7.404 7.456 -0.052 19502 983 1 3 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.330 0.287 19502 984 1 3 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.672 0.444 19502 985 1 3 . 1 1 756 756 PRO CB C 756 33.251 33.251 30.440 2.811 19502 986 1 3 . 1 1 757 757 LYS N N 757 119.032 119.032 125.639 -6.607 19502 987 1 3 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.678 -0.074 19502 988 1 3 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.582 0.062 19502 989 1 3 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.511 1.685 19502 990 1 3 . 1 1 757 757 LYS H H 757 8.195 8.195 7.983 0.212 19502 991 1 3 . 1 1 758 758 PHE N N 758 120.288 120.288 126.510 -6.222 19502 992 1 3 . 1 1 758 758 PHE HA H 758 5.040 5.040 5.000 0.040 19502 993 1 3 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.973 -0.157 19502 994 1 3 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.457 2.843 19502 995 1 3 . 1 1 758 758 PHE H H 758 8.844 8.844 9.521 -0.677 19502 996 1 3 . 1 1 759 759 VAL N N 759 121.385 121.385 125.222 -3.837 19502 997 1 3 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.584 0.808 19502 998 1 3 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.126 -1.476 19502 999 1 3 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.026 2.212 19502 1000 1 3 . 1 1 759 759 VAL H H 759 8.609 8.609 9.345 -0.736 19502 1001 1 3 . 1 1 760 760 TYR N N 760 126.374 126.374 128.891 -2.517 19502 1002 1 3 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.222 0.575 19502 1003 1 3 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.373 -0.453 19502 1004 1 3 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.375 4.478 19502 1005 1 3 . 1 1 760 760 TYR H H 760 8.903 8.903 8.863 0.040 19502 1006 1 3 . 1 1 761 761 GLN N N 761 115.228 115.228 122.761 -7.533 19502 1007 1 3 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.709 -0.885 19502 1008 1 3 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.593 1.933 19502 1009 1 3 . 1 1 761 761 GLN CB C 761 33.318 33.318 34.008 -0.690 19502 1010 1 3 . 1 1 761 761 GLN H H 761 9.016 9.016 8.682 0.334 19502 1011 1 3 . 1 1 762 762 ALA N N 762 128.023 128.023 128.908 -0.885 19502 1012 1 3 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.574 0.607 19502 1013 1 3 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.513 0.362 19502 1014 1 3 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.996 0.155 19502 1015 1 3 . 1 1 762 762 ALA H H 762 9.500 9.500 8.824 0.676 19502 1016 1 3 . 1 1 763 763 LYS N N 763 122.022 122.022 126.789 -4.767 19502 1017 1 3 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.789 0.075 19502 1018 1 3 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.544 0.601 19502 1019 1 3 . 1 1 763 763 LYS CB C 763 36.456 36.456 34.057 2.399 19502 1020 1 3 . 1 1 763 763 LYS H H 763 8.347 8.347 8.729 -0.382 19502 1021 1 3 . 1 1 764 764 VAL N N 764 123.980 123.980 127.897 -3.917 19502 1022 1 3 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.519 0.108 19502 1023 1 3 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.493 0.473 19502 1024 1 3 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.034 3.786 19502 1025 1 3 . 1 1 764 764 VAL H H 764 8.703 8.703 7.890 0.813 19502 1026 1 3 . 1 1 765 765 GLY N N 765 119.292 119.292 118.083 1.209 19502 1027 1 3 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.396 0.227 19502 1028 1 3 . 1 1 765 765 GLY H H 765 9.151 9.151 8.994 0.157 19502 1029 1 3 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.340 0.849 19502 1030 1 3 . 1 1 767 767 ARG N N 767 119.571 119.571 120.281 -0.710 19502 1031 1 3 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.665 -0.272 19502 1032 1 3 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.760 0.589 19502 1033 1 3 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.694 -0.375 19502 1034 1 3 . 1 1 767 767 ARG H H 767 7.595 7.595 7.439 0.156 19502 1035 1 3 . 1 1 768 768 TRP N N 768 122.976 122.976 121.850 1.126 19502 1036 1 3 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.058 -0.488 19502 1037 1 3 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.081 0.385 19502 1038 1 3 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.286 -0.068 19502 1039 1 3 . 1 1 768 768 TRP H H 768 8.056 8.056 8.683 -0.627 19502 1040 1 3 . 1 1 769 769 PHE N N 769 116.997 116.997 122.779 -5.782 19502 1041 1 3 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.785 -0.035 19502 1042 1 3 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.825 1.904 19502 1043 1 3 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.129 -0.832 19502 1044 1 3 . 1 1 769 769 PHE H H 769 7.532 7.532 8.832 -1.300 19502 1045 1 3 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.728 -0.004 19502 1046 1 3 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.822 2.477 19502 1047 1 3 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.768 0.007 19502 1048 1 3 . 1 1 771 771 ALA N N 771 125.979 125.979 122.679 3.300 19502 1049 1 3 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.323 -0.089 19502 1050 1 3 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.381 0.261 19502 1051 1 3 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.752 -0.097 19502 1052 1 3 . 1 1 771 771 ALA H H 771 9.069 9.069 8.210 0.859 19502 1053 1 3 . 1 1 772 772 VAL N N 772 113.901 113.901 118.329 -4.428 19502 1054 1 3 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.682 0.129 19502 1055 1 3 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.353 -0.204 19502 1056 1 3 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.075 0.171 19502 1057 1 3 . 1 1 772 772 VAL H H 772 9.024 9.024 9.349 -0.325 19502 1058 1 3 . 1 1 773 773 CYS N N 773 119.222 119.222 117.695 1.527 19502 1059 1 3 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.734 -0.127 19502 1060 1 3 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.823 0.935 19502 1061 1 3 . 1 1 773 773 CYS CB C 773 29.841 29.841 30.094 -0.253 19502 1062 1 3 . 1 1 773 773 CYS H H 773 8.597 8.597 8.171 0.426 19502 1063 1 3 . 1 1 774 774 ALA N N 774 124.328 124.328 127.801 -3.473 19502 1064 1 3 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.692 0.111 19502 1065 1 3 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.445 0.786 19502 1066 1 3 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.987 2.138 19502 1067 1 3 . 1 1 774 774 ALA H H 774 9.238 9.238 8.515 0.723 19502 1068 1 3 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.968 0.288 19502 1069 1 3 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.474 1.055 19502 1070 1 3 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.620 0.512 19502 1071 1 3 . 1 1 776 776 SER N N 776 110.366 110.366 113.738 -3.372 19502 1072 1 3 . 1 1 776 776 SER HA H 776 4.766 4.766 4.748 0.018 19502 1073 1 3 . 1 1 776 776 SER CA C 776 57.029 57.029 56.260 0.769 19502 1074 1 3 . 1 1 776 776 SER H H 776 7.550 7.550 7.522 0.028 19502 1075 1 3 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.699 -0.112 19502 1076 1 3 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.229 1.207 19502 1077 1 3 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.957 0.247 19502 1078 1 3 . 1 1 778 778 LYS N N 778 118.469 118.469 118.420 0.049 19502 1079 1 3 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.844 -0.080 19502 1080 1 3 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.170 0.741 19502 1081 1 3 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.182 1.503 19502 1082 1 3 . 1 1 778 778 LYS H H 778 8.151 8.151 7.709 0.442 19502 1083 1 3 . 1 1 779 779 GLN N N 779 117.975 117.975 118.838 -0.863 19502 1084 1 3 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.959 0.054 19502 1085 1 3 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.627 -0.718 19502 1086 1 3 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.601 -0.041 19502 1087 1 3 . 1 1 779 779 GLN H H 779 7.773 7.773 7.491 0.282 19502 1088 1 3 . 1 1 780 780 GLY N N 780 108.214 108.214 107.647 0.567 19502 1089 1 3 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.085 0.926 19502 1090 1 3 . 1 1 780 780 GLY H H 780 8.273 8.273 8.288 -0.015 19502 1091 1 3 . 1 1 781 781 LYS N N 781 120.027 120.027 121.627 -1.600 19502 1092 1 3 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.603 -0.514 19502 1093 1 3 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.575 0.783 19502 1094 1 3 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.755 -0.069 19502 1095 1 3 . 1 1 781 781 LYS H H 781 7.307 7.307 7.099 0.208 19502 1096 1 3 . 1 1 782 782 GLN N N 782 117.131 117.131 118.453 -1.322 19502 1097 1 3 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.874 -0.106 19502 1098 1 3 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.290 0.505 19502 1099 1 3 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.569 -0.016 19502 1100 1 3 . 1 1 782 782 GLN H H 782 7.227 7.227 7.439 -0.212 19502 1101 1 3 . 1 1 783 783 GLU N N 783 117.958 117.958 119.635 -1.677 19502 1102 1 3 . 1 1 783 783 GLU HA H 783 4.203 4.203 3.974 0.229 19502 1103 1 3 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.352 -0.388 19502 1104 1 3 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.120 -0.161 19502 1105 1 3 . 1 1 783 783 GLU H H 783 8.896 8.896 8.796 0.100 19502 1106 1 3 . 1 1 784 784 ALA N N 784 124.176 124.176 122.305 1.871 19502 1107 1 3 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.037 0.097 19502 1108 1 3 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.339 -0.124 19502 1109 1 3 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.449 -0.852 19502 1110 1 3 . 1 1 784 784 ALA H H 784 8.532 8.532 7.932 0.600 19502 1111 1 3 . 1 1 785 785 ALA N N 785 121.847 121.847 120.931 0.916 19502 1112 1 3 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.030 0.012 19502 1113 1 3 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.264 -0.095 19502 1114 1 3 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.403 -0.010 19502 1115 1 3 . 1 1 785 785 ALA H H 785 8.402 8.402 8.388 0.014 19502 1116 1 3 . 1 1 786 786 ASP N N 786 120.625 120.625 120.030 0.595 19502 1117 1 3 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.211 -0.059 19502 1118 1 3 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.977 0.194 19502 1119 1 3 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.760 1.756 19502 1120 1 3 . 1 1 786 786 ASP H H 786 8.524 8.524 8.524 -0.000 19502 1121 1 3 . 1 1 787 787 ALA N N 787 118.408 118.408 121.381 -2.973 19502 1122 1 3 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.055 -0.079 19502 1123 1 3 . 1 1 787 787 ALA CA C 787 55.116 55.116 55.060 0.056 19502 1124 1 3 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.277 -0.007 19502 1125 1 3 . 1 1 787 787 ALA H H 787 8.191 8.191 7.914 0.277 19502 1126 1 3 . 1 1 788 788 ALA N N 788 118.510 118.510 121.871 -3.361 19502 1127 1 3 . 1 1 788 788 ALA HA H 788 3.704 3.704 3.938 -0.234 19502 1128 1 3 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.081 -0.188 19502 1129 1 3 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.946 0.627 19502 1130 1 3 . 1 1 788 788 ALA H H 788 7.533 7.533 8.167 -0.634 19502 1131 1 3 . 1 1 789 789 LEU N N 789 117.413 117.413 118.546 -1.133 19502 1132 1 3 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.738 -0.048 19502 1133 1 3 . 1 1 789 789 LEU CA C 789 58.180 58.180 58.138 0.042 19502 1134 1 3 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.330 0.774 19502 1135 1 3 . 1 1 789 789 LEU H H 789 8.520 8.520 8.181 0.339 19502 1136 1 3 . 1 1 790 790 ARG N N 790 116.360 116.360 119.229 -2.869 19502 1137 1 3 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.999 -0.081 19502 1138 1 3 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.501 1.302 19502 1139 1 3 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.934 -0.173 19502 1140 1 3 . 1 1 790 790 ARG H H 790 8.293 8.293 7.865 0.428 19502 1141 1 3 . 1 1 791 791 VAL N N 791 120.700 120.700 120.530 0.170 19502 1142 1 3 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.722 0.190 19502 1143 1 3 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.097 0.387 19502 1144 1 3 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.168 0.568 19502 1145 1 3 . 1 1 791 791 VAL H H 791 7.455 7.455 8.257 -0.802 19502 1146 1 3 . 1 1 792 792 LEU N N 792 120.706 120.706 120.140 0.566 19502 1147 1 3 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.806 0.226 19502 1148 1 3 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.293 -0.426 19502 1149 1 3 . 1 1 792 792 LEU CB C 792 42.247 42.247 40.944 1.303 19502 1150 1 3 . 1 1 792 792 LEU H H 792 8.007 8.007 8.205 -0.198 19502 1151 1 3 . 1 1 793 793 ILE N N 793 118.876 118.876 118.752 0.124 19502 1152 1 3 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.628 0.101 19502 1153 1 3 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.554 -0.553 19502 1154 1 3 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.488 1.467 19502 1155 1 3 . 1 1 793 793 ILE H H 793 8.778 8.778 8.778 0.000 19502 1156 1 3 . 1 1 794 794 GLY N N 794 107.008 107.008 107.244 -0.236 19502 1157 1 3 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.169 -0.535 19502 1158 1 3 . 1 1 794 794 GLY H H 794 7.810 7.810 8.075 -0.265 19502 1159 1 3 . 1 1 795 795 GLU N N 795 119.866 119.866 121.654 -1.788 19502 1160 1 3 . 1 1 795 795 GLU HA H 795 4.356 4.356 3.994 0.362 19502 1161 1 3 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.677 -1.973 19502 1162 1 3 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.316 0.764 19502 1163 1 3 . 1 1 795 795 GLU H H 795 7.978 7.978 8.570 -0.592 19502 1164 1 3 . 1 1 796 796 ASN N N 796 118.365 118.365 117.884 0.481 19502 1165 1 3 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.530 0.252 19502 1166 1 3 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.775 -1.193 19502 1167 1 3 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.950 1.095 19502 1168 1 3 . 1 1 796 796 ASN H H 796 8.053 8.053 8.406 -0.353 19502 1169 1 3 . 1 1 797 797 GLU N N 797 120.368 120.368 121.316 -0.948 19502 1170 1 3 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.209 0.127 19502 1171 1 3 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.691 -1.067 19502 1172 1 3 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.645 0.697 19502 1173 1 3 . 1 1 797 797 GLU H H 797 8.225 8.225 8.050 0.175 19502 1174 1 3 . 1 1 798 798 LYS N N 798 120.614 120.614 118.831 1.783 19502 1175 1 3 . 1 1 798 798 LYS H H 798 8.088 8.088 7.998 0.090 19502 1176 1 3 . 1 1 799 799 ALA N N 799 124.642 124.642 120.913 3.729 19502 1177 1 3 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.199 0.242 19502 1178 1 3 . 1 1 799 799 ALA CA C 799 52.692 52.692 53.115 -0.423 19502 1179 1 3 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.308 0.309 19502 1180 1 3 . 1 1 799 799 ALA H H 799 8.138 8.138 7.932 0.206 19502 1181 1 3 . 1 1 800 800 GLU N N 800 120.408 120.408 116.881 3.527 19502 1182 1 3 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.050 0.345 19502 1183 1 3 . 1 1 800 800 GLU CA C 800 56.810 56.810 57.441 -0.631 19502 1184 1 3 . 1 1 800 800 GLU CB C 800 30.604 30.604 28.184 2.420 19502 1185 1 3 . 1 1 800 800 GLU H H 800 8.337 8.337 8.314 0.023 19502 1186 1 4 . 1 1 713 713 VAL N N 713 120.649 120.649 119.956 0.693 19502 1187 1 4 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.278 -0.158 19502 1188 1 4 . 1 1 713 713 VAL CA C 713 63.009 63.009 60.894 2.115 19502 1189 1 4 . 1 1 713 713 VAL CB C 713 32.747 32.747 34.015 -1.268 19502 1190 1 4 . 1 1 713 713 VAL H H 713 8.051 8.051 7.247 0.804 19502 1191 1 4 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.701 -0.220 19502 1192 1 4 . 1 1 715 715 LYS CA C 715 56.754 56.754 53.684 3.070 19502 1193 1 4 . 1 1 715 715 LYS CB C 715 33.015 33.015 34.587 -1.572 19502 1194 1 4 . 1 1 716 716 ILE N N 716 121.593 121.593 122.638 -1.045 19502 1195 1 4 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.085 0.014 19502 1196 1 4 . 1 1 716 716 ILE CA C 716 62.829 62.829 63.178 -0.350 19502 1197 1 4 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.218 0.948 19502 1198 1 4 . 1 1 716 716 ILE H H 716 8.406 8.406 8.884 -0.478 19502 1199 1 4 . 1 1 717 717 GLY N N 717 108.628 108.628 107.113 1.515 19502 1200 1 4 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.898 -0.224 19502 1201 1 4 . 1 1 717 717 GLY H H 717 8.476 8.476 8.757 -0.281 19502 1202 1 4 . 1 1 718 718 GLU N N 718 119.944 119.944 121.304 -1.360 19502 1203 1 4 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.132 0.145 19502 1204 1 4 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.663 -0.476 19502 1205 1 4 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.512 0.525 19502 1206 1 4 . 1 1 718 718 GLU H H 718 8.055 8.055 7.589 0.466 19502 1207 1 4 . 1 1 719 719 LEU N N 719 118.538 118.538 119.603 -1.065 19502 1208 1 4 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.395 -0.017 19502 1209 1 4 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.209 0.133 19502 1210 1 4 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.699 1.341 19502 1211 1 4 . 1 1 719 719 LEU H H 719 8.098 8.098 7.801 0.297 19502 1212 1 4 . 1 1 720 720 VAL N N 720 117.613 117.613 119.049 -1.436 19502 1213 1 4 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.638 0.066 19502 1214 1 4 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.894 -1.275 19502 1215 1 4 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.224 0.700 19502 1216 1 4 . 1 1 720 720 VAL H H 720 7.838 7.838 7.597 0.241 19502 1217 1 4 . 1 1 721 721 ARG N N 721 118.905 118.905 119.912 -1.007 19502 1218 1 4 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.952 0.227 19502 1219 1 4 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.325 -0.905 19502 1220 1 4 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.669 -0.082 19502 1221 1 4 . 1 1 721 721 ARG H H 721 7.614 7.614 7.417 0.197 19502 1222 1 4 . 1 1 722 722 TYR N N 722 117.574 117.574 119.414 -1.840 19502 1223 1 4 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.289 0.060 19502 1224 1 4 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.323 -1.258 19502 1225 1 4 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.266 0.565 19502 1226 1 4 . 1 1 722 722 TYR H H 722 7.885 7.885 7.813 0.072 19502 1227 1 4 . 1 1 723 723 LEU N N 723 120.520 120.520 117.181 3.339 19502 1228 1 4 . 1 1 723 723 LEU HA H 723 3.995 3.995 3.999 -0.004 19502 1229 1 4 . 1 1 723 723 LEU CA C 723 57.555 57.555 57.176 0.379 19502 1230 1 4 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.794 0.244 19502 1231 1 4 . 1 1 723 723 LEU H H 723 7.794 7.794 7.947 -0.153 19502 1232 1 4 . 1 1 724 724 ASN N N 724 115.161 115.161 115.310 -0.149 19502 1233 1 4 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.642 -0.030 19502 1234 1 4 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.484 -0.247 19502 1235 1 4 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.247 0.030 19502 1236 1 4 . 1 1 724 724 ASN H H 724 8.892 8.892 7.674 1.218 19502 1237 1 4 . 1 1 725 725 THR N N 725 110.273 110.273 115.022 -4.749 19502 1238 1 4 . 1 1 725 725 THR HA H 725 4.527 4.527 4.313 0.214 19502 1239 1 4 . 1 1 725 725 THR CA C 725 62.903 62.903 64.700 -1.797 19502 1240 1 4 . 1 1 725 725 THR CB C 725 70.619 70.619 69.630 0.989 19502 1241 1 4 . 1 1 725 725 THR H H 725 7.874 7.874 7.990 -0.116 19502 1242 1 4 . 1 1 726 726 ASN N N 726 117.048 117.048 118.127 -1.079 19502 1243 1 4 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.155 -0.016 19502 1244 1 4 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.351 1.487 19502 1245 1 4 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.554 -1.647 19502 1246 1 4 . 1 1 726 726 ASN H H 726 8.613 8.613 7.671 0.942 19502 1247 1 4 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.398 -0.334 19502 1248 1 4 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.295 0.214 19502 1249 1 4 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.586 -1.141 19502 1250 1 4 . 1 1 728 728 VAL N N 728 118.643 118.643 118.424 0.219 19502 1251 1 4 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.699 -0.299 19502 1252 1 4 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.303 1.263 19502 1253 1 4 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.571 0.855 19502 1254 1 4 . 1 1 728 728 VAL H H 728 8.182 8.182 8.014 0.168 19502 1255 1 4 . 1 1 729 729 GLY N N 729 105.307 105.307 107.088 -1.781 19502 1256 1 4 . 1 1 729 729 GLY CA C 729 47.650 47.650 47.322 0.328 19502 1257 1 4 . 1 1 729 729 GLY H H 729 7.297 7.297 8.822 -1.525 19502 1258 1 4 . 1 1 730 730 GLY N N 730 109.038 109.038 109.702 -0.664 19502 1259 1 4 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.018 0.674 19502 1260 1 4 . 1 1 730 730 GLY H H 730 8.080 8.080 7.556 0.524 19502 1261 1 4 . 1 1 731 731 LEU N N 731 123.822 123.822 123.613 0.209 19502 1262 1 4 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.010 0.026 19502 1263 1 4 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.642 -0.046 19502 1264 1 4 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.595 0.620 19502 1265 1 4 . 1 1 731 731 LEU H H 731 8.287 8.287 8.231 0.056 19502 1266 1 4 . 1 1 732 732 LEU N N 732 118.759 118.759 118.149 0.610 19502 1267 1 4 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.928 0.158 19502 1268 1 4 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.044 0.465 19502 1269 1 4 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.409 -0.426 19502 1270 1 4 . 1 1 732 732 LEU H H 732 8.412 8.412 8.054 0.358 19502 1271 1 4 . 1 1 733 733 GLU N N 733 121.155 121.155 120.237 0.918 19502 1272 1 4 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.994 0.279 19502 1273 1 4 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.015 0.058 19502 1274 1 4 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.087 -0.107 19502 1275 1 4 . 1 1 733 733 GLU H H 733 8.003 8.003 8.118 -0.115 19502 1276 1 4 . 1 1 734 734 TYR N N 734 122.518 122.518 121.237 1.281 19502 1277 1 4 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.937 0.244 19502 1278 1 4 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.503 0.456 19502 1279 1 4 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.194 -0.350 19502 1280 1 4 . 1 1 734 734 TYR H H 734 8.419 8.419 8.429 -0.010 19502 1281 1 4 . 1 1 735 735 ALA N N 735 122.353 122.353 121.186 1.167 19502 1282 1 4 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.765 0.047 19502 1283 1 4 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.971 1.200 19502 1284 1 4 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.644 0.189 19502 1285 1 4 . 1 1 735 735 ALA H H 735 8.777 8.777 7.835 0.942 19502 1286 1 4 . 1 1 736 736 ARG N N 736 118.852 118.852 117.763 1.089 19502 1287 1 4 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.061 0.112 19502 1288 1 4 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.628 0.895 19502 1289 1 4 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.788 0.368 19502 1290 1 4 . 1 1 736 736 ARG H H 736 8.570 8.570 8.327 0.243 19502 1291 1 4 . 1 1 737 737 SER N N 737 115.125 115.125 113.587 1.538 19502 1292 1 4 . 1 1 737 737 SER HA H 737 4.149 4.149 4.388 -0.239 19502 1293 1 4 . 1 1 737 737 SER CA C 737 61.300 61.300 60.104 1.196 19502 1294 1 4 . 1 1 737 737 SER CB C 737 63.166 63.166 63.382 -0.216 19502 1295 1 4 . 1 1 737 737 SER H H 737 8.257 8.257 8.226 0.031 19502 1296 1 4 . 1 1 738 738 HIS N N 738 117.591 117.591 116.685 0.906 19502 1297 1 4 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.549 -0.209 19502 1298 1 4 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.631 1.377 19502 1299 1 4 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.160 -0.630 19502 1300 1 4 . 1 1 738 738 HIS H H 738 7.300 7.300 7.533 -0.233 19502 1301 1 4 . 1 1 739 739 GLY N N 739 107.604 107.604 107.976 -0.372 19502 1302 1 4 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.843 1.288 19502 1303 1 4 . 1 1 739 739 GLY H H 739 7.638 7.638 8.230 -0.592 19502 1304 1 4 . 1 1 740 740 PHE N N 740 118.114 118.114 120.757 -2.643 19502 1305 1 4 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.445 0.742 19502 1306 1 4 . 1 1 740 740 PHE CA C 740 54.403 54.403 57.072 -2.670 19502 1307 1 4 . 1 1 740 740 PHE CB C 740 42.982 42.982 39.923 3.059 19502 1308 1 4 . 1 1 740 740 PHE H H 740 8.138 8.138 7.706 0.432 19502 1309 1 4 . 1 1 741 741 ALA N N 741 122.577 122.577 122.256 0.321 19502 1310 1 4 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.468 0.187 19502 1311 1 4 . 1 1 741 741 ALA CA C 741 51.271 51.271 51.017 0.254 19502 1312 1 4 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.042 -0.066 19502 1313 1 4 . 1 1 741 741 ALA H H 741 8.550 8.550 8.528 0.022 19502 1314 1 4 . 1 1 742 742 ALA N N 742 124.016 124.016 128.486 -4.470 19502 1315 1 4 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.532 -0.626 19502 1316 1 4 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.492 0.537 19502 1317 1 4 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.691 -0.331 19502 1318 1 4 . 1 1 742 742 ALA H H 742 8.511 8.511 8.561 -0.050 19502 1319 1 4 . 1 1 743 743 GLU N N 743 120.968 120.968 122.949 -1.981 19502 1320 1 4 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.759 -0.209 19502 1321 1 4 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.998 -0.232 19502 1322 1 4 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.880 1.109 19502 1323 1 4 . 1 1 743 743 GLU H H 743 8.628 8.628 8.546 0.082 19502 1324 1 4 . 1 1 744 744 PHE N N 744 120.078 120.078 122.723 -2.645 19502 1325 1 4 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.182 -0.367 19502 1326 1 4 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.024 0.147 19502 1327 1 4 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.645 0.730 19502 1328 1 4 . 1 1 744 744 PHE H H 744 8.792 8.792 9.047 -0.255 19502 1329 1 4 . 1 1 745 745 LYS N N 745 124.937 124.937 123.276 1.661 19502 1330 1 4 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.756 -0.163 19502 1331 1 4 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.222 0.848 19502 1332 1 4 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.669 -2.124 19502 1333 1 4 . 1 1 745 745 LYS H H 745 9.180 9.180 8.385 0.795 19502 1334 1 4 . 1 1 746 746 LEU N N 746 129.002 129.002 124.804 4.198 19502 1335 1 4 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.698 0.226 19502 1336 1 4 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.860 -0.162 19502 1337 1 4 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.527 -0.948 19502 1338 1 4 . 1 1 746 746 LEU H H 746 8.687 8.687 8.422 0.265 19502 1339 1 4 . 1 1 747 747 VAL N N 747 131.114 131.114 127.958 3.156 19502 1340 1 4 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.828 -0.083 19502 1341 1 4 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.547 -0.413 19502 1342 1 4 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.394 0.577 19502 1343 1 4 . 1 1 747 747 VAL H H 747 9.033 9.033 8.935 0.098 19502 1344 1 4 . 1 1 748 748 ASP N N 748 113.346 113.346 114.262 -0.916 19502 1345 1 4 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.827 -0.043 19502 1346 1 4 . 1 1 748 748 ASP CA C 748 54.334 54.334 54.041 0.292 19502 1347 1 4 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.133 3.058 19502 1348 1 4 . 1 1 748 748 ASP H H 748 7.426 7.426 7.612 -0.186 19502 1349 1 4 . 1 1 749 749 GLN N N 749 120.867 120.867 120.605 0.262 19502 1350 1 4 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.370 -0.300 19502 1351 1 4 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.274 0.329 19502 1352 1 4 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.621 1.302 19502 1353 1 4 . 1 1 749 749 GLN H H 749 7.647 7.647 8.385 -0.738 19502 1354 1 4 . 1 1 750 750 SER N N 750 119.661 119.661 120.732 -1.071 19502 1355 1 4 . 1 1 750 750 SER HA H 750 4.791 4.791 4.718 0.073 19502 1356 1 4 . 1 1 750 750 SER CA C 750 57.575 57.575 58.309 -0.734 19502 1357 1 4 . 1 1 750 750 SER CB C 750 65.910 65.910 65.319 0.591 19502 1358 1 4 . 1 1 750 750 SER H H 750 8.891 8.891 8.307 0.584 19502 1359 1 4 . 1 1 751 751 GLY N N 751 106.531 106.531 110.272 -3.741 19502 1360 1 4 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.633 -0.419 19502 1361 1 4 . 1 1 751 751 GLY H H 751 8.183 8.183 8.011 0.172 19502 1362 1 4 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.736 0.112 19502 1363 1 4 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.229 0.309 19502 1364 1 4 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.707 0.191 19502 1365 1 4 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.208 0.018 19502 1366 1 4 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.847 0.498 19502 1367 1 4 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.509 0.398 19502 1368 1 4 . 1 1 754 754 HIS N N 754 109.780 109.780 112.666 -2.886 19502 1369 1 4 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.626 0.132 19502 1370 1 4 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.508 -0.279 19502 1371 1 4 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.236 0.258 19502 1372 1 4 . 1 1 754 754 HIS H H 754 7.707 7.707 7.986 -0.279 19502 1373 1 4 . 1 1 755 755 GLU N N 755 122.843 122.843 121.104 1.739 19502 1374 1 4 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.746 -0.134 19502 1375 1 4 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.126 1.523 19502 1376 1 4 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.143 0.669 19502 1377 1 4 . 1 1 755 755 GLU H H 755 7.404 7.404 7.219 0.185 19502 1378 1 4 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.203 0.414 19502 1379 1 4 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.822 0.294 19502 1380 1 4 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.426 1.825 19502 1381 1 4 . 1 1 757 757 LYS N N 757 119.032 119.032 125.614 -6.582 19502 1382 1 4 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.503 0.101 19502 1383 1 4 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.390 0.254 19502 1384 1 4 . 1 1 757 757 LYS CB C 757 35.196 35.196 32.806 2.390 19502 1385 1 4 . 1 1 757 757 LYS H H 757 8.195 8.195 8.028 0.167 19502 1386 1 4 . 1 1 758 758 PHE N N 758 120.288 120.288 127.077 -6.789 19502 1387 1 4 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.846 0.194 19502 1388 1 4 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.063 -0.247 19502 1389 1 4 . 1 1 758 758 PHE CB C 758 43.300 43.300 39.505 3.795 19502 1390 1 4 . 1 1 758 758 PHE H H 758 8.844 8.844 9.345 -0.501 19502 1391 1 4 . 1 1 759 759 VAL N N 759 121.385 121.385 124.693 -3.308 19502 1392 1 4 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.606 0.786 19502 1393 1 4 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.884 -1.234 19502 1394 1 4 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.937 2.301 19502 1395 1 4 . 1 1 759 759 VAL H H 759 8.609 8.609 9.284 -0.675 19502 1396 1 4 . 1 1 760 760 TYR N N 760 126.374 126.374 129.044 -2.670 19502 1397 1 4 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.111 0.686 19502 1398 1 4 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.198 -0.278 19502 1399 1 4 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.319 4.534 19502 1400 1 4 . 1 1 760 760 TYR H H 760 8.903 8.903 9.485 -0.582 19502 1401 1 4 . 1 1 761 761 GLN N N 761 115.228 115.228 123.651 -8.423 19502 1402 1 4 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.816 -0.992 19502 1403 1 4 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.355 2.171 19502 1404 1 4 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.785 -0.467 19502 1405 1 4 . 1 1 761 761 GLN H H 761 9.016 9.016 8.622 0.394 19502 1406 1 4 . 1 1 762 762 ALA N N 762 128.023 128.023 129.720 -1.697 19502 1407 1 4 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.491 0.690 19502 1408 1 4 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.544 0.331 19502 1409 1 4 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.622 0.529 19502 1410 1 4 . 1 1 762 762 ALA H H 762 9.500 9.500 8.643 0.857 19502 1411 1 4 . 1 1 763 763 LYS N N 763 122.022 122.022 126.808 -4.786 19502 1412 1 4 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.277 0.587 19502 1413 1 4 . 1 1 763 763 LYS CA C 763 55.145 55.145 55.297 -0.152 19502 1414 1 4 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.331 3.125 19502 1415 1 4 . 1 1 763 763 LYS H H 763 8.347 8.347 8.839 -0.492 19502 1416 1 4 . 1 1 764 764 VAL N N 764 123.980 123.980 127.943 -3.963 19502 1417 1 4 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.712 -0.085 19502 1418 1 4 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.298 0.668 19502 1419 1 4 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.993 3.827 19502 1420 1 4 . 1 1 764 764 VAL H H 764 8.703 8.703 8.155 0.548 19502 1421 1 4 . 1 1 765 765 GLY N N 765 119.292 119.292 117.784 1.508 19502 1422 1 4 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.462 0.161 19502 1423 1 4 . 1 1 765 765 GLY H H 765 9.151 9.151 8.938 0.213 19502 1424 1 4 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.544 0.646 19502 1425 1 4 . 1 1 767 767 ARG N N 767 119.571 119.571 120.323 -0.752 19502 1426 1 4 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.713 -0.320 19502 1427 1 4 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.916 0.433 19502 1428 1 4 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.560 -0.241 19502 1429 1 4 . 1 1 767 767 ARG H H 767 7.595 7.595 7.502 0.093 19502 1430 1 4 . 1 1 768 768 TRP N N 768 122.976 122.976 122.420 0.556 19502 1431 1 4 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.050 -0.480 19502 1432 1 4 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.101 0.365 19502 1433 1 4 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.114 0.104 19502 1434 1 4 . 1 1 768 768 TRP H H 768 8.056 8.056 8.787 -0.731 19502 1435 1 4 . 1 1 769 769 PHE N N 769 116.997 116.997 122.634 -5.637 19502 1436 1 4 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.819 -0.069 19502 1437 1 4 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.673 2.056 19502 1438 1 4 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.301 -1.004 19502 1439 1 4 . 1 1 769 769 PHE H H 769 7.532 7.532 8.681 -1.149 19502 1440 1 4 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.741 -0.017 19502 1441 1 4 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.780 2.519 19502 1442 1 4 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.813 -0.038 19502 1443 1 4 . 1 1 771 771 ALA N N 771 125.979 125.979 122.677 3.302 19502 1444 1 4 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.358 -0.124 19502 1445 1 4 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.569 0.073 19502 1446 1 4 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.373 0.282 19502 1447 1 4 . 1 1 771 771 ALA H H 771 9.069 9.069 8.246 0.823 19502 1448 1 4 . 1 1 772 772 VAL N N 772 113.901 113.901 120.224 -6.323 19502 1449 1 4 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.674 0.137 19502 1450 1 4 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.723 -0.574 19502 1451 1 4 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.132 1.114 19502 1452 1 4 . 1 1 772 772 VAL H H 772 9.024 9.024 8.951 0.073 19502 1453 1 4 . 1 1 773 773 CYS N N 773 119.222 119.222 121.083 -1.861 19502 1454 1 4 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.384 0.223 19502 1455 1 4 . 1 1 773 773 CYS CA C 773 56.758 56.758 57.721 -0.963 19502 1456 1 4 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.901 0.940 19502 1457 1 4 . 1 1 773 773 CYS H H 773 8.597 8.597 8.482 0.115 19502 1458 1 4 . 1 1 774 774 ALA N N 774 124.328 124.328 126.910 -2.582 19502 1459 1 4 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.644 0.159 19502 1460 1 4 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.203 1.028 19502 1461 1 4 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.251 1.874 19502 1462 1 4 . 1 1 774 774 ALA H H 774 9.238 9.238 8.627 0.611 19502 1463 1 4 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.352 -0.096 19502 1464 1 4 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.051 1.478 19502 1465 1 4 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.785 0.347 19502 1466 1 4 . 1 1 776 776 SER N N 776 110.366 110.366 113.766 -3.400 19502 1467 1 4 . 1 1 776 776 SER HA H 776 4.766 4.766 4.594 0.172 19502 1468 1 4 . 1 1 776 776 SER CA C 776 57.029 57.029 56.690 0.339 19502 1469 1 4 . 1 1 776 776 SER H H 776 7.550 7.550 7.708 -0.158 19502 1470 1 4 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.672 -0.085 19502 1471 1 4 . 1 1 777 777 LYS CA C 777 60.436 60.436 60.144 0.292 19502 1472 1 4 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.201 0.003 19502 1473 1 4 . 1 1 778 778 LYS N N 778 118.469 118.469 118.134 0.335 19502 1474 1 4 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.794 -0.030 19502 1475 1 4 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.313 0.598 19502 1476 1 4 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.032 1.653 19502 1477 1 4 . 1 1 778 778 LYS H H 778 8.151 8.151 8.278 -0.127 19502 1478 1 4 . 1 1 779 779 GLN N N 779 117.975 117.975 118.828 -0.853 19502 1479 1 4 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.932 0.081 19502 1480 1 4 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.828 -0.919 19502 1481 1 4 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.337 0.223 19502 1482 1 4 . 1 1 779 779 GLN H H 779 7.773 7.773 8.074 -0.301 19502 1483 1 4 . 1 1 780 780 GLY N N 780 108.214 108.214 107.984 0.230 19502 1484 1 4 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.996 1.015 19502 1485 1 4 . 1 1 780 780 GLY H H 780 8.273 8.273 8.331 -0.058 19502 1486 1 4 . 1 1 781 781 LYS N N 781 120.027 120.027 121.537 -1.510 19502 1487 1 4 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.588 -0.499 19502 1488 1 4 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.722 0.636 19502 1489 1 4 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.847 -0.161 19502 1490 1 4 . 1 1 781 781 LYS H H 781 7.307 7.307 7.936 -0.629 19502 1491 1 4 . 1 1 782 782 GLN N N 782 117.131 117.131 118.492 -1.361 19502 1492 1 4 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.863 -0.095 19502 1493 1 4 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.325 0.470 19502 1494 1 4 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.684 -0.131 19502 1495 1 4 . 1 1 782 782 GLN H H 782 7.227 7.227 8.017 -0.790 19502 1496 1 4 . 1 1 783 783 GLU N N 783 117.958 117.958 119.454 -1.496 19502 1497 1 4 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.048 0.155 19502 1498 1 4 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.928 0.036 19502 1499 1 4 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.087 -0.128 19502 1500 1 4 . 1 1 783 783 GLU H H 783 8.896 8.896 8.656 0.240 19502 1501 1 4 . 1 1 784 784 ALA N N 784 124.176 124.176 122.735 1.441 19502 1502 1 4 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.060 0.074 19502 1503 1 4 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.467 -0.252 19502 1504 1 4 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.506 -0.909 19502 1505 1 4 . 1 1 784 784 ALA H H 784 8.532 8.532 8.546 -0.014 19502 1506 1 4 . 1 1 785 785 ALA N N 785 121.847 121.847 120.824 1.023 19502 1507 1 4 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.079 -0.037 19502 1508 1 4 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.370 -0.201 19502 1509 1 4 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.173 0.220 19502 1510 1 4 . 1 1 785 785 ALA H H 785 8.402 8.402 8.238 0.164 19502 1511 1 4 . 1 1 786 786 ASP N N 786 120.625 120.625 119.920 0.705 19502 1512 1 4 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.271 -0.119 19502 1513 1 4 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.800 0.371 19502 1514 1 4 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.883 1.633 19502 1515 1 4 . 1 1 786 786 ASP H H 786 8.524 8.524 8.284 0.240 19502 1516 1 4 . 1 1 787 787 ALA N N 787 118.408 118.408 121.688 -3.280 19502 1517 1 4 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.113 -0.137 19502 1518 1 4 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.882 0.234 19502 1519 1 4 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.408 -0.138 19502 1520 1 4 . 1 1 787 787 ALA H H 787 8.191 8.191 8.089 0.102 19502 1521 1 4 . 1 1 788 788 ALA N N 788 118.510 118.510 122.036 -3.526 19502 1522 1 4 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.160 -0.456 19502 1523 1 4 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.110 -0.217 19502 1524 1 4 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.077 0.496 19502 1525 1 4 . 1 1 788 788 ALA H H 788 7.533 7.533 8.219 -0.686 19502 1526 1 4 . 1 1 789 789 LEU N N 789 117.413 117.413 118.184 -0.771 19502 1527 1 4 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.794 -0.104 19502 1528 1 4 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.628 0.552 19502 1529 1 4 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.225 0.879 19502 1530 1 4 . 1 1 789 789 LEU H H 789 8.520 8.520 8.187 0.333 19502 1531 1 4 . 1 1 790 790 ARG N N 790 116.360 116.360 119.228 -2.868 19502 1532 1 4 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.025 -0.107 19502 1533 1 4 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.602 2.201 19502 1534 1 4 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.137 0.624 19502 1535 1 4 . 1 1 790 790 ARG H H 790 8.293 8.293 7.783 0.510 19502 1536 1 4 . 1 1 791 791 VAL N N 791 120.700 120.700 119.878 0.822 19502 1537 1 4 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.687 0.225 19502 1538 1 4 . 1 1 791 791 VAL CA C 791 66.484 66.484 65.968 0.516 19502 1539 1 4 . 1 1 791 791 VAL CB C 791 31.736 31.736 30.837 0.899 19502 1540 1 4 . 1 1 791 791 VAL H H 791 7.455 7.455 7.806 -0.351 19502 1541 1 4 . 1 1 792 792 LEU N N 792 120.706 120.706 120.068 0.638 19502 1542 1 4 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.798 0.234 19502 1543 1 4 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.032 -0.165 19502 1544 1 4 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.048 1.199 19502 1545 1 4 . 1 1 792 792 LEU H H 792 8.007 8.007 7.797 0.210 19502 1546 1 4 . 1 1 793 793 ILE N N 793 118.876 118.876 119.165 -0.289 19502 1547 1 4 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.594 0.135 19502 1548 1 4 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.579 -0.578 19502 1549 1 4 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.624 1.331 19502 1550 1 4 . 1 1 793 793 ILE H H 793 8.778 8.778 8.631 0.147 19502 1551 1 4 . 1 1 794 794 GLY N N 794 107.008 107.008 106.464 0.544 19502 1552 1 4 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.975 -0.342 19502 1553 1 4 . 1 1 794 794 GLY H H 794 7.810 7.810 8.412 -0.602 19502 1554 1 4 . 1 1 795 795 GLU N N 795 119.866 119.866 121.616 -1.750 19502 1555 1 4 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.065 0.291 19502 1556 1 4 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.335 -1.631 19502 1557 1 4 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.418 0.662 19502 1558 1 4 . 1 1 795 795 GLU H H 795 7.978 7.978 7.863 0.115 19502 1559 1 4 . 1 1 796 796 ASN N N 796 118.365 118.365 117.679 0.686 19502 1560 1 4 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.631 0.151 19502 1561 1 4 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.572 -0.989 19502 1562 1 4 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.852 1.193 19502 1563 1 4 . 1 1 796 796 ASN H H 796 8.053 8.053 8.021 0.032 19502 1564 1 4 . 1 1 797 797 GLU N N 797 120.368 120.368 119.752 0.616 19502 1565 1 4 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.218 0.118 19502 1566 1 4 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.377 -0.753 19502 1567 1 4 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.347 0.995 19502 1568 1 4 . 1 1 797 797 GLU H H 797 8.225 8.225 8.439 -0.214 19502 1569 1 4 . 1 1 798 798 LYS N N 798 120.614 120.614 116.566 4.048 19502 1570 1 4 . 1 1 798 798 LYS H H 798 8.088 8.088 7.469 0.619 19502 1571 1 4 . 1 1 799 799 ALA N N 799 124.642 124.642 124.323 0.319 19502 1572 1 4 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.405 0.036 19502 1573 1 4 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.921 0.771 19502 1574 1 4 . 1 1 799 799 ALA CB C 799 19.617 19.617 17.650 1.967 19502 1575 1 4 . 1 1 799 799 ALA H H 799 8.138 8.138 7.546 0.592 19502 1576 1 4 . 1 1 800 800 GLU N N 800 120.408 120.408 120.984 -0.576 19502 1577 1 4 . 1 1 800 800 GLU HA H 800 4.395 4.395 3.969 0.426 19502 1578 1 4 . 1 1 800 800 GLU CA C 800 56.810 56.810 57.909 -1.099 19502 1579 1 4 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.376 1.228 19502 1580 1 4 . 1 1 800 800 GLU H H 800 8.337 8.337 8.534 -0.197 19502 1581 1 5 . 1 1 713 713 VAL N N 713 120.649 120.649 121.318 -0.669 19502 1582 1 5 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.247 -0.127 19502 1583 1 5 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.239 1.770 19502 1584 1 5 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.011 -0.264 19502 1585 1 5 . 1 1 713 713 VAL H H 713 8.051 8.051 8.343 -0.292 19502 1586 1 5 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.333 0.148 19502 1587 1 5 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.471 1.283 19502 1588 1 5 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.155 0.860 19502 1589 1 5 . 1 1 716 716 ILE N N 716 121.593 121.593 127.252 -5.659 19502 1590 1 5 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.000 0.099 19502 1591 1 5 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.309 0.520 19502 1592 1 5 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.478 0.688 19502 1593 1 5 . 1 1 716 716 ILE H H 716 8.406 8.406 8.152 0.254 19502 1594 1 5 . 1 1 717 717 GLY N N 717 108.628 108.628 107.768 0.860 19502 1595 1 5 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.059 -0.385 19502 1596 1 5 . 1 1 717 717 GLY H H 717 8.476 8.476 8.684 -0.208 19502 1597 1 5 . 1 1 718 718 GLU N N 718 119.944 119.944 121.528 -1.584 19502 1598 1 5 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.104 0.173 19502 1599 1 5 . 1 1 718 718 GLU CA C 718 58.187 58.187 59.002 -0.815 19502 1600 1 5 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.205 0.832 19502 1601 1 5 . 1 1 718 718 GLU H H 718 8.055 8.055 7.740 0.315 19502 1602 1 5 . 1 1 719 719 LEU N N 719 118.538 118.538 118.944 -0.406 19502 1603 1 5 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.338 0.040 19502 1604 1 5 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.865 0.477 19502 1605 1 5 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.589 1.451 19502 1606 1 5 . 1 1 719 719 LEU H H 719 8.098 8.098 7.652 0.446 19502 1607 1 5 . 1 1 720 720 VAL N N 720 117.613 117.613 119.219 -1.606 19502 1608 1 5 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.635 0.069 19502 1609 1 5 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.915 -1.296 19502 1610 1 5 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.263 0.661 19502 1611 1 5 . 1 1 720 720 VAL H H 720 7.838 7.838 8.022 -0.184 19502 1612 1 5 . 1 1 721 721 ARG N N 721 118.905 118.905 120.084 -1.179 19502 1613 1 5 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.978 0.201 19502 1614 1 5 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.263 -0.843 19502 1615 1 5 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.473 0.114 19502 1616 1 5 . 1 1 721 721 ARG H H 721 7.614 7.614 7.732 -0.118 19502 1617 1 5 . 1 1 722 722 TYR N N 722 117.574 117.574 118.374 -0.800 19502 1618 1 5 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.397 -0.048 19502 1619 1 5 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.112 -1.047 19502 1620 1 5 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.507 0.324 19502 1621 1 5 . 1 1 722 722 TYR H H 722 7.885 7.885 7.505 0.380 19502 1622 1 5 . 1 1 723 723 LEU N N 723 120.520 120.520 117.103 3.417 19502 1623 1 5 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.113 -0.118 19502 1624 1 5 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.575 0.980 19502 1625 1 5 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.998 0.040 19502 1626 1 5 . 1 1 723 723 LEU H H 723 7.794 7.794 7.723 0.071 19502 1627 1 5 . 1 1 724 724 ASN N N 724 115.161 115.161 115.540 -0.379 19502 1628 1 5 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.678 -0.066 19502 1629 1 5 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.171 0.066 19502 1630 1 5 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.680 -0.403 19502 1631 1 5 . 1 1 724 724 ASN H H 724 8.892 8.892 7.706 1.186 19502 1632 1 5 . 1 1 725 725 THR N N 725 110.273 110.273 114.753 -4.480 19502 1633 1 5 . 1 1 725 725 THR HA H 725 4.527 4.527 4.368 0.159 19502 1634 1 5 . 1 1 725 725 THR CA C 725 62.903 62.903 64.020 -1.117 19502 1635 1 5 . 1 1 725 725 THR CB C 725 70.619 70.619 69.827 0.792 19502 1636 1 5 . 1 1 725 725 THR H H 725 7.874 7.874 7.699 0.175 19502 1637 1 5 . 1 1 726 726 ASN N N 726 117.048 117.048 118.328 -1.280 19502 1638 1 5 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.134 0.005 19502 1639 1 5 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.266 1.572 19502 1640 1 5 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.777 -1.870 19502 1641 1 5 . 1 1 726 726 ASN H H 726 8.613 8.613 7.939 0.674 19502 1642 1 5 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.318 -0.254 19502 1643 1 5 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.169 0.340 19502 1644 1 5 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.450 -1.005 19502 1645 1 5 . 1 1 728 728 VAL N N 728 118.643 118.643 118.701 -0.058 19502 1646 1 5 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.671 -0.271 19502 1647 1 5 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.347 1.219 19502 1648 1 5 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.033 0.393 19502 1649 1 5 . 1 1 728 728 VAL H H 728 8.182 8.182 7.715 0.467 19502 1650 1 5 . 1 1 729 729 GLY N N 729 105.307 105.307 107.132 -1.825 19502 1651 1 5 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.697 0.953 19502 1652 1 5 . 1 1 729 729 GLY H H 729 7.297 7.297 8.468 -1.171 19502 1653 1 5 . 1 1 730 730 GLY N N 730 109.038 109.038 109.857 -0.819 19502 1654 1 5 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.126 0.566 19502 1655 1 5 . 1 1 730 730 GLY H H 730 8.080 8.080 7.607 0.473 19502 1656 1 5 . 1 1 731 731 LEU N N 731 123.822 123.822 123.602 0.220 19502 1657 1 5 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.015 0.021 19502 1658 1 5 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.361 0.235 19502 1659 1 5 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.521 0.694 19502 1660 1 5 . 1 1 731 731 LEU H H 731 8.287 8.287 8.164 0.123 19502 1661 1 5 . 1 1 732 732 LEU N N 732 118.759 118.759 118.815 -0.056 19502 1662 1 5 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.868 0.218 19502 1663 1 5 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.269 0.239 19502 1664 1 5 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.407 -0.423 19502 1665 1 5 . 1 1 732 732 LEU H H 732 8.412 8.412 8.171 0.241 19502 1666 1 5 . 1 1 733 733 GLU N N 733 121.155 121.155 119.878 1.277 19502 1667 1 5 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.949 0.324 19502 1668 1 5 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.123 -0.050 19502 1669 1 5 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.980 0.000 19502 1670 1 5 . 1 1 733 733 GLU H H 733 8.003 8.003 7.965 0.038 19502 1671 1 5 . 1 1 734 734 TYR N N 734 122.518 122.518 121.255 1.263 19502 1672 1 5 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.933 0.248 19502 1673 1 5 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.502 0.457 19502 1674 1 5 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.200 -0.356 19502 1675 1 5 . 1 1 734 734 TYR H H 734 8.419 8.419 8.358 0.061 19502 1676 1 5 . 1 1 735 735 ALA N N 735 122.353 122.353 121.104 1.249 19502 1677 1 5 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.792 0.020 19502 1678 1 5 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.083 1.089 19502 1679 1 5 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.614 0.219 19502 1680 1 5 . 1 1 735 735 ALA H H 735 8.777 8.777 7.990 0.787 19502 1681 1 5 . 1 1 736 736 ARG N N 736 118.852 118.852 117.505 1.347 19502 1682 1 5 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.087 0.086 19502 1683 1 5 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.569 0.954 19502 1684 1 5 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.861 0.295 19502 1685 1 5 . 1 1 736 736 ARG H H 736 8.570 8.570 8.366 0.204 19502 1686 1 5 . 1 1 737 737 SER N N 737 115.125 115.125 113.565 1.560 19502 1687 1 5 . 1 1 737 737 SER HA H 737 4.149 4.149 4.412 -0.264 19502 1688 1 5 . 1 1 737 737 SER CA C 737 61.300 61.300 60.105 1.195 19502 1689 1 5 . 1 1 737 737 SER CB C 737 63.166 63.166 63.777 -0.611 19502 1690 1 5 . 1 1 737 737 SER H H 737 8.257 8.257 8.031 0.226 19502 1691 1 5 . 1 1 738 738 HIS N N 738 117.591 117.591 116.470 1.121 19502 1692 1 5 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.539 -0.199 19502 1693 1 5 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.307 0.701 19502 1694 1 5 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.202 -0.672 19502 1695 1 5 . 1 1 738 738 HIS H H 738 7.300 7.300 7.800 -0.500 19502 1696 1 5 . 1 1 739 739 GLY N N 739 107.604 107.604 107.675 -0.071 19502 1697 1 5 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.900 1.231 19502 1698 1 5 . 1 1 739 739 GLY H H 739 7.638 7.638 8.145 -0.507 19502 1699 1 5 . 1 1 740 740 PHE N N 740 118.114 118.114 120.140 -2.026 19502 1700 1 5 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.529 0.658 19502 1701 1 5 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.491 -2.088 19502 1702 1 5 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.228 2.754 19502 1703 1 5 . 1 1 740 740 PHE H H 740 8.138 8.138 7.730 0.408 19502 1704 1 5 . 1 1 741 741 ALA N N 741 122.577 122.577 120.438 2.139 19502 1705 1 5 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.597 0.058 19502 1706 1 5 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.780 0.491 19502 1707 1 5 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.219 -1.243 19502 1708 1 5 . 1 1 741 741 ALA H H 741 8.550 8.550 8.630 -0.080 19502 1709 1 5 . 1 1 742 742 ALA N N 742 124.016 124.016 126.883 -2.867 19502 1710 1 5 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.475 0.431 19502 1711 1 5 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.156 -0.127 19502 1712 1 5 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.374 0.986 19502 1713 1 5 . 1 1 742 742 ALA H H 742 8.511 8.511 8.529 -0.018 19502 1714 1 5 . 1 1 743 743 GLU N N 743 120.968 120.968 123.794 -2.826 19502 1715 1 5 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.623 -0.073 19502 1716 1 5 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.775 -0.009 19502 1717 1 5 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.260 0.729 19502 1718 1 5 . 1 1 743 743 GLU H H 743 8.628 8.628 8.111 0.517 19502 1719 1 5 . 1 1 744 744 PHE N N 744 120.078 120.078 122.016 -1.938 19502 1720 1 5 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.205 -0.390 19502 1721 1 5 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.100 0.071 19502 1722 1 5 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.335 0.040 19502 1723 1 5 . 1 1 744 744 PHE H H 744 8.792 8.792 8.808 -0.016 19502 1724 1 5 . 1 1 745 745 LYS N N 745 124.937 124.937 123.923 1.014 19502 1725 1 5 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.755 -0.162 19502 1726 1 5 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.287 0.783 19502 1727 1 5 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.773 -2.228 19502 1728 1 5 . 1 1 745 745 LYS H H 745 9.180 9.180 8.202 0.978 19502 1729 1 5 . 1 1 746 746 LEU N N 746 129.002 129.002 124.719 4.283 19502 1730 1 5 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.711 0.213 19502 1731 1 5 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.942 -0.244 19502 1732 1 5 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.701 -1.122 19502 1733 1 5 . 1 1 746 746 LEU H H 746 8.687 8.687 8.385 0.302 19502 1734 1 5 . 1 1 747 747 VAL N N 747 131.114 131.114 127.020 4.094 19502 1735 1 5 . 1 1 747 747 VAL HA H 747 3.745 3.745 4.062 -0.317 19502 1736 1 5 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.420 -0.286 19502 1737 1 5 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.781 0.190 19502 1738 1 5 . 1 1 747 747 VAL H H 747 9.033 9.033 8.914 0.119 19502 1739 1 5 . 1 1 748 748 ASP N N 748 113.346 113.346 118.938 -5.592 19502 1740 1 5 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.764 0.020 19502 1741 1 5 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.442 0.892 19502 1742 1 5 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.927 2.264 19502 1743 1 5 . 1 1 748 748 ASP H H 748 7.426 7.426 7.671 -0.245 19502 1744 1 5 . 1 1 749 749 GLN N N 749 120.867 120.867 124.080 -3.213 19502 1745 1 5 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.172 -0.102 19502 1746 1 5 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.805 -0.202 19502 1747 1 5 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.800 1.123 19502 1748 1 5 . 1 1 749 749 GLN H H 749 7.647 7.647 8.633 -0.986 19502 1749 1 5 . 1 1 750 750 SER N N 750 119.661 119.661 123.573 -3.912 19502 1750 1 5 . 1 1 750 750 SER HA H 750 4.791 4.791 4.708 0.083 19502 1751 1 5 . 1 1 750 750 SER CA C 750 57.575 57.575 58.113 -0.538 19502 1752 1 5 . 1 1 750 750 SER CB C 750 65.910 65.910 64.539 1.371 19502 1753 1 5 . 1 1 750 750 SER H H 750 8.891 8.891 8.182 0.709 19502 1754 1 5 . 1 1 751 751 GLY N N 751 106.531 106.531 111.191 -4.660 19502 1755 1 5 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.537 -0.323 19502 1756 1 5 . 1 1 751 751 GLY H H 751 8.183 8.183 7.944 0.239 19502 1757 1 5 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.798 0.050 19502 1758 1 5 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.017 0.520 19502 1759 1 5 . 1 1 752 752 PRO CB C 752 30.898 30.898 31.179 -0.281 19502 1760 1 5 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.267 -0.041 19502 1761 1 5 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.720 0.625 19502 1762 1 5 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.635 0.272 19502 1763 1 5 . 1 1 754 754 HIS N N 754 109.780 109.780 114.846 -5.066 19502 1764 1 5 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.690 0.068 19502 1765 1 5 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.802 -0.573 19502 1766 1 5 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.940 0.554 19502 1767 1 5 . 1 1 754 754 HIS H H 754 7.707 7.707 8.238 -0.531 19502 1768 1 5 . 1 1 755 755 GLU N N 755 122.843 122.843 120.618 2.225 19502 1769 1 5 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.843 -0.231 19502 1770 1 5 . 1 1 755 755 GLU CA C 755 54.649 54.649 52.996 1.653 19502 1771 1 5 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.541 0.272 19502 1772 1 5 . 1 1 755 755 GLU H H 755 7.404 7.404 7.228 0.176 19502 1773 1 5 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.303 0.314 19502 1774 1 5 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.666 0.450 19502 1775 1 5 . 1 1 756 756 PRO CB C 756 33.251 33.251 32.297 0.954 19502 1776 1 5 . 1 1 757 757 LYS N N 757 119.032 119.032 122.127 -3.095 19502 1777 1 5 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.841 -0.237 19502 1778 1 5 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.926 0.718 19502 1779 1 5 . 1 1 757 757 LYS CB C 757 35.196 35.196 34.633 0.563 19502 1780 1 5 . 1 1 757 757 LYS H H 757 8.195 8.195 7.852 0.343 19502 1781 1 5 . 1 1 758 758 PHE N N 758 120.288 120.288 125.800 -5.512 19502 1782 1 5 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.992 0.048 19502 1783 1 5 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.513 0.303 19502 1784 1 5 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.602 2.698 19502 1785 1 5 . 1 1 758 758 PHE H H 758 8.844 8.844 9.175 -0.331 19502 1786 1 5 . 1 1 759 759 VAL N N 759 121.385 121.385 125.251 -3.866 19502 1787 1 5 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.574 0.818 19502 1788 1 5 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.408 -1.758 19502 1789 1 5 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.907 2.331 19502 1790 1 5 . 1 1 759 759 VAL H H 759 8.609 8.609 9.250 -0.641 19502 1791 1 5 . 1 1 760 760 TYR N N 760 126.374 126.374 128.684 -2.310 19502 1792 1 5 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.378 0.419 19502 1793 1 5 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.011 -0.091 19502 1794 1 5 . 1 1 760 760 TYR CB C 760 46.853 46.853 41.712 5.141 19502 1795 1 5 . 1 1 760 760 TYR H H 760 8.903 8.903 9.474 -0.571 19502 1796 1 5 . 1 1 761 761 GLN N N 761 115.228 115.228 122.132 -6.904 19502 1797 1 5 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.588 -0.764 19502 1798 1 5 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.686 1.840 19502 1799 1 5 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.960 -0.642 19502 1800 1 5 . 1 1 761 761 GLN H H 761 9.016 9.016 8.498 0.518 19502 1801 1 5 . 1 1 762 762 ALA N N 762 128.023 128.023 129.078 -1.055 19502 1802 1 5 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.710 0.471 19502 1803 1 5 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.703 0.172 19502 1804 1 5 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.631 0.520 19502 1805 1 5 . 1 1 762 762 ALA H H 762 9.500 9.500 8.858 0.642 19502 1806 1 5 . 1 1 763 763 LYS N N 763 122.022 122.022 127.686 -5.664 19502 1807 1 5 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.515 0.349 19502 1808 1 5 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.804 0.341 19502 1809 1 5 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.031 3.425 19502 1810 1 5 . 1 1 763 763 LYS H H 763 8.347 8.347 8.631 -0.284 19502 1811 1 5 . 1 1 764 764 VAL N N 764 123.980 123.980 128.359 -4.379 19502 1812 1 5 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.935 -0.308 19502 1813 1 5 . 1 1 764 764 VAL CA C 764 60.966 60.966 61.068 -0.102 19502 1814 1 5 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.216 3.604 19502 1815 1 5 . 1 1 764 764 VAL H H 764 8.703 8.703 8.602 0.101 19502 1816 1 5 . 1 1 765 765 GLY N N 765 119.292 119.292 117.796 1.496 19502 1817 1 5 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.259 0.364 19502 1818 1 5 . 1 1 765 765 GLY H H 765 9.151 9.151 8.902 0.249 19502 1819 1 5 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.167 1.023 19502 1820 1 5 . 1 1 767 767 ARG N N 767 119.571 119.571 121.644 -2.073 19502 1821 1 5 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.706 -0.313 19502 1822 1 5 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.595 0.754 19502 1823 1 5 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.489 -0.170 19502 1824 1 5 . 1 1 767 767 ARG H H 767 7.595 7.595 7.416 0.179 19502 1825 1 5 . 1 1 768 768 TRP N N 768 122.976 122.976 127.348 -4.372 19502 1826 1 5 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.025 -0.455 19502 1827 1 5 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.241 0.225 19502 1828 1 5 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.427 0.791 19502 1829 1 5 . 1 1 768 768 TRP H H 768 8.056 8.056 8.888 -0.832 19502 1830 1 5 . 1 1 769 769 PHE N N 769 116.997 116.997 123.485 -6.488 19502 1831 1 5 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.781 -0.031 19502 1832 1 5 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.656 2.073 19502 1833 1 5 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.126 -0.829 19502 1834 1 5 . 1 1 769 769 PHE H H 769 7.532 7.532 8.827 -1.295 19502 1835 1 5 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.741 -0.017 19502 1836 1 5 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.828 2.470 19502 1837 1 5 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.758 0.017 19502 1838 1 5 . 1 1 771 771 ALA N N 771 125.979 125.979 121.800 4.179 19502 1839 1 5 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.317 -0.083 19502 1840 1 5 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.474 0.168 19502 1841 1 5 . 1 1 771 771 ALA CB C 771 19.655 19.655 20.957 -1.302 19502 1842 1 5 . 1 1 771 771 ALA H H 771 9.069 9.069 8.077 0.992 19502 1843 1 5 . 1 1 772 772 VAL N N 772 113.901 113.901 116.824 -2.923 19502 1844 1 5 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.822 -0.011 19502 1845 1 5 . 1 1 772 772 VAL CA C 772 59.149 59.149 60.259 -1.110 19502 1846 1 5 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.538 -0.292 19502 1847 1 5 . 1 1 772 772 VAL H H 772 9.024 9.024 9.329 -0.305 19502 1848 1 5 . 1 1 773 773 CYS N N 773 119.222 119.222 121.373 -2.151 19502 1849 1 5 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.435 0.172 19502 1850 1 5 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.645 0.113 19502 1851 1 5 . 1 1 773 773 CYS CB C 773 29.841 29.841 27.822 2.019 19502 1852 1 5 . 1 1 773 773 CYS H H 773 8.597 8.597 8.617 -0.020 19502 1853 1 5 . 1 1 774 774 ALA N N 774 124.328 124.328 127.620 -3.292 19502 1854 1 5 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.677 0.126 19502 1855 1 5 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.600 0.631 19502 1856 1 5 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.710 2.415 19502 1857 1 5 . 1 1 774 774 ALA H H 774 9.238 9.238 8.829 0.409 19502 1858 1 5 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.346 -0.090 19502 1859 1 5 . 1 1 775 775 HIS CA C 775 56.529 56.529 56.443 0.086 19502 1860 1 5 . 1 1 775 775 HIS CB C 775 30.133 30.133 31.396 -1.263 19502 1861 1 5 . 1 1 776 776 SER N N 776 110.366 110.366 112.255 -1.889 19502 1862 1 5 . 1 1 776 776 SER HA H 776 4.766 4.766 4.800 -0.034 19502 1863 1 5 . 1 1 776 776 SER CA C 776 57.029 57.029 57.537 -0.508 19502 1864 1 5 . 1 1 776 776 SER H H 776 7.550 7.550 7.617 -0.067 19502 1865 1 5 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.494 0.093 19502 1866 1 5 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.857 0.579 19502 1867 1 5 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.105 0.099 19502 1868 1 5 . 1 1 778 778 LYS N N 778 118.469 118.469 118.887 -0.418 19502 1869 1 5 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.836 -0.072 19502 1870 1 5 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.290 0.621 19502 1871 1 5 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.873 1.812 19502 1872 1 5 . 1 1 778 778 LYS H H 778 8.151 8.151 8.225 -0.074 19502 1873 1 5 . 1 1 779 779 GLN N N 779 117.975 117.975 117.486 0.489 19502 1874 1 5 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.924 0.089 19502 1875 1 5 . 1 1 779 779 GLN CA C 779 57.909 57.909 59.271 -1.362 19502 1876 1 5 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.271 0.288 19502 1877 1 5 . 1 1 779 779 GLN H H 779 7.773 7.773 8.465 -0.692 19502 1878 1 5 . 1 1 780 780 GLY N N 780 108.214 108.214 107.306 0.908 19502 1879 1 5 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.897 1.114 19502 1880 1 5 . 1 1 780 780 GLY H H 780 8.273 8.273 8.014 0.259 19502 1881 1 5 . 1 1 781 781 LYS N N 781 120.027 120.027 122.149 -2.122 19502 1882 1 5 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.713 -0.624 19502 1883 1 5 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.848 0.510 19502 1884 1 5 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.858 -0.172 19502 1885 1 5 . 1 1 781 781 LYS H H 781 7.307 7.307 8.046 -0.739 19502 1886 1 5 . 1 1 782 782 GLN N N 782 117.131 117.131 118.383 -1.252 19502 1887 1 5 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.885 -0.117 19502 1888 1 5 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.283 0.512 19502 1889 1 5 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.677 -0.124 19502 1890 1 5 . 1 1 782 782 GLN H H 782 7.227 7.227 8.028 -0.801 19502 1891 1 5 . 1 1 783 783 GLU N N 783 117.958 117.958 119.653 -1.695 19502 1892 1 5 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.019 0.184 19502 1893 1 5 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.182 -0.218 19502 1894 1 5 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.161 -0.202 19502 1895 1 5 . 1 1 783 783 GLU H H 783 8.896 8.896 8.612 0.284 19502 1896 1 5 . 1 1 784 784 ALA N N 784 124.176 124.176 122.493 1.683 19502 1897 1 5 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.043 0.091 19502 1898 1 5 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.409 -0.194 19502 1899 1 5 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.485 -0.888 19502 1900 1 5 . 1 1 784 784 ALA H H 784 8.532 8.532 8.599 -0.067 19502 1901 1 5 . 1 1 785 785 ALA N N 785 121.847 121.847 120.965 0.882 19502 1902 1 5 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.931 0.111 19502 1903 1 5 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.200 -0.031 19502 1904 1 5 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.304 0.089 19502 1905 1 5 . 1 1 785 785 ALA H H 785 8.402 8.402 8.039 0.363 19502 1906 1 5 . 1 1 786 786 ASP N N 786 120.625 120.625 119.741 0.884 19502 1907 1 5 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.252 -0.100 19502 1908 1 5 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.902 0.269 19502 1909 1 5 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.935 1.581 19502 1910 1 5 . 1 1 786 786 ASP H H 786 8.524 8.524 8.468 0.056 19502 1911 1 5 . 1 1 787 787 ALA N N 787 118.408 118.408 121.875 -3.467 19502 1912 1 5 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.068 -0.092 19502 1913 1 5 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.968 0.148 19502 1914 1 5 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.341 -0.071 19502 1915 1 5 . 1 1 787 787 ALA H H 787 8.191 8.191 8.033 0.158 19502 1916 1 5 . 1 1 788 788 ALA N N 788 118.510 118.510 121.784 -3.274 19502 1917 1 5 . 1 1 788 788 ALA HA H 788 3.704 3.704 3.916 -0.212 19502 1918 1 5 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.000 -0.107 19502 1919 1 5 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.916 0.657 19502 1920 1 5 . 1 1 788 788 ALA H H 788 7.533 7.533 8.068 -0.535 19502 1921 1 5 . 1 1 789 789 LEU N N 789 117.413 117.413 118.441 -1.028 19502 1922 1 5 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.741 -0.051 19502 1923 1 5 . 1 1 789 789 LEU CA C 789 58.180 58.180 58.064 0.116 19502 1924 1 5 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.288 0.816 19502 1925 1 5 . 1 1 789 789 LEU H H 789 8.520 8.520 8.068 0.452 19502 1926 1 5 . 1 1 790 790 ARG N N 790 116.360 116.360 119.194 -2.834 19502 1927 1 5 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.982 -0.064 19502 1928 1 5 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.444 1.359 19502 1929 1 5 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.903 -0.142 19502 1930 1 5 . 1 1 790 790 ARG H H 790 8.293 8.293 7.755 0.538 19502 1931 1 5 . 1 1 791 791 VAL N N 791 120.700 120.700 120.242 0.458 19502 1932 1 5 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.726 0.186 19502 1933 1 5 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.095 0.389 19502 1934 1 5 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.156 0.580 19502 1935 1 5 . 1 1 791 791 VAL H H 791 7.455 7.455 7.973 -0.518 19502 1936 1 5 . 1 1 792 792 LEU N N 792 120.706 120.706 119.685 1.021 19502 1937 1 5 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.839 0.193 19502 1938 1 5 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.155 -0.288 19502 1939 1 5 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.090 1.157 19502 1940 1 5 . 1 1 792 792 LEU H H 792 8.007 8.007 8.064 -0.057 19502 1941 1 5 . 1 1 793 793 ILE N N 793 118.876 118.876 118.280 0.596 19502 1942 1 5 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.667 0.062 19502 1943 1 5 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.456 -0.455 19502 1944 1 5 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.584 1.371 19502 1945 1 5 . 1 1 793 793 ILE H H 793 8.778 8.778 8.619 0.159 19502 1946 1 5 . 1 1 794 794 GLY N N 794 107.008 107.008 107.725 -0.717 19502 1947 1 5 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.253 -0.620 19502 1948 1 5 . 1 1 794 794 GLY H H 794 7.810 7.810 8.229 -0.419 19502 1949 1 5 . 1 1 795 795 GLU N N 795 119.866 119.866 120.203 -0.337 19502 1950 1 5 . 1 1 795 795 GLU HA H 795 4.356 4.356 3.916 0.440 19502 1951 1 5 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.890 -2.186 19502 1952 1 5 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.371 0.709 19502 1953 1 5 . 1 1 795 795 GLU H H 795 7.978 7.978 8.635 -0.657 19502 1954 1 5 . 1 1 796 796 ASN N N 796 118.365 118.365 115.912 2.453 19502 1955 1 5 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.629 0.153 19502 1956 1 5 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.202 -0.620 19502 1957 1 5 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.904 1.141 19502 1958 1 5 . 1 1 796 796 ASN H H 796 8.053 8.053 7.488 0.565 19502 1959 1 5 . 1 1 797 797 GLU N N 797 120.368 120.368 119.688 0.680 19502 1960 1 5 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.197 0.139 19502 1961 1 5 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.599 -0.975 19502 1962 1 5 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.796 0.546 19502 1963 1 5 . 1 1 797 797 GLU H H 797 8.225 8.225 8.470 -0.245 19502 1964 1 5 . 1 1 798 798 LYS N N 798 120.614 120.614 117.267 3.347 19502 1965 1 5 . 1 1 798 798 LYS H H 798 8.088 8.088 7.978 0.110 19502 1966 1 5 . 1 1 799 799 ALA N N 799 124.642 124.642 120.209 4.433 19502 1967 1 5 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.128 0.313 19502 1968 1 5 . 1 1 799 799 ALA CA C 799 52.692 52.692 53.770 -1.078 19502 1969 1 5 . 1 1 799 799 ALA CB C 799 19.617 19.617 17.274 2.343 19502 1970 1 5 . 1 1 799 799 ALA H H 799 8.138 8.138 7.928 0.210 19502 1971 1 5 . 1 1 800 800 GLU N N 800 120.408 120.408 115.694 4.714 19502 1972 1 5 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.418 -0.023 19502 1973 1 5 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.509 1.301 19502 1974 1 5 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.590 1.014 19502 1975 1 5 . 1 1 800 800 GLU H H 800 8.337 8.337 8.397 -0.060 19502 1976 1 6 . 1 1 713 713 VAL N N 713 120.649 120.649 120.961 -0.312 19502 1977 1 6 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.240 -0.120 19502 1978 1 6 . 1 1 713 713 VAL CA C 713 63.009 63.009 60.296 2.713 19502 1979 1 6 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.128 -0.381 19502 1980 1 6 . 1 1 713 713 VAL H H 713 8.051 8.051 7.675 0.376 19502 1981 1 6 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.432 0.049 19502 1982 1 6 . 1 1 715 715 LYS CA C 715 56.754 56.754 56.216 0.538 19502 1983 1 6 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.550 0.465 19502 1984 1 6 . 1 1 716 716 ILE N N 716 121.593 121.593 118.155 3.438 19502 1985 1 6 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.785 0.314 19502 1986 1 6 . 1 1 716 716 ILE CA C 716 62.829 62.829 64.215 -1.386 19502 1987 1 6 . 1 1 716 716 ILE CB C 716 38.166 38.166 36.810 1.356 19502 1988 1 6 . 1 1 716 716 ILE H H 716 8.406 8.406 8.261 0.145 19502 1989 1 6 . 1 1 717 717 GLY N N 717 108.628 108.628 105.696 2.932 19502 1990 1 6 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.881 -0.207 19502 1991 1 6 . 1 1 717 717 GLY H H 717 8.476 8.476 8.804 -0.328 19502 1992 1 6 . 1 1 718 718 GLU N N 718 119.944 119.944 122.173 -2.229 19502 1993 1 6 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.203 0.074 19502 1994 1 6 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.747 -0.560 19502 1995 1 6 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.556 0.481 19502 1996 1 6 . 1 1 718 718 GLU H H 718 8.055 8.055 7.729 0.326 19502 1997 1 6 . 1 1 719 719 LEU N N 719 118.538 118.538 119.706 -1.168 19502 1998 1 6 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.257 0.121 19502 1999 1 6 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.276 0.065 19502 2000 1 6 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.649 1.391 19502 2001 1 6 . 1 1 719 719 LEU H H 719 8.098 8.098 8.168 -0.070 19502 2002 1 6 . 1 1 720 720 VAL N N 720 117.613 117.613 118.653 -1.040 19502 2003 1 6 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.654 0.050 19502 2004 1 6 . 1 1 720 720 VAL CA C 720 65.619 65.619 67.133 -1.514 19502 2005 1 6 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.187 0.737 19502 2006 1 6 . 1 1 720 720 VAL H H 720 7.838 7.838 7.669 0.169 19502 2007 1 6 . 1 1 721 721 ARG N N 721 118.905 118.905 118.170 0.735 19502 2008 1 6 . 1 1 721 721 ARG HA H 721 4.179 4.179 4.198 -0.019 19502 2009 1 6 . 1 1 721 721 ARG CA C 721 58.420 58.420 58.904 -0.484 19502 2010 1 6 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.407 0.180 19502 2011 1 6 . 1 1 721 721 ARG H H 721 7.614 7.614 7.516 0.098 19502 2012 1 6 . 1 1 722 722 TYR N N 722 117.574 117.574 117.941 -0.367 19502 2013 1 6 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.340 0.009 19502 2014 1 6 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.769 -0.704 19502 2015 1 6 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.283 0.548 19502 2016 1 6 . 1 1 722 722 TYR H H 722 7.885 7.885 7.339 0.546 19502 2017 1 6 . 1 1 723 723 LEU N N 723 120.520 120.520 117.181 3.339 19502 2018 1 6 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.085 -0.090 19502 2019 1 6 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.970 0.585 19502 2020 1 6 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.837 0.201 19502 2021 1 6 . 1 1 723 723 LEU H H 723 7.794 7.794 7.631 0.163 19502 2022 1 6 . 1 1 724 724 ASN N N 724 115.161 115.161 115.817 -0.656 19502 2023 1 6 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.648 -0.036 19502 2024 1 6 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.222 0.015 19502 2025 1 6 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.044 0.233 19502 2026 1 6 . 1 1 724 724 ASN H H 724 8.892 8.892 7.681 1.211 19502 2027 1 6 . 1 1 725 725 THR N N 725 110.273 110.273 115.024 -4.751 19502 2028 1 6 . 1 1 725 725 THR HA H 725 4.527 4.527 4.274 0.253 19502 2029 1 6 . 1 1 725 725 THR CA C 725 62.903 62.903 64.484 -1.581 19502 2030 1 6 . 1 1 725 725 THR CB C 725 70.619 70.619 69.592 1.027 19502 2031 1 6 . 1 1 725 725 THR H H 725 7.874 7.874 7.968 -0.094 19502 2032 1 6 . 1 1 726 726 ASN N N 726 117.048 117.048 118.081 -1.033 19502 2033 1 6 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.106 0.033 19502 2034 1 6 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.536 1.302 19502 2035 1 6 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.975 -2.068 19502 2036 1 6 . 1 1 726 726 ASN H H 726 8.613 8.613 7.945 0.668 19502 2037 1 6 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.397 -0.333 19502 2038 1 6 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.174 0.335 19502 2039 1 6 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.565 -1.120 19502 2040 1 6 . 1 1 728 728 VAL N N 728 118.643 118.643 119.030 -0.387 19502 2041 1 6 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.662 -0.262 19502 2042 1 6 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.295 1.271 19502 2043 1 6 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.034 0.392 19502 2044 1 6 . 1 1 728 728 VAL H H 728 8.182 8.182 7.570 0.612 19502 2045 1 6 . 1 1 729 729 GLY N N 729 105.307 105.307 107.175 -1.868 19502 2046 1 6 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.662 0.988 19502 2047 1 6 . 1 1 729 729 GLY H H 729 7.297 7.297 8.275 -0.978 19502 2048 1 6 . 1 1 730 730 GLY N N 730 109.038 109.038 109.878 -0.840 19502 2049 1 6 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.110 0.582 19502 2050 1 6 . 1 1 730 730 GLY H H 730 8.080 8.080 7.686 0.394 19502 2051 1 6 . 1 1 731 731 LEU N N 731 123.822 123.822 123.525 0.297 19502 2052 1 6 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.012 0.024 19502 2053 1 6 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.531 0.065 19502 2054 1 6 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.592 0.624 19502 2055 1 6 . 1 1 731 731 LEU H H 731 8.287 8.287 8.387 -0.100 19502 2056 1 6 . 1 1 732 732 LEU N N 732 118.759 118.759 118.597 0.162 19502 2057 1 6 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.890 0.196 19502 2058 1 6 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.132 0.376 19502 2059 1 6 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.446 -0.463 19502 2060 1 6 . 1 1 732 732 LEU H H 732 8.412 8.412 7.957 0.455 19502 2061 1 6 . 1 1 733 733 GLU N N 733 121.155 121.155 120.340 0.815 19502 2062 1 6 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.933 0.340 19502 2063 1 6 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.181 -0.108 19502 2064 1 6 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.998 -0.018 19502 2065 1 6 . 1 1 733 733 GLU H H 733 8.003 8.003 8.103 -0.100 19502 2066 1 6 . 1 1 734 734 TYR N N 734 122.518 122.518 120.837 1.681 19502 2067 1 6 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.901 0.280 19502 2068 1 6 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.290 0.669 19502 2069 1 6 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.221 -0.377 19502 2070 1 6 . 1 1 734 734 TYR H H 734 8.419 8.419 8.306 0.113 19502 2071 1 6 . 1 1 735 735 ALA N N 735 122.353 122.353 121.403 0.950 19502 2072 1 6 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.688 0.124 19502 2073 1 6 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.949 1.224 19502 2074 1 6 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.559 0.274 19502 2075 1 6 . 1 1 735 735 ALA H H 735 8.777 8.777 7.791 0.986 19502 2076 1 6 . 1 1 736 736 ARG N N 736 118.852 118.852 117.869 0.983 19502 2077 1 6 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.022 0.151 19502 2078 1 6 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.719 0.803 19502 2079 1 6 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.779 0.377 19502 2080 1 6 . 1 1 736 736 ARG H H 736 8.570 8.570 8.495 0.075 19502 2081 1 6 . 1 1 737 737 SER N N 737 115.125 115.125 112.391 2.734 19502 2082 1 6 . 1 1 737 737 SER HA H 737 4.149 4.149 4.382 -0.233 19502 2083 1 6 . 1 1 737 737 SER CA C 737 61.300 61.300 59.812 1.488 19502 2084 1 6 . 1 1 737 737 SER CB C 737 63.166 63.166 63.595 -0.429 19502 2085 1 6 . 1 1 737 737 SER H H 737 8.257 8.257 7.823 0.434 19502 2086 1 6 . 1 1 738 738 HIS N N 738 117.591 117.591 117.305 0.286 19502 2087 1 6 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.696 -0.356 19502 2088 1 6 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.310 1.698 19502 2089 1 6 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.119 -0.589 19502 2090 1 6 . 1 1 738 738 HIS H H 738 7.300 7.300 7.565 -0.265 19502 2091 1 6 . 1 1 739 739 GLY N N 739 107.604 107.604 107.620 -0.016 19502 2092 1 6 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.217 0.914 19502 2093 1 6 . 1 1 739 739 GLY H H 739 7.638 7.638 7.874 -0.236 19502 2094 1 6 . 1 1 740 740 PHE N N 740 118.114 118.114 120.488 -2.374 19502 2095 1 6 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.455 0.732 19502 2096 1 6 . 1 1 740 740 PHE CA C 740 54.403 54.403 57.016 -2.613 19502 2097 1 6 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.035 2.946 19502 2098 1 6 . 1 1 740 740 PHE H H 740 8.138 8.138 7.882 0.256 19502 2099 1 6 . 1 1 741 741 ALA N N 741 122.577 122.577 123.179 -0.602 19502 2100 1 6 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.457 0.198 19502 2101 1 6 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.622 0.649 19502 2102 1 6 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.549 0.427 19502 2103 1 6 . 1 1 741 741 ALA H H 741 8.550 8.550 8.529 0.021 19502 2104 1 6 . 1 1 742 742 ALA N N 742 124.016 124.016 129.023 -5.007 19502 2105 1 6 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.868 0.038 19502 2106 1 6 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.266 -0.237 19502 2107 1 6 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.516 0.844 19502 2108 1 6 . 1 1 742 742 ALA H H 742 8.511 8.511 8.658 -0.147 19502 2109 1 6 . 1 1 743 743 GLU N N 743 120.968 120.968 123.314 -2.346 19502 2110 1 6 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.585 -0.035 19502 2111 1 6 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.939 -0.173 19502 2112 1 6 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.692 0.297 19502 2113 1 6 . 1 1 743 743 GLU H H 743 8.628 8.628 8.649 -0.021 19502 2114 1 6 . 1 1 744 744 PHE N N 744 120.078 120.078 122.960 -2.882 19502 2115 1 6 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.201 -0.386 19502 2116 1 6 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.127 0.044 19502 2117 1 6 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.883 0.492 19502 2118 1 6 . 1 1 744 744 PHE H H 744 8.792 8.792 8.879 -0.087 19502 2119 1 6 . 1 1 745 745 LYS N N 745 124.937 124.937 123.890 1.047 19502 2120 1 6 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.801 -0.208 19502 2121 1 6 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.492 0.578 19502 2122 1 6 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.221 -1.676 19502 2123 1 6 . 1 1 745 745 LYS H H 745 9.180 9.180 8.180 1.000 19502 2124 1 6 . 1 1 746 746 LEU N N 746 129.002 129.002 125.683 3.319 19502 2125 1 6 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.701 0.223 19502 2126 1 6 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.750 -0.052 19502 2127 1 6 . 1 1 746 746 LEU CB C 746 40.579 40.579 42.019 -1.440 19502 2128 1 6 . 1 1 746 746 LEU H H 746 8.687 8.687 8.456 0.231 19502 2129 1 6 . 1 1 747 747 VAL N N 747 131.114 131.114 127.587 3.527 19502 2130 1 6 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.995 -0.250 19502 2131 1 6 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.036 0.098 19502 2132 1 6 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.340 0.631 19502 2133 1 6 . 1 1 747 747 VAL H H 747 9.033 9.033 9.104 -0.071 19502 2134 1 6 . 1 1 748 748 ASP N N 748 113.346 113.346 115.820 -2.474 19502 2135 1 6 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.774 0.010 19502 2136 1 6 . 1 1 748 748 ASP CA C 748 54.334 54.334 54.009 0.325 19502 2137 1 6 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.675 2.515 19502 2138 1 6 . 1 1 748 748 ASP H H 748 7.426 7.426 7.562 -0.136 19502 2139 1 6 . 1 1 749 749 GLN N N 749 120.867 120.867 121.991 -1.124 19502 2140 1 6 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.925 0.145 19502 2141 1 6 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.044 -0.440 19502 2142 1 6 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.744 1.179 19502 2143 1 6 . 1 1 749 749 GLN H H 749 7.647 7.647 8.488 -0.841 19502 2144 1 6 . 1 1 750 750 SER N N 750 119.661 119.661 124.684 -5.023 19502 2145 1 6 . 1 1 750 750 SER HA H 750 4.791 4.791 4.716 0.075 19502 2146 1 6 . 1 1 750 750 SER CA C 750 57.575 57.575 57.960 -0.385 19502 2147 1 6 . 1 1 750 750 SER CB C 750 65.910 65.910 64.419 1.491 19502 2148 1 6 . 1 1 750 750 SER H H 750 8.891 8.891 8.908 -0.017 19502 2149 1 6 . 1 1 751 751 GLY N N 751 106.531 106.531 112.337 -5.806 19502 2150 1 6 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.727 -0.513 19502 2151 1 6 . 1 1 751 751 GLY H H 751 8.183 8.183 7.998 0.185 19502 2152 1 6 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.684 0.164 19502 2153 1 6 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.172 0.366 19502 2154 1 6 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.664 0.234 19502 2155 1 6 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.214 0.012 19502 2156 1 6 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.950 0.395 19502 2157 1 6 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.462 0.445 19502 2158 1 6 . 1 1 754 754 HIS N N 754 109.780 109.780 112.477 -2.697 19502 2159 1 6 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.751 0.007 19502 2160 1 6 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.184 0.045 19502 2161 1 6 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.877 0.617 19502 2162 1 6 . 1 1 754 754 HIS H H 754 7.707 7.707 8.182 -0.475 19502 2163 1 6 . 1 1 755 755 GLU N N 755 122.843 122.843 120.624 2.219 19502 2164 1 6 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.792 -0.180 19502 2165 1 6 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.693 0.956 19502 2166 1 6 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.222 -0.409 19502 2167 1 6 . 1 1 755 755 GLU H H 755 7.404 7.404 7.496 -0.092 19502 2168 1 6 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.205 0.412 19502 2169 1 6 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.740 0.376 19502 2170 1 6 . 1 1 756 756 PRO CB C 756 33.251 33.251 30.748 2.503 19502 2171 1 6 . 1 1 757 757 LYS N N 757 119.032 119.032 125.288 -6.256 19502 2172 1 6 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.397 0.207 19502 2173 1 6 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.662 -0.018 19502 2174 1 6 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.148 2.048 19502 2175 1 6 . 1 1 757 757 LYS H H 757 8.195 8.195 7.719 0.476 19502 2176 1 6 . 1 1 758 758 PHE N N 758 120.288 120.288 126.213 -5.925 19502 2177 1 6 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.711 0.329 19502 2178 1 6 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.240 -0.424 19502 2179 1 6 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.378 2.922 19502 2180 1 6 . 1 1 758 758 PHE H H 758 8.844 8.844 9.253 -0.409 19502 2181 1 6 . 1 1 759 759 VAL N N 759 121.385 121.385 123.296 -1.911 19502 2182 1 6 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.674 0.718 19502 2183 1 6 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.694 -1.044 19502 2184 1 6 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.111 2.127 19502 2185 1 6 . 1 1 759 759 VAL H H 759 8.609 8.609 9.269 -0.660 19502 2186 1 6 . 1 1 760 760 TYR N N 760 126.374 126.374 128.570 -2.196 19502 2187 1 6 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.254 0.543 19502 2188 1 6 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.935 -0.015 19502 2189 1 6 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.425 4.428 19502 2190 1 6 . 1 1 760 760 TYR H H 760 8.903 8.903 9.387 -0.484 19502 2191 1 6 . 1 1 761 761 GLN N N 761 115.228 115.228 122.200 -6.972 19502 2192 1 6 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.638 -0.814 19502 2193 1 6 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.441 2.085 19502 2194 1 6 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.953 -0.635 19502 2195 1 6 . 1 1 761 761 GLN H H 761 9.016 9.016 8.516 0.500 19502 2196 1 6 . 1 1 762 762 ALA N N 762 128.023 128.023 129.111 -1.088 19502 2197 1 6 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.414 0.767 19502 2198 1 6 . 1 1 762 762 ALA CA C 762 50.875 50.875 51.000 -0.125 19502 2199 1 6 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.383 0.768 19502 2200 1 6 . 1 1 762 762 ALA H H 762 9.500 9.500 8.904 0.596 19502 2201 1 6 . 1 1 763 763 LYS N N 763 122.022 122.022 127.374 -5.352 19502 2202 1 6 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.321 0.543 19502 2203 1 6 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.834 0.311 19502 2204 1 6 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.086 3.370 19502 2205 1 6 . 1 1 763 763 LYS H H 763 8.347 8.347 8.811 -0.464 19502 2206 1 6 . 1 1 764 764 VAL N N 764 123.980 123.980 127.587 -3.607 19502 2207 1 6 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.237 0.390 19502 2208 1 6 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.222 0.744 19502 2209 1 6 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.790 4.030 19502 2210 1 6 . 1 1 764 764 VAL H H 764 8.703 8.703 8.819 -0.116 19502 2211 1 6 . 1 1 765 765 GLY N N 765 119.292 119.292 117.809 1.483 19502 2212 1 6 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.333 0.290 19502 2213 1 6 . 1 1 765 765 GLY H H 765 9.151 9.151 9.165 -0.014 19502 2214 1 6 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.706 0.484 19502 2215 1 6 . 1 1 767 767 ARG N N 767 119.571 119.571 122.122 -2.551 19502 2216 1 6 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.665 -0.272 19502 2217 1 6 . 1 1 767 767 ARG CA C 767 55.349 55.349 55.149 0.200 19502 2218 1 6 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.594 0.725 19502 2219 1 6 . 1 1 767 767 ARG H H 767 7.595 7.595 7.663 -0.068 19502 2220 1 6 . 1 1 768 768 TRP N N 768 122.976 122.976 125.660 -2.684 19502 2221 1 6 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.128 -0.558 19502 2222 1 6 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.130 0.336 19502 2223 1 6 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.710 0.508 19502 2224 1 6 . 1 1 768 768 TRP H H 768 8.056 8.056 8.967 -0.911 19502 2225 1 6 . 1 1 769 769 PHE N N 769 116.997 116.997 122.584 -5.587 19502 2226 1 6 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.814 -0.064 19502 2227 1 6 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.667 2.062 19502 2228 1 6 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.209 -0.912 19502 2229 1 6 . 1 1 769 769 PHE H H 769 7.532 7.532 8.633 -1.101 19502 2230 1 6 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.737 -0.013 19502 2231 1 6 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.886 2.413 19502 2232 1 6 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.777 -0.002 19502 2233 1 6 . 1 1 771 771 ALA N N 771 125.979 125.979 122.733 3.246 19502 2234 1 6 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.168 0.066 19502 2235 1 6 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.443 0.199 19502 2236 1 6 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.606 0.049 19502 2237 1 6 . 1 1 771 771 ALA H H 771 9.069 9.069 8.214 0.855 19502 2238 1 6 . 1 1 772 772 VAL N N 772 113.901 113.901 119.482 -5.581 19502 2239 1 6 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.883 -0.072 19502 2240 1 6 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.918 -0.769 19502 2241 1 6 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.852 0.394 19502 2242 1 6 . 1 1 772 772 VAL H H 772 9.024 9.024 9.083 -0.059 19502 2243 1 6 . 1 1 773 773 CYS N N 773 119.222 119.222 118.777 0.445 19502 2244 1 6 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.713 -0.106 19502 2245 1 6 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.999 0.759 19502 2246 1 6 . 1 1 773 773 CYS CB C 773 29.841 29.841 29.409 0.432 19502 2247 1 6 . 1 1 773 773 CYS H H 773 8.597 8.597 8.354 0.243 19502 2248 1 6 . 1 1 774 774 ALA N N 774 124.328 124.328 127.838 -3.510 19502 2249 1 6 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.655 0.148 19502 2250 1 6 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.396 0.835 19502 2251 1 6 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.475 1.650 19502 2252 1 6 . 1 1 774 774 ALA H H 774 9.238 9.238 8.896 0.342 19502 2253 1 6 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.751 0.505 19502 2254 1 6 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.803 0.725 19502 2255 1 6 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.508 0.625 19502 2256 1 6 . 1 1 776 776 SER N N 776 110.366 110.366 114.670 -4.304 19502 2257 1 6 . 1 1 776 776 SER HA H 776 4.766 4.766 4.921 -0.155 19502 2258 1 6 . 1 1 776 776 SER CA C 776 57.029 57.029 57.641 -0.612 19502 2259 1 6 . 1 1 776 776 SER H H 776 7.550 7.550 7.682 -0.132 19502 2260 1 6 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.629 -0.042 19502 2261 1 6 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.870 0.566 19502 2262 1 6 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.087 0.117 19502 2263 1 6 . 1 1 778 778 LYS N N 778 118.469 118.469 117.805 0.664 19502 2264 1 6 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.903 -0.139 19502 2265 1 6 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.016 0.895 19502 2266 1 6 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.625 2.060 19502 2267 1 6 . 1 1 778 778 LYS H H 778 8.151 8.151 8.268 -0.117 19502 2268 1 6 . 1 1 779 779 GLN N N 779 117.975 117.975 118.727 -0.752 19502 2269 1 6 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.051 -0.038 19502 2270 1 6 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.792 -0.883 19502 2271 1 6 . 1 1 779 779 GLN CB C 779 28.560 28.560 27.955 0.605 19502 2272 1 6 . 1 1 779 779 GLN H H 779 7.773 7.773 8.320 -0.547 19502 2273 1 6 . 1 1 780 780 GLY N N 780 108.214 108.214 107.843 0.371 19502 2274 1 6 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.027 0.984 19502 2275 1 6 . 1 1 780 780 GLY H H 780 8.273 8.273 8.584 -0.311 19502 2276 1 6 . 1 1 781 781 LYS N N 781 120.027 120.027 121.979 -1.952 19502 2277 1 6 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.676 -0.587 19502 2278 1 6 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.584 0.774 19502 2279 1 6 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.870 -0.184 19502 2280 1 6 . 1 1 781 781 LYS H H 781 7.307 7.307 7.344 -0.037 19502 2281 1 6 . 1 1 782 782 GLN N N 782 117.131 117.131 118.610 -1.479 19502 2282 1 6 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.864 -0.096 19502 2283 1 6 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.294 0.501 19502 2284 1 6 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.651 -0.098 19502 2285 1 6 . 1 1 782 782 GLN H H 782 7.227 7.227 8.154 -0.927 19502 2286 1 6 . 1 1 783 783 GLU N N 783 117.958 117.958 119.418 -1.460 19502 2287 1 6 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.004 0.199 19502 2288 1 6 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.261 -0.297 19502 2289 1 6 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.155 -0.196 19502 2290 1 6 . 1 1 783 783 GLU H H 783 8.896 8.896 8.683 0.213 19502 2291 1 6 . 1 1 784 784 ALA N N 784 124.176 124.176 122.279 1.897 19502 2292 1 6 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.041 0.093 19502 2293 1 6 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.346 -0.132 19502 2294 1 6 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.453 -0.856 19502 2295 1 6 . 1 1 784 784 ALA H H 784 8.532 8.532 7.978 0.554 19502 2296 1 6 . 1 1 785 785 ALA N N 785 121.847 121.847 120.678 1.169 19502 2297 1 6 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.021 0.021 19502 2298 1 6 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.256 -0.087 19502 2299 1 6 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.234 0.159 19502 2300 1 6 . 1 1 785 785 ALA H H 785 8.402 8.402 8.147 0.255 19502 2301 1 6 . 1 1 786 786 ASP N N 786 120.625 120.625 119.950 0.675 19502 2302 1 6 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.257 -0.105 19502 2303 1 6 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.726 0.445 19502 2304 1 6 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.880 1.636 19502 2305 1 6 . 1 1 786 786 ASP H H 786 8.524 8.524 8.254 0.270 19502 2306 1 6 . 1 1 787 787 ALA N N 787 118.408 118.408 121.634 -3.226 19502 2307 1 6 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.073 -0.097 19502 2308 1 6 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.943 0.173 19502 2309 1 6 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.365 -0.095 19502 2310 1 6 . 1 1 787 787 ALA H H 787 8.191 8.191 8.061 0.130 19502 2311 1 6 . 1 1 788 788 ALA N N 788 118.510 118.510 121.682 -3.172 19502 2312 1 6 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.060 -0.356 19502 2313 1 6 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.002 -0.109 19502 2314 1 6 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.037 0.536 19502 2315 1 6 . 1 1 788 788 ALA H H 788 7.533 7.533 8.089 -0.556 19502 2316 1 6 . 1 1 789 789 LEU N N 789 117.413 117.413 117.826 -0.413 19502 2317 1 6 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.784 -0.094 19502 2318 1 6 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.641 0.539 19502 2319 1 6 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.178 0.926 19502 2320 1 6 . 1 1 789 789 LEU H H 789 8.520 8.520 7.787 0.733 19502 2321 1 6 . 1 1 790 790 ARG N N 790 116.360 116.360 119.251 -2.891 19502 2322 1 6 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.038 -0.120 19502 2323 1 6 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.377 2.426 19502 2324 1 6 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.057 0.704 19502 2325 1 6 . 1 1 790 790 ARG H H 790 8.293 8.293 7.713 0.580 19502 2326 1 6 . 1 1 791 791 VAL N N 791 120.700 120.700 119.880 0.820 19502 2327 1 6 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.625 0.287 19502 2328 1 6 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.204 0.281 19502 2329 1 6 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.461 0.275 19502 2330 1 6 . 1 1 791 791 VAL H H 791 7.455 7.455 7.864 -0.409 19502 2331 1 6 . 1 1 792 792 LEU N N 792 120.706 120.706 119.860 0.846 19502 2332 1 6 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.928 0.104 19502 2333 1 6 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.809 0.058 19502 2334 1 6 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.403 0.844 19502 2335 1 6 . 1 1 792 792 LEU H H 792 8.007 8.007 7.440 0.567 19502 2336 1 6 . 1 1 793 793 ILE N N 793 118.876 118.876 119.362 -0.486 19502 2337 1 6 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.601 0.128 19502 2338 1 6 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.300 -0.299 19502 2339 1 6 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.675 1.280 19502 2340 1 6 . 1 1 793 793 ILE H H 793 8.778 8.778 8.522 0.256 19502 2341 1 6 . 1 1 794 794 GLY N N 794 107.008 107.008 105.597 1.411 19502 2342 1 6 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.732 -0.099 19502 2343 1 6 . 1 1 794 794 GLY H H 794 7.810 7.810 8.316 -0.506 19502 2344 1 6 . 1 1 795 795 GLU N N 795 119.866 119.866 121.279 -1.413 19502 2345 1 6 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.188 0.168 19502 2346 1 6 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.306 -0.602 19502 2347 1 6 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.863 0.217 19502 2348 1 6 . 1 1 795 795 GLU H H 795 7.978 7.978 7.604 0.374 19502 2349 1 6 . 1 1 796 796 ASN N N 796 118.365 118.365 116.603 1.762 19502 2350 1 6 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.767 0.015 19502 2351 1 6 . 1 1 796 796 ASN CA C 796 54.582 54.582 53.904 0.678 19502 2352 1 6 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.184 0.861 19502 2353 1 6 . 1 1 796 796 ASN H H 796 8.053 8.053 8.208 -0.155 19502 2354 1 6 . 1 1 797 797 GLU N N 797 120.368 120.368 120.751 -0.383 19502 2355 1 6 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.023 0.313 19502 2356 1 6 . 1 1 797 797 GLU CA C 797 57.624 57.624 59.539 -1.915 19502 2357 1 6 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.887 0.455 19502 2358 1 6 . 1 1 797 797 GLU H H 797 8.225 8.225 7.719 0.506 19502 2359 1 6 . 1 1 798 798 LYS N N 798 120.614 120.614 118.997 1.617 19502 2360 1 6 . 1 1 798 798 LYS H H 798 8.088 8.088 8.263 -0.175 19502 2361 1 6 . 1 1 799 799 ALA N N 799 124.642 124.642 124.228 0.414 19502 2362 1 6 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.515 -0.074 19502 2363 1 6 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.660 1.032 19502 2364 1 6 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.285 -0.668 19502 2365 1 6 . 1 1 799 799 ALA H H 799 8.138 8.138 7.425 0.713 19502 2366 1 6 . 1 1 800 800 GLU N N 800 120.408 120.408 118.252 2.156 19502 2367 1 6 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.398 -0.003 19502 2368 1 6 . 1 1 800 800 GLU CA C 800 56.810 56.810 57.231 -0.421 19502 2369 1 6 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.939 0.666 19502 2370 1 6 . 1 1 800 800 GLU H H 800 8.337 8.337 8.617 -0.280 19502 2371 1 7 . 1 1 713 713 VAL N N 713 120.649 120.649 123.616 -2.967 19502 2372 1 7 . 1 1 713 713 VAL HA H 713 4.120 4.120 3.976 0.144 19502 2373 1 7 . 1 1 713 713 VAL CA C 713 63.009 63.009 62.346 0.663 19502 2374 1 7 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.803 -1.056 19502 2375 1 7 . 1 1 713 713 VAL H H 713 8.051 8.051 8.426 -0.375 19502 2376 1 7 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.239 0.242 19502 2377 1 7 . 1 1 715 715 LYS CA C 715 56.754 56.754 56.542 0.212 19502 2378 1 7 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.532 0.483 19502 2379 1 7 . 1 1 716 716 ILE N N 716 121.593 121.593 128.683 -7.090 19502 2380 1 7 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.952 0.147 19502 2381 1 7 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.944 -0.115 19502 2382 1 7 . 1 1 716 716 ILE CB C 716 38.166 38.166 36.804 1.362 19502 2383 1 7 . 1 1 716 716 ILE H H 716 8.406 8.406 8.680 -0.274 19502 2384 1 7 . 1 1 717 717 GLY N N 717 108.628 108.628 107.852 0.776 19502 2385 1 7 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.077 -0.403 19502 2386 1 7 . 1 1 717 717 GLY H H 717 8.476 8.476 8.685 -0.209 19502 2387 1 7 . 1 1 718 718 GLU N N 718 119.944 119.944 121.343 -1.399 19502 2388 1 7 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.106 0.171 19502 2389 1 7 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.884 -0.697 19502 2390 1 7 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.133 0.905 19502 2391 1 7 . 1 1 718 718 GLU H H 718 8.055 8.055 7.797 0.258 19502 2392 1 7 . 1 1 719 719 LEU N N 719 118.538 118.538 118.127 0.411 19502 2393 1 7 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.417 -0.039 19502 2394 1 7 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.844 0.498 19502 2395 1 7 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.628 1.412 19502 2396 1 7 . 1 1 719 719 LEU H H 719 8.098 8.098 7.533 0.565 19502 2397 1 7 . 1 1 720 720 VAL N N 720 117.613 117.613 119.152 -1.539 19502 2398 1 7 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.716 -0.012 19502 2399 1 7 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.518 -0.899 19502 2400 1 7 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.433 0.490 19502 2401 1 7 . 1 1 720 720 VAL H H 720 7.838 7.838 7.693 0.145 19502 2402 1 7 . 1 1 721 721 ARG N N 721 118.905 118.905 119.801 -0.896 19502 2403 1 7 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.969 0.210 19502 2404 1 7 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.203 -0.783 19502 2405 1 7 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.289 0.298 19502 2406 1 7 . 1 1 721 721 ARG H H 721 7.614 7.614 7.652 -0.038 19502 2407 1 7 . 1 1 722 722 TYR N N 722 117.574 117.574 118.836 -1.262 19502 2408 1 7 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.325 0.024 19502 2409 1 7 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.840 -0.775 19502 2410 1 7 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.169 0.662 19502 2411 1 7 . 1 1 722 722 TYR H H 722 7.885 7.885 7.342 0.543 19502 2412 1 7 . 1 1 723 723 LEU N N 723 120.520 120.520 116.743 3.777 19502 2413 1 7 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.052 -0.057 19502 2414 1 7 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.636 0.919 19502 2415 1 7 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.879 0.159 19502 2416 1 7 . 1 1 723 723 LEU H H 723 7.794 7.794 7.537 0.257 19502 2417 1 7 . 1 1 724 724 ASN N N 724 115.161 115.161 114.988 0.173 19502 2418 1 7 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.698 -0.086 19502 2419 1 7 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.274 -0.037 19502 2420 1 7 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.435 -0.158 19502 2421 1 7 . 1 1 724 724 ASN H H 724 8.892 8.892 7.663 1.229 19502 2422 1 7 . 1 1 725 725 THR N N 725 110.273 110.273 115.546 -5.273 19502 2423 1 7 . 1 1 725 725 THR HA H 725 4.527 4.527 4.317 0.210 19502 2424 1 7 . 1 1 725 725 THR CA C 725 62.903 62.903 65.028 -2.125 19502 2425 1 7 . 1 1 725 725 THR CB C 725 70.619 70.619 69.625 0.994 19502 2426 1 7 . 1 1 725 725 THR H H 725 7.874 7.874 8.065 -0.191 19502 2427 1 7 . 1 1 726 726 ASN N N 726 117.048 117.048 117.500 -0.452 19502 2428 1 7 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.113 0.026 19502 2429 1 7 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.556 1.282 19502 2430 1 7 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.585 -1.678 19502 2431 1 7 . 1 1 726 726 ASN H H 726 8.613 8.613 7.993 0.620 19502 2432 1 7 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.376 -0.312 19502 2433 1 7 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.069 0.440 19502 2434 1 7 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.571 -1.126 19502 2435 1 7 . 1 1 728 728 VAL N N 728 118.643 118.643 118.466 0.177 19502 2436 1 7 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.657 -0.257 19502 2437 1 7 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.518 1.048 19502 2438 1 7 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.986 0.440 19502 2439 1 7 . 1 1 728 728 VAL H H 728 8.182 8.182 7.888 0.294 19502 2440 1 7 . 1 1 729 729 GLY N N 729 105.307 105.307 106.632 -1.325 19502 2441 1 7 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.902 0.748 19502 2442 1 7 . 1 1 729 729 GLY H H 729 7.297 7.297 7.943 -0.646 19502 2443 1 7 . 1 1 730 730 GLY N N 730 109.038 109.038 109.356 -0.318 19502 2444 1 7 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.814 0.878 19502 2445 1 7 . 1 1 730 730 GLY H H 730 8.080 8.080 7.141 0.939 19502 2446 1 7 . 1 1 731 731 LEU N N 731 123.822 123.822 123.616 0.206 19502 2447 1 7 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.021 0.015 19502 2448 1 7 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.426 0.170 19502 2449 1 7 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.526 0.689 19502 2450 1 7 . 1 1 731 731 LEU H H 731 8.287 8.287 8.357 -0.070 19502 2451 1 7 . 1 1 732 732 LEU N N 732 118.759 118.759 117.553 1.206 19502 2452 1 7 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.886 0.200 19502 2453 1 7 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.177 0.331 19502 2454 1 7 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.672 -0.689 19502 2455 1 7 . 1 1 732 732 LEU H H 732 8.412 8.412 8.288 0.124 19502 2456 1 7 . 1 1 733 733 GLU N N 733 121.155 121.155 119.277 1.878 19502 2457 1 7 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.996 0.277 19502 2458 1 7 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.759 0.314 19502 2459 1 7 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.144 -0.164 19502 2460 1 7 . 1 1 733 733 GLU H H 733 8.003 8.003 7.765 0.238 19502 2461 1 7 . 1 1 734 734 TYR N N 734 122.518 122.518 122.874 -0.356 19502 2462 1 7 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.953 0.228 19502 2463 1 7 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.546 0.413 19502 2464 1 7 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.270 -0.426 19502 2465 1 7 . 1 1 734 734 TYR H H 734 8.419 8.419 8.457 -0.038 19502 2466 1 7 . 1 1 735 735 ALA N N 735 122.353 122.353 121.340 1.013 19502 2467 1 7 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.817 -0.005 19502 2468 1 7 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.069 1.103 19502 2469 1 7 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.551 0.282 19502 2470 1 7 . 1 1 735 735 ALA H H 735 8.777 8.777 7.747 1.030 19502 2471 1 7 . 1 1 736 736 ARG N N 736 118.852 118.852 118.158 0.694 19502 2472 1 7 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.043 0.130 19502 2473 1 7 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.611 0.912 19502 2474 1 7 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.787 0.369 19502 2475 1 7 . 1 1 736 736 ARG H H 736 8.570 8.570 7.830 0.740 19502 2476 1 7 . 1 1 737 737 SER N N 737 115.125 115.125 113.682 1.443 19502 2477 1 7 . 1 1 737 737 SER HA H 737 4.149 4.149 4.304 -0.155 19502 2478 1 7 . 1 1 737 737 SER CA C 737 61.300 61.300 60.460 0.840 19502 2479 1 7 . 1 1 737 737 SER CB C 737 63.166 63.166 63.479 -0.313 19502 2480 1 7 . 1 1 737 737 SER H H 737 8.257 8.257 8.204 0.053 19502 2481 1 7 . 1 1 738 738 HIS N N 738 117.591 117.591 116.750 0.841 19502 2482 1 7 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.551 -0.211 19502 2483 1 7 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.206 0.802 19502 2484 1 7 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.809 -0.279 19502 2485 1 7 . 1 1 738 738 HIS H H 738 7.300 7.300 7.771 -0.471 19502 2486 1 7 . 1 1 739 739 GLY N N 739 107.604 107.604 108.273 -0.669 19502 2487 1 7 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.303 0.827 19502 2488 1 7 . 1 1 739 739 GLY H H 739 7.638 7.638 7.966 -0.328 19502 2489 1 7 . 1 1 740 740 PHE N N 740 118.114 118.114 120.172 -2.058 19502 2490 1 7 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.591 0.596 19502 2491 1 7 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.229 -1.826 19502 2492 1 7 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.230 2.752 19502 2493 1 7 . 1 1 740 740 PHE H H 740 8.138 8.138 7.811 0.327 19502 2494 1 7 . 1 1 741 741 ALA N N 741 122.577 122.577 120.087 2.490 19502 2495 1 7 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.653 0.002 19502 2496 1 7 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.827 0.444 19502 2497 1 7 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.471 -1.495 19502 2498 1 7 . 1 1 741 741 ALA H H 741 8.550 8.550 8.620 -0.070 19502 2499 1 7 . 1 1 742 742 ALA N N 742 124.016 124.016 126.527 -2.511 19502 2500 1 7 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.196 -0.290 19502 2501 1 7 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.376 0.653 19502 2502 1 7 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.606 -0.246 19502 2503 1 7 . 1 1 742 742 ALA H H 742 8.511 8.511 8.472 0.039 19502 2504 1 7 . 1 1 743 743 GLU N N 743 120.968 120.968 122.272 -1.304 19502 2505 1 7 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.583 -0.033 19502 2506 1 7 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.881 -0.115 19502 2507 1 7 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.683 1.306 19502 2508 1 7 . 1 1 743 743 GLU H H 743 8.628 8.628 8.372 0.256 19502 2509 1 7 . 1 1 744 744 PHE N N 744 120.078 120.078 120.562 -0.484 19502 2510 1 7 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.254 -0.439 19502 2511 1 7 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.092 0.079 19502 2512 1 7 . 1 1 744 744 PHE CB C 744 40.375 40.375 41.166 -0.791 19502 2513 1 7 . 1 1 744 744 PHE H H 744 8.792 8.792 8.809 -0.017 19502 2514 1 7 . 1 1 745 745 LYS N N 745 124.937 124.937 124.071 0.866 19502 2515 1 7 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.872 -0.279 19502 2516 1 7 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.620 0.451 19502 2517 1 7 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.800 -2.255 19502 2518 1 7 . 1 1 745 745 LYS H H 745 9.180 9.180 8.408 0.772 19502 2519 1 7 . 1 1 746 746 LEU N N 746 129.002 129.002 127.156 1.846 19502 2520 1 7 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.639 0.285 19502 2521 1 7 . 1 1 746 746 LEU CA C 746 54.698 54.698 55.263 -0.565 19502 2522 1 7 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.869 -1.290 19502 2523 1 7 . 1 1 746 746 LEU H H 746 8.687 8.687 8.747 -0.060 19502 2524 1 7 . 1 1 747 747 VAL N N 747 131.114 131.114 126.778 4.336 19502 2525 1 7 . 1 1 747 747 VAL HA H 747 3.745 3.745 4.050 -0.305 19502 2526 1 7 . 1 1 747 747 VAL CA C 747 64.134 64.134 63.659 0.475 19502 2527 1 7 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.838 0.133 19502 2528 1 7 . 1 1 747 747 VAL H H 747 9.033 9.033 9.067 -0.034 19502 2529 1 7 . 1 1 748 748 ASP N N 748 113.346 113.346 117.165 -3.819 19502 2530 1 7 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.852 -0.068 19502 2531 1 7 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.500 0.834 19502 2532 1 7 . 1 1 748 748 ASP CB C 748 46.191 46.191 44.171 2.020 19502 2533 1 7 . 1 1 748 748 ASP H H 748 7.426 7.426 7.555 -0.129 19502 2534 1 7 . 1 1 749 749 GLN N N 749 120.867 120.867 122.493 -1.626 19502 2535 1 7 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.994 0.076 19502 2536 1 7 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.011 -0.408 19502 2537 1 7 . 1 1 749 749 GLN CB C 749 31.923 31.923 31.062 0.861 19502 2538 1 7 . 1 1 749 749 GLN H H 749 7.647 7.647 8.435 -0.788 19502 2539 1 7 . 1 1 750 750 SER N N 750 119.661 119.661 121.870 -2.209 19502 2540 1 7 . 1 1 750 750 SER HA H 750 4.791 4.791 4.721 0.070 19502 2541 1 7 . 1 1 750 750 SER CA C 750 57.575 57.575 57.091 0.484 19502 2542 1 7 . 1 1 750 750 SER CB C 750 65.910 65.910 64.937 0.973 19502 2543 1 7 . 1 1 750 750 SER H H 750 8.891 8.891 8.633 0.258 19502 2544 1 7 . 1 1 751 751 GLY N N 751 106.531 106.531 108.948 -2.417 19502 2545 1 7 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.536 -0.322 19502 2546 1 7 . 1 1 751 751 GLY H H 751 8.183 8.183 8.151 0.032 19502 2547 1 7 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.859 -0.011 19502 2548 1 7 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.022 0.516 19502 2549 1 7 . 1 1 752 752 PRO CB C 752 30.898 30.898 31.313 -0.415 19502 2550 1 7 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.333 -0.107 19502 2551 1 7 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.486 0.859 19502 2552 1 7 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.628 0.279 19502 2553 1 7 . 1 1 754 754 HIS N N 754 109.780 109.780 115.511 -5.731 19502 2554 1 7 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.598 0.160 19502 2555 1 7 . 1 1 754 754 HIS CA C 754 56.229 56.229 57.363 -1.134 19502 2556 1 7 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.773 0.721 19502 2557 1 7 . 1 1 754 754 HIS H H 754 7.707 7.707 8.267 -0.560 19502 2558 1 7 . 1 1 755 755 GLU N N 755 122.843 122.843 120.299 2.544 19502 2559 1 7 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.700 -0.088 19502 2560 1 7 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.078 1.571 19502 2561 1 7 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.392 0.421 19502 2562 1 7 . 1 1 755 755 GLU H H 755 7.404 7.404 7.810 -0.406 19502 2563 1 7 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.327 0.290 19502 2564 1 7 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.652 0.464 19502 2565 1 7 . 1 1 756 756 PRO CB C 756 33.251 33.251 32.016 1.235 19502 2566 1 7 . 1 1 757 757 LYS N N 757 119.032 119.032 124.817 -5.785 19502 2567 1 7 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.723 -0.119 19502 2568 1 7 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.049 0.595 19502 2569 1 7 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.882 1.314 19502 2570 1 7 . 1 1 757 757 LYS H H 757 8.195 8.195 8.817 -0.622 19502 2571 1 7 . 1 1 758 758 PHE N N 758 120.288 120.288 126.498 -6.210 19502 2572 1 7 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.863 0.177 19502 2573 1 7 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.177 -0.361 19502 2574 1 7 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.035 3.265 19502 2575 1 7 . 1 1 758 758 PHE H H 758 8.844 8.844 9.522 -0.678 19502 2576 1 7 . 1 1 759 759 VAL N N 759 121.385 121.385 124.872 -3.487 19502 2577 1 7 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.654 0.738 19502 2578 1 7 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.290 -1.640 19502 2579 1 7 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.392 1.846 19502 2580 1 7 . 1 1 759 759 VAL H H 759 8.609 8.609 9.259 -0.650 19502 2581 1 7 . 1 1 760 760 TYR N N 760 126.374 126.374 128.766 -2.392 19502 2582 1 7 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.183 0.614 19502 2583 1 7 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.943 -0.023 19502 2584 1 7 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.312 4.541 19502 2585 1 7 . 1 1 760 760 TYR H H 760 8.903 8.903 9.391 -0.488 19502 2586 1 7 . 1 1 761 761 GLN N N 761 115.228 115.228 123.828 -8.600 19502 2587 1 7 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.649 -0.825 19502 2588 1 7 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.514 2.011 19502 2589 1 7 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.341 -0.023 19502 2590 1 7 . 1 1 761 761 GLN H H 761 9.016 9.016 8.365 0.651 19502 2591 1 7 . 1 1 762 762 ALA N N 762 128.023 128.023 130.027 -2.004 19502 2592 1 7 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.464 0.717 19502 2593 1 7 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.882 -0.007 19502 2594 1 7 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.730 0.421 19502 2595 1 7 . 1 1 762 762 ALA H H 762 9.500 9.500 8.821 0.679 19502 2596 1 7 . 1 1 763 763 LYS N N 763 122.022 122.022 127.078 -5.056 19502 2597 1 7 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.549 0.315 19502 2598 1 7 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.621 0.524 19502 2599 1 7 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.658 2.798 19502 2600 1 7 . 1 1 763 763 LYS H H 763 8.347 8.347 8.706 -0.359 19502 2601 1 7 . 1 1 764 764 VAL N N 764 123.980 123.980 128.029 -4.049 19502 2602 1 7 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.853 -0.226 19502 2603 1 7 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.699 0.267 19502 2604 1 7 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.634 3.186 19502 2605 1 7 . 1 1 764 764 VAL H H 764 8.703 8.703 8.555 0.148 19502 2606 1 7 . 1 1 765 765 GLY N N 765 119.292 119.292 117.586 1.706 19502 2607 1 7 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.218 0.405 19502 2608 1 7 . 1 1 765 765 GLY H H 765 9.151 9.151 8.958 0.193 19502 2609 1 7 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.476 0.714 19502 2610 1 7 . 1 1 767 767 ARG N N 767 119.571 119.571 120.958 -1.387 19502 2611 1 7 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.724 -0.331 19502 2612 1 7 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.372 0.977 19502 2613 1 7 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.593 0.726 19502 2614 1 7 . 1 1 767 767 ARG H H 767 7.595 7.595 7.603 -0.008 19502 2615 1 7 . 1 1 768 768 TRP N N 768 122.976 122.976 125.453 -2.477 19502 2616 1 7 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.083 -0.513 19502 2617 1 7 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.174 0.292 19502 2618 1 7 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.939 0.279 19502 2619 1 7 . 1 1 768 768 TRP H H 768 8.056 8.056 8.884 -0.828 19502 2620 1 7 . 1 1 769 769 PHE N N 769 116.997 116.997 122.896 -5.899 19502 2621 1 7 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.753 -0.003 19502 2622 1 7 . 1 1 769 769 PHE CA C 769 57.729 57.729 56.041 1.688 19502 2623 1 7 . 1 1 769 769 PHE CB C 769 39.297 39.297 39.877 -0.580 19502 2624 1 7 . 1 1 769 769 PHE H H 769 7.532 7.532 8.789 -1.257 19502 2625 1 7 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.753 -0.029 19502 2626 1 7 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.737 2.562 19502 2627 1 7 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.690 0.085 19502 2628 1 7 . 1 1 771 771 ALA N N 771 125.979 125.979 121.361 4.618 19502 2629 1 7 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.016 0.218 19502 2630 1 7 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.676 -0.034 19502 2631 1 7 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.506 0.149 19502 2632 1 7 . 1 1 771 771 ALA H H 771 9.069 9.069 8.311 0.758 19502 2633 1 7 . 1 1 772 772 VAL N N 772 113.901 113.901 119.458 -5.557 19502 2634 1 7 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.896 -0.085 19502 2635 1 7 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.948 -0.799 19502 2636 1 7 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.681 0.565 19502 2637 1 7 . 1 1 772 772 VAL H H 772 9.024 9.024 9.112 -0.088 19502 2638 1 7 . 1 1 773 773 CYS N N 773 119.222 119.222 118.168 1.054 19502 2639 1 7 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.711 -0.104 19502 2640 1 7 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.527 1.231 19502 2641 1 7 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.666 1.175 19502 2642 1 7 . 1 1 773 773 CYS H H 773 8.597 8.597 8.450 0.147 19502 2643 1 7 . 1 1 774 774 ALA N N 774 124.328 124.328 127.144 -2.816 19502 2644 1 7 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.768 0.035 19502 2645 1 7 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.432 0.799 19502 2646 1 7 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.136 1.989 19502 2647 1 7 . 1 1 774 774 ALA H H 774 9.238 9.238 8.656 0.582 19502 2648 1 7 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.899 0.357 19502 2649 1 7 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.849 0.680 19502 2650 1 7 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.588 0.545 19502 2651 1 7 . 1 1 776 776 SER N N 776 110.366 110.366 112.794 -2.428 19502 2652 1 7 . 1 1 776 776 SER HA H 776 4.766 4.766 4.731 0.035 19502 2653 1 7 . 1 1 776 776 SER CA C 776 57.029 57.029 56.570 0.459 19502 2654 1 7 . 1 1 776 776 SER H H 776 7.550 7.550 7.460 0.090 19502 2655 1 7 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.563 0.024 19502 2656 1 7 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.544 0.892 19502 2657 1 7 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.869 0.335 19502 2658 1 7 . 1 1 778 778 LYS N N 778 118.469 118.469 116.063 2.406 19502 2659 1 7 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.837 -0.073 19502 2660 1 7 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.743 1.168 19502 2661 1 7 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.509 2.176 19502 2662 1 7 . 1 1 778 778 LYS H H 778 8.151 8.151 8.146 0.005 19502 2663 1 7 . 1 1 779 779 GLN N N 779 117.975 117.975 119.490 -1.515 19502 2664 1 7 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.038 -0.025 19502 2665 1 7 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.330 -0.421 19502 2666 1 7 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.477 0.082 19502 2667 1 7 . 1 1 779 779 GLN H H 779 7.773 7.773 7.256 0.517 19502 2668 1 7 . 1 1 780 780 GLY N N 780 108.214 108.214 108.445 -0.231 19502 2669 1 7 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.171 0.840 19502 2670 1 7 . 1 1 780 780 GLY H H 780 8.273 8.273 8.299 -0.026 19502 2671 1 7 . 1 1 781 781 LYS N N 781 120.027 120.027 121.477 -1.450 19502 2672 1 7 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.450 -0.361 19502 2673 1 7 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.476 0.882 19502 2674 1 7 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.684 0.002 19502 2675 1 7 . 1 1 781 781 LYS H H 781 7.307 7.307 7.105 0.202 19502 2676 1 7 . 1 1 782 782 GLN N N 782 117.131 117.131 118.603 -1.472 19502 2677 1 7 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.828 -0.060 19502 2678 1 7 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.209 0.586 19502 2679 1 7 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.609 -0.056 19502 2680 1 7 . 1 1 782 782 GLN H H 782 7.227 7.227 7.343 -0.116 19502 2681 1 7 . 1 1 783 783 GLU N N 783 117.958 117.958 119.330 -1.372 19502 2682 1 7 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.010 0.193 19502 2683 1 7 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.156 -0.192 19502 2684 1 7 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.058 -0.099 19502 2685 1 7 . 1 1 783 783 GLU H H 783 8.896 8.896 8.810 0.086 19502 2686 1 7 . 1 1 784 784 ALA N N 784 124.176 124.176 122.484 1.692 19502 2687 1 7 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.063 0.071 19502 2688 1 7 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.392 -0.177 19502 2689 1 7 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.484 -0.887 19502 2690 1 7 . 1 1 784 784 ALA H H 784 8.532 8.532 8.054 0.478 19502 2691 1 7 . 1 1 785 785 ALA N N 785 121.847 121.847 120.545 1.302 19502 2692 1 7 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.021 0.021 19502 2693 1 7 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.169 -0.000 19502 2694 1 7 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.250 0.142 19502 2695 1 7 . 1 1 785 785 ALA H H 785 8.402 8.402 8.011 0.391 19502 2696 1 7 . 1 1 786 786 ASP N N 786 120.625 120.625 120.134 0.491 19502 2697 1 7 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.264 -0.112 19502 2698 1 7 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.903 0.268 19502 2699 1 7 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.949 1.567 19502 2700 1 7 . 1 1 786 786 ASP H H 786 8.524 8.524 8.470 0.054 19502 2701 1 7 . 1 1 787 787 ALA N N 787 118.408 118.408 121.665 -3.257 19502 2702 1 7 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.103 -0.127 19502 2703 1 7 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.879 0.237 19502 2704 1 7 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.365 -0.095 19502 2705 1 7 . 1 1 787 787 ALA H H 787 8.191 8.191 8.311 -0.120 19502 2706 1 7 . 1 1 788 788 ALA N N 788 118.510 118.510 122.133 -3.623 19502 2707 1 7 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.054 -0.350 19502 2708 1 7 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.041 -0.148 19502 2709 1 7 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.999 0.574 19502 2710 1 7 . 1 1 788 788 ALA H H 788 7.533 7.533 8.005 -0.472 19502 2711 1 7 . 1 1 789 789 LEU N N 789 117.413 117.413 118.495 -1.082 19502 2712 1 7 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.789 -0.099 19502 2713 1 7 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.576 0.604 19502 2714 1 7 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.264 0.840 19502 2715 1 7 . 1 1 789 789 LEU H H 789 8.520 8.520 8.198 0.322 19502 2716 1 7 . 1 1 790 790 ARG N N 790 116.360 116.360 119.725 -3.365 19502 2717 1 7 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.055 -0.137 19502 2718 1 7 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.566 2.237 19502 2719 1 7 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.046 0.715 19502 2720 1 7 . 1 1 790 790 ARG H H 790 8.293 8.293 8.099 0.194 19502 2721 1 7 . 1 1 791 791 VAL N N 791 120.700 120.700 120.021 0.679 19502 2722 1 7 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.701 0.211 19502 2723 1 7 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.217 0.267 19502 2724 1 7 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.099 0.637 19502 2725 1 7 . 1 1 791 791 VAL H H 791 7.455 7.455 8.026 -0.571 19502 2726 1 7 . 1 1 792 792 LEU N N 792 120.706 120.706 120.013 0.693 19502 2727 1 7 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.863 0.169 19502 2728 1 7 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.194 -0.327 19502 2729 1 7 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.063 1.184 19502 2730 1 7 . 1 1 792 792 LEU H H 792 8.007 8.007 8.043 -0.036 19502 2731 1 7 . 1 1 793 793 ILE N N 793 118.876 118.876 119.203 -0.327 19502 2732 1 7 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.587 0.142 19502 2733 1 7 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.767 -0.766 19502 2734 1 7 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.609 1.346 19502 2735 1 7 . 1 1 793 793 ILE H H 793 8.778 8.778 8.719 0.059 19502 2736 1 7 . 1 1 794 794 GLY N N 794 107.008 107.008 107.175 -0.167 19502 2737 1 7 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.007 -0.374 19502 2738 1 7 . 1 1 794 794 GLY H H 794 7.810 7.810 8.296 -0.486 19502 2739 1 7 . 1 1 795 795 GLU N N 795 119.866 119.866 121.711 -1.845 19502 2740 1 7 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.058 0.298 19502 2741 1 7 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.925 -1.220 19502 2742 1 7 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.494 0.586 19502 2743 1 7 . 1 1 795 795 GLU H H 795 7.978 7.978 8.239 -0.261 19502 2744 1 7 . 1 1 796 796 ASN N N 796 118.365 118.365 118.229 0.136 19502 2745 1 7 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.523 0.259 19502 2746 1 7 . 1 1 796 796 ASN CA C 796 54.582 54.582 56.089 -1.507 19502 2747 1 7 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.559 1.486 19502 2748 1 7 . 1 1 796 796 ASN H H 796 8.053 8.053 8.371 -0.319 19502 2749 1 7 . 1 1 797 797 GLU N N 797 120.368 120.368 118.045 2.323 19502 2750 1 7 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.138 0.198 19502 2751 1 7 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.212 -0.589 19502 2752 1 7 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.475 0.867 19502 2753 1 7 . 1 1 797 797 GLU H H 797 8.225 8.225 7.992 0.233 19502 2754 1 7 . 1 1 798 798 LYS N N 798 120.614 120.614 116.683 3.931 19502 2755 1 7 . 1 1 798 798 LYS H H 798 8.088 8.088 7.489 0.599 19502 2756 1 7 . 1 1 799 799 ALA N N 799 124.642 124.642 122.182 2.460 19502 2757 1 7 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.444 -0.003 19502 2758 1 7 . 1 1 799 799 ALA CA C 799 52.692 52.692 52.890 -0.198 19502 2759 1 7 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.118 -0.501 19502 2760 1 7 . 1 1 799 799 ALA H H 799 8.138 8.138 7.665 0.473 19502 2761 1 7 . 1 1 800 800 GLU N N 800 120.408 120.408 120.393 0.015 19502 2762 1 7 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.133 0.262 19502 2763 1 7 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.886 -0.076 19502 2764 1 7 . 1 1 800 800 GLU CB C 800 30.604 30.604 28.337 2.267 19502 2765 1 7 . 1 1 800 800 GLU H H 800 8.337 8.337 8.205 0.132 19502 2766 1 8 . 1 1 713 713 VAL N N 713 120.649 120.649 120.033 0.616 19502 2767 1 8 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.370 -0.250 19502 2768 1 8 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.678 1.331 19502 2769 1 8 . 1 1 713 713 VAL CB C 713 32.747 32.747 35.433 -2.686 19502 2770 1 8 . 1 1 713 713 VAL H H 713 8.051 8.051 8.204 -0.153 19502 2771 1 8 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.487 -0.006 19502 2772 1 8 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.761 0.994 19502 2773 1 8 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.177 0.838 19502 2774 1 8 . 1 1 716 716 ILE N N 716 121.593 121.593 120.719 0.874 19502 2775 1 8 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.886 0.213 19502 2776 1 8 . 1 1 716 716 ILE CA C 716 62.829 62.829 63.083 -0.254 19502 2777 1 8 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.012 1.154 19502 2778 1 8 . 1 1 716 716 ILE H H 716 8.406 8.406 7.978 0.428 19502 2779 1 8 . 1 1 717 717 GLY N N 717 108.628 108.628 106.636 1.992 19502 2780 1 8 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.842 -0.168 19502 2781 1 8 . 1 1 717 717 GLY H H 717 8.476 8.476 8.722 -0.246 19502 2782 1 8 . 1 1 718 718 GLU N N 718 119.944 119.944 121.092 -1.148 19502 2783 1 8 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.188 0.089 19502 2784 1 8 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.414 -0.227 19502 2785 1 8 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.551 0.486 19502 2786 1 8 . 1 1 718 718 GLU H H 718 8.055 8.055 8.003 0.052 19502 2787 1 8 . 1 1 719 719 LEU N N 719 118.538 118.538 119.824 -1.286 19502 2788 1 8 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.313 0.065 19502 2789 1 8 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.353 -0.011 19502 2790 1 8 . 1 1 719 719 LEU CB C 719 42.040 42.040 41.067 0.973 19502 2791 1 8 . 1 1 719 719 LEU H H 719 8.098 8.098 7.464 0.634 19502 2792 1 8 . 1 1 720 720 VAL N N 720 117.613 117.613 117.718 -0.105 19502 2793 1 8 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.607 0.097 19502 2794 1 8 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.334 -0.715 19502 2795 1 8 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.309 0.615 19502 2796 1 8 . 1 1 720 720 VAL H H 720 7.838 7.838 7.546 0.292 19502 2797 1 8 . 1 1 721 721 ARG N N 721 118.905 118.905 120.138 -1.233 19502 2798 1 8 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.925 0.254 19502 2799 1 8 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.371 -0.951 19502 2800 1 8 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.656 -0.069 19502 2801 1 8 . 1 1 721 721 ARG H H 721 7.614 7.614 7.499 0.115 19502 2802 1 8 . 1 1 722 722 TYR N N 722 117.574 117.574 118.733 -1.159 19502 2803 1 8 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.279 0.070 19502 2804 1 8 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.325 -1.260 19502 2805 1 8 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.282 0.548 19502 2806 1 8 . 1 1 722 722 TYR H H 722 7.885 7.885 7.554 0.331 19502 2807 1 8 . 1 1 723 723 LEU N N 723 120.520 120.520 117.755 2.765 19502 2808 1 8 . 1 1 723 723 LEU HA H 723 3.995 3.995 3.995 0.000 19502 2809 1 8 . 1 1 723 723 LEU CA C 723 57.555 57.555 57.131 0.424 19502 2810 1 8 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.567 0.471 19502 2811 1 8 . 1 1 723 723 LEU H H 723 7.794 7.794 7.415 0.379 19502 2812 1 8 . 1 1 724 724 ASN N N 724 115.161 115.161 115.535 -0.374 19502 2813 1 8 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.616 -0.004 19502 2814 1 8 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.462 -0.225 19502 2815 1 8 . 1 1 724 724 ASN CB C 724 39.277 39.277 38.393 0.884 19502 2816 1 8 . 1 1 724 724 ASN H H 724 8.892 8.892 7.690 1.202 19502 2817 1 8 . 1 1 725 725 THR N N 725 110.273 110.273 114.382 -4.109 19502 2818 1 8 . 1 1 725 725 THR HA H 725 4.527 4.527 4.323 0.204 19502 2819 1 8 . 1 1 725 725 THR CA C 725 62.903 62.903 64.726 -1.823 19502 2820 1 8 . 1 1 725 725 THR CB C 725 70.619 70.619 69.603 1.016 19502 2821 1 8 . 1 1 725 725 THR H H 725 7.874 7.874 7.711 0.163 19502 2822 1 8 . 1 1 726 726 ASN N N 726 117.048 117.048 118.325 -1.277 19502 2823 1 8 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.111 0.028 19502 2824 1 8 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.559 1.279 19502 2825 1 8 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.735 -1.828 19502 2826 1 8 . 1 1 726 726 ASN H H 726 8.613 8.613 7.679 0.934 19502 2827 1 8 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.385 -0.321 19502 2828 1 8 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.256 0.253 19502 2829 1 8 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.375 -0.930 19502 2830 1 8 . 1 1 728 728 VAL N N 728 118.643 118.643 119.147 -0.504 19502 2831 1 8 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.642 -0.242 19502 2832 1 8 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.825 0.741 19502 2833 1 8 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.807 0.619 19502 2834 1 8 . 1 1 728 728 VAL H H 728 8.182 8.182 7.673 0.509 19502 2835 1 8 . 1 1 729 729 GLY N N 729 105.307 105.307 106.804 -1.497 19502 2836 1 8 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.701 0.949 19502 2837 1 8 . 1 1 729 729 GLY H H 729 7.297 7.297 8.472 -1.175 19502 2838 1 8 . 1 1 730 730 GLY N N 730 109.038 109.038 109.748 -0.710 19502 2839 1 8 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.961 0.731 19502 2840 1 8 . 1 1 730 730 GLY H H 730 8.080 8.080 7.490 0.590 19502 2841 1 8 . 1 1 731 731 LEU N N 731 123.822 123.822 123.655 0.167 19502 2842 1 8 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.036 -0.000 19502 2843 1 8 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.374 0.222 19502 2844 1 8 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.551 0.664 19502 2845 1 8 . 1 1 731 731 LEU H H 731 8.287 8.287 8.245 0.042 19502 2846 1 8 . 1 1 732 732 LEU N N 732 118.759 118.759 118.749 0.010 19502 2847 1 8 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.914 0.172 19502 2848 1 8 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.248 0.260 19502 2849 1 8 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.414 -0.431 19502 2850 1 8 . 1 1 732 732 LEU H H 732 8.412 8.412 8.246 0.166 19502 2851 1 8 . 1 1 733 733 GLU N N 733 121.155 121.155 120.198 0.957 19502 2852 1 8 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.956 0.317 19502 2853 1 8 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.129 -0.056 19502 2854 1 8 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.942 0.038 19502 2855 1 8 . 1 1 733 733 GLU H H 733 8.003 8.003 7.960 0.043 19502 2856 1 8 . 1 1 734 734 TYR N N 734 122.518 122.518 121.129 1.389 19502 2857 1 8 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.923 0.258 19502 2858 1 8 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.524 0.435 19502 2859 1 8 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.185 -0.341 19502 2860 1 8 . 1 1 734 734 TYR H H 734 8.419 8.419 8.389 0.030 19502 2861 1 8 . 1 1 735 735 ALA N N 735 122.353 122.353 121.291 1.062 19502 2862 1 8 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.853 -0.041 19502 2863 1 8 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.191 0.981 19502 2864 1 8 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.581 0.253 19502 2865 1 8 . 1 1 735 735 ALA H H 735 8.777 8.777 8.053 0.724 19502 2866 1 8 . 1 1 736 736 ARG N N 736 118.852 118.852 118.063 0.789 19502 2867 1 8 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.063 0.110 19502 2868 1 8 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.755 0.768 19502 2869 1 8 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.852 0.304 19502 2870 1 8 . 1 1 736 736 ARG H H 736 8.570 8.570 8.443 0.127 19502 2871 1 8 . 1 1 737 737 SER N N 737 115.125 115.125 113.483 1.642 19502 2872 1 8 . 1 1 737 737 SER HA H 737 4.149 4.149 4.372 -0.223 19502 2873 1 8 . 1 1 737 737 SER CA C 737 61.300 61.300 60.247 1.053 19502 2874 1 8 . 1 1 737 737 SER CB C 737 63.166 63.166 63.685 -0.519 19502 2875 1 8 . 1 1 737 737 SER H H 737 8.257 8.257 8.361 -0.104 19502 2876 1 8 . 1 1 738 738 HIS N N 738 117.591 117.591 116.559 1.032 19502 2877 1 8 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.448 -0.108 19502 2878 1 8 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.667 0.341 19502 2879 1 8 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.528 -0.998 19502 2880 1 8 . 1 1 738 738 HIS H H 738 7.300 7.300 7.826 -0.526 19502 2881 1 8 . 1 1 739 739 GLY N N 739 107.604 107.604 107.300 0.304 19502 2882 1 8 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.721 1.410 19502 2883 1 8 . 1 1 739 739 GLY H H 739 7.638 7.638 8.199 -0.561 19502 2884 1 8 . 1 1 740 740 PHE N N 740 118.114 118.114 120.052 -1.938 19502 2885 1 8 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.567 0.620 19502 2886 1 8 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.200 -1.797 19502 2887 1 8 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.571 2.411 19502 2888 1 8 . 1 1 740 740 PHE H H 740 8.138 8.138 7.834 0.304 19502 2889 1 8 . 1 1 741 741 ALA N N 741 122.577 122.577 122.674 -0.097 19502 2890 1 8 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.538 0.117 19502 2891 1 8 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.810 0.461 19502 2892 1 8 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.955 0.021 19502 2893 1 8 . 1 1 741 741 ALA H H 741 8.550 8.550 8.766 -0.216 19502 2894 1 8 . 1 1 742 742 ALA N N 742 124.016 124.016 129.269 -5.253 19502 2895 1 8 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.692 0.214 19502 2896 1 8 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.103 -0.074 19502 2897 1 8 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.311 1.048 19502 2898 1 8 . 1 1 742 742 ALA H H 742 8.511 8.511 8.756 -0.245 19502 2899 1 8 . 1 1 743 743 GLU N N 743 120.968 120.968 125.010 -4.042 19502 2900 1 8 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.647 -0.097 19502 2901 1 8 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.759 0.007 19502 2902 1 8 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.420 1.569 19502 2903 1 8 . 1 1 743 743 GLU H H 743 8.628 8.628 8.771 -0.143 19502 2904 1 8 . 1 1 744 744 PHE N N 744 120.078 120.078 125.465 -5.387 19502 2905 1 8 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.090 -0.275 19502 2906 1 8 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.414 -0.243 19502 2907 1 8 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.117 1.258 19502 2908 1 8 . 1 1 744 744 PHE H H 744 8.792 8.792 9.162 -0.371 19502 2909 1 8 . 1 1 745 745 LYS N N 745 124.937 124.937 123.074 1.863 19502 2910 1 8 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.890 -0.297 19502 2911 1 8 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.359 0.711 19502 2912 1 8 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.968 -2.423 19502 2913 1 8 . 1 1 745 745 LYS H H 745 9.180 9.180 8.066 1.114 19502 2914 1 8 . 1 1 746 746 LEU N N 746 129.002 129.002 124.806 4.196 19502 2915 1 8 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.730 0.194 19502 2916 1 8 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.890 -0.192 19502 2917 1 8 . 1 1 746 746 LEU CB C 746 40.579 40.579 42.178 -1.599 19502 2918 1 8 . 1 1 746 746 LEU H H 746 8.687 8.687 8.539 0.148 19502 2919 1 8 . 1 1 747 747 VAL N N 747 131.114 131.114 127.652 3.462 19502 2920 1 8 . 1 1 747 747 VAL HA H 747 3.745 3.745 4.079 -0.334 19502 2921 1 8 . 1 1 747 747 VAL CA C 747 64.134 64.134 63.979 0.155 19502 2922 1 8 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.691 0.280 19502 2923 1 8 . 1 1 747 747 VAL H H 747 9.033 9.033 9.023 0.010 19502 2924 1 8 . 1 1 748 748 ASP N N 748 113.346 113.346 116.854 -3.508 19502 2925 1 8 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.790 -0.006 19502 2926 1 8 . 1 1 748 748 ASP CA C 748 54.334 54.334 54.009 0.325 19502 2927 1 8 . 1 1 748 748 ASP CB C 748 46.191 46.191 44.010 2.181 19502 2928 1 8 . 1 1 748 748 ASP H H 748 7.426 7.426 7.532 -0.106 19502 2929 1 8 . 1 1 749 749 GLN N N 749 120.867 120.867 123.079 -2.212 19502 2930 1 8 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.581 0.489 19502 2931 1 8 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.942 -0.339 19502 2932 1 8 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.156 1.767 19502 2933 1 8 . 1 1 749 749 GLN H H 749 7.647 7.647 8.539 -0.892 19502 2934 1 8 . 1 1 750 750 SER N N 750 119.661 119.661 121.912 -2.251 19502 2935 1 8 . 1 1 750 750 SER HA H 750 4.791 4.791 4.966 -0.175 19502 2936 1 8 . 1 1 750 750 SER CA C 750 57.575 57.575 57.594 -0.019 19502 2937 1 8 . 1 1 750 750 SER CB C 750 65.910 65.910 65.912 -0.002 19502 2938 1 8 . 1 1 750 750 SER H H 750 8.891 8.891 8.208 0.683 19502 2939 1 8 . 1 1 751 751 GLY N N 751 106.531 106.531 107.385 -0.854 19502 2940 1 8 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.242 -0.028 19502 2941 1 8 . 1 1 751 751 GLY H H 751 8.183 8.183 8.051 0.132 19502 2942 1 8 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.703 0.145 19502 2943 1 8 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.313 0.225 19502 2944 1 8 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.969 -0.071 19502 2945 1 8 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.280 -0.054 19502 2946 1 8 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.789 0.556 19502 2947 1 8 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.613 0.294 19502 2948 1 8 . 1 1 754 754 HIS N N 754 109.780 109.780 114.942 -5.162 19502 2949 1 8 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.650 0.108 19502 2950 1 8 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.921 -0.692 19502 2951 1 8 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.194 0.300 19502 2952 1 8 . 1 1 754 754 HIS H H 754 7.707 7.707 8.127 -0.420 19502 2953 1 8 . 1 1 755 755 GLU N N 755 122.843 122.843 120.464 2.379 19502 2954 1 8 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.755 -0.143 19502 2955 1 8 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.059 1.589 19502 2956 1 8 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.787 0.026 19502 2957 1 8 . 1 1 755 755 GLU H H 755 7.404 7.404 7.633 -0.229 19502 2958 1 8 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.204 0.413 19502 2959 1 8 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.857 0.259 19502 2960 1 8 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.494 1.757 19502 2961 1 8 . 1 1 757 757 LYS N N 757 119.032 119.032 125.640 -6.608 19502 2962 1 8 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.812 -0.208 19502 2963 1 8 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.440 0.204 19502 2964 1 8 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.327 1.869 19502 2965 1 8 . 1 1 757 757 LYS H H 757 8.195 8.195 8.594 -0.399 19502 2966 1 8 . 1 1 758 758 PHE N N 758 120.288 120.288 125.195 -4.907 19502 2967 1 8 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.670 0.370 19502 2968 1 8 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.667 -0.851 19502 2969 1 8 . 1 1 758 758 PHE CB C 758 43.300 43.300 39.718 3.582 19502 2970 1 8 . 1 1 758 758 PHE H H 758 8.844 8.844 9.366 -0.522 19502 2971 1 8 . 1 1 759 759 VAL N N 759 121.385 121.385 125.388 -4.003 19502 2972 1 8 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.422 0.970 19502 2973 1 8 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.633 -1.983 19502 2974 1 8 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.854 2.384 19502 2975 1 8 . 1 1 759 759 VAL H H 759 8.609 8.609 9.141 -0.532 19502 2976 1 8 . 1 1 760 760 TYR N N 760 126.374 126.374 128.803 -2.429 19502 2977 1 8 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.175 0.622 19502 2978 1 8 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.167 -0.247 19502 2979 1 8 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.592 4.261 19502 2980 1 8 . 1 1 760 760 TYR H H 760 8.903 8.903 9.340 -0.437 19502 2981 1 8 . 1 1 761 761 GLN N N 761 115.228 115.228 121.901 -6.673 19502 2982 1 8 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.597 -0.773 19502 2983 1 8 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.780 1.746 19502 2984 1 8 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.944 -0.626 19502 2985 1 8 . 1 1 761 761 GLN H H 761 9.016 9.016 8.405 0.611 19502 2986 1 8 . 1 1 762 762 ALA N N 762 128.023 128.023 129.230 -1.207 19502 2987 1 8 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.415 0.766 19502 2988 1 8 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.653 0.222 19502 2989 1 8 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.467 0.684 19502 2990 1 8 . 1 1 762 762 ALA H H 762 9.500 9.500 8.576 0.924 19502 2991 1 8 . 1 1 763 763 LYS N N 763 122.022 122.022 127.339 -5.317 19502 2992 1 8 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.435 0.429 19502 2993 1 8 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.752 0.393 19502 2994 1 8 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.143 3.313 19502 2995 1 8 . 1 1 763 763 LYS H H 763 8.347 8.347 8.704 -0.357 19502 2996 1 8 . 1 1 764 764 VAL N N 764 123.980 123.980 127.627 -3.647 19502 2997 1 8 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.482 0.145 19502 2998 1 8 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.836 0.130 19502 2999 1 8 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.330 3.490 19502 3000 1 8 . 1 1 764 764 VAL H H 764 8.703 8.703 8.659 0.044 19502 3001 1 8 . 1 1 765 765 GLY N N 765 119.292 119.292 117.592 1.700 19502 3002 1 8 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.087 0.535 19502 3003 1 8 . 1 1 765 765 GLY H H 765 9.151 9.151 9.288 -0.137 19502 3004 1 8 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.519 0.671 19502 3005 1 8 . 1 1 767 767 ARG N N 767 119.571 119.571 121.625 -2.054 19502 3006 1 8 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.648 -0.255 19502 3007 1 8 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.422 0.927 19502 3008 1 8 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.757 0.562 19502 3009 1 8 . 1 1 767 767 ARG H H 767 7.595 7.595 7.341 0.254 19502 3010 1 8 . 1 1 768 768 TRP N N 768 122.976 122.976 127.681 -4.705 19502 3011 1 8 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.033 -0.463 19502 3012 1 8 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.035 0.431 19502 3013 1 8 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.259 0.959 19502 3014 1 8 . 1 1 768 768 TRP H H 768 8.056 8.056 8.921 -0.865 19502 3015 1 8 . 1 1 769 769 PHE N N 769 116.997 116.997 122.892 -5.895 19502 3016 1 8 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.821 -0.071 19502 3017 1 8 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.454 2.275 19502 3018 1 8 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.274 -0.977 19502 3019 1 8 . 1 1 769 769 PHE H H 769 7.532 7.532 8.707 -1.175 19502 3020 1 8 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.723 0.001 19502 3021 1 8 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.844 2.455 19502 3022 1 8 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.702 0.073 19502 3023 1 8 . 1 1 771 771 ALA N N 771 125.979 125.979 121.987 3.992 19502 3024 1 8 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.242 -0.008 19502 3025 1 8 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.813 -0.171 19502 3026 1 8 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.944 -0.289 19502 3027 1 8 . 1 1 771 771 ALA H H 771 9.069 9.069 8.108 0.961 19502 3028 1 8 . 1 1 772 772 VAL N N 772 113.901 113.901 119.356 -5.455 19502 3029 1 8 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.955 -0.144 19502 3030 1 8 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.837 -0.689 19502 3031 1 8 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.130 0.116 19502 3032 1 8 . 1 1 772 772 VAL H H 772 9.024 9.024 9.061 -0.037 19502 3033 1 8 . 1 1 773 773 CYS N N 773 119.222 119.222 118.151 1.071 19502 3034 1 8 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.982 -0.375 19502 3035 1 8 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.778 0.980 19502 3036 1 8 . 1 1 773 773 CYS CB C 773 29.841 29.841 31.201 -1.360 19502 3037 1 8 . 1 1 773 773 CYS H H 773 8.597 8.597 8.399 0.198 19502 3038 1 8 . 1 1 774 774 ALA N N 774 124.328 124.328 125.170 -0.842 19502 3039 1 8 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.765 0.038 19502 3040 1 8 . 1 1 774 774 ALA CA C 774 51.231 51.231 51.246 -0.015 19502 3041 1 8 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.702 2.423 19502 3042 1 8 . 1 1 774 774 ALA H H 774 9.238 9.238 8.219 1.019 19502 3043 1 8 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.632 0.624 19502 3044 1 8 . 1 1 775 775 HIS CA C 775 56.529 56.529 56.586 -0.057 19502 3045 1 8 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.748 0.385 19502 3046 1 8 . 1 1 776 776 SER N N 776 110.366 110.366 114.140 -3.774 19502 3047 1 8 . 1 1 776 776 SER HA H 776 4.766 4.766 4.599 0.167 19502 3048 1 8 . 1 1 776 776 SER CA C 776 57.029 57.029 56.383 0.646 19502 3049 1 8 . 1 1 776 776 SER H H 776 7.550 7.550 7.415 0.135 19502 3050 1 8 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.506 0.081 19502 3051 1 8 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.754 0.682 19502 3052 1 8 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.877 0.327 19502 3053 1 8 . 1 1 778 778 LYS N N 778 118.469 118.469 118.871 -0.402 19502 3054 1 8 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.814 -0.050 19502 3055 1 8 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.135 0.776 19502 3056 1 8 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.888 1.797 19502 3057 1 8 . 1 1 778 778 LYS H H 778 8.151 8.151 8.159 -0.008 19502 3058 1 8 . 1 1 779 779 GLN N N 779 117.975 117.975 117.318 0.657 19502 3059 1 8 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.949 0.064 19502 3060 1 8 . 1 1 779 779 GLN CA C 779 57.909 57.909 59.055 -1.146 19502 3061 1 8 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.259 0.301 19502 3062 1 8 . 1 1 779 779 GLN H H 779 7.773 7.773 8.370 -0.597 19502 3063 1 8 . 1 1 780 780 GLY N N 780 108.214 108.214 107.687 0.527 19502 3064 1 8 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.984 1.027 19502 3065 1 8 . 1 1 780 780 GLY H H 780 8.273 8.273 8.257 0.016 19502 3066 1 8 . 1 1 781 781 LYS N N 781 120.027 120.027 121.980 -1.953 19502 3067 1 8 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.807 -0.718 19502 3068 1 8 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.515 0.843 19502 3069 1 8 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.776 -0.090 19502 3070 1 8 . 1 1 781 781 LYS H H 781 7.307 7.307 7.231 0.076 19502 3071 1 8 . 1 1 782 782 GLN N N 782 117.131 117.131 119.166 -2.035 19502 3072 1 8 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.833 -0.065 19502 3073 1 8 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.478 0.316 19502 3074 1 8 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.666 -0.113 19502 3075 1 8 . 1 1 782 782 GLN H H 782 7.227 7.227 8.389 -1.162 19502 3076 1 8 . 1 1 783 783 GLU N N 783 117.958 117.958 118.921 -0.963 19502 3077 1 8 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.072 0.131 19502 3078 1 8 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.772 0.192 19502 3079 1 8 . 1 1 783 783 GLU CB C 783 28.959 28.959 28.997 -0.038 19502 3080 1 8 . 1 1 783 783 GLU H H 783 8.896 8.896 8.512 0.384 19502 3081 1 8 . 1 1 784 784 ALA N N 784 124.176 124.176 123.089 1.087 19502 3082 1 8 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.015 0.119 19502 3083 1 8 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.462 -0.247 19502 3084 1 8 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.375 -0.778 19502 3085 1 8 . 1 1 784 784 ALA H H 784 8.532 8.532 8.126 0.406 19502 3086 1 8 . 1 1 785 785 ALA N N 785 121.847 121.847 120.749 1.098 19502 3087 1 8 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.961 0.081 19502 3088 1 8 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.112 0.057 19502 3089 1 8 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.551 -0.158 19502 3090 1 8 . 1 1 785 785 ALA H H 785 8.402 8.402 8.265 0.137 19502 3091 1 8 . 1 1 786 786 ASP N N 786 120.625 120.625 120.279 0.346 19502 3092 1 8 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.198 -0.046 19502 3093 1 8 . 1 1 786 786 ASP CA C 786 58.171 58.171 58.000 0.171 19502 3094 1 8 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.740 1.776 19502 3095 1 8 . 1 1 786 786 ASP H H 786 8.524 8.524 8.631 -0.107 19502 3096 1 8 . 1 1 787 787 ALA N N 787 118.408 118.408 121.008 -2.600 19502 3097 1 8 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.116 -0.140 19502 3098 1 8 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.965 0.151 19502 3099 1 8 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.379 -0.109 19502 3100 1 8 . 1 1 787 787 ALA H H 787 8.191 8.191 8.095 0.096 19502 3101 1 8 . 1 1 788 788 ALA N N 788 118.510 118.510 121.908 -3.398 19502 3102 1 8 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.023 -0.319 19502 3103 1 8 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.970 -0.077 19502 3104 1 8 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.941 0.632 19502 3105 1 8 . 1 1 788 788 ALA H H 788 7.533 7.533 7.968 -0.435 19502 3106 1 8 . 1 1 789 789 LEU N N 789 117.413 117.413 118.558 -1.145 19502 3107 1 8 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.705 -0.015 19502 3108 1 8 . 1 1 789 789 LEU CA C 789 58.180 58.180 58.155 0.025 19502 3109 1 8 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.344 0.760 19502 3110 1 8 . 1 1 789 789 LEU H H 789 8.520 8.520 8.390 0.130 19502 3111 1 8 . 1 1 790 790 ARG N N 790 116.360 116.360 118.186 -1.826 19502 3112 1 8 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.973 -0.055 19502 3113 1 8 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.634 1.169 19502 3114 1 8 . 1 1 790 790 ARG CB C 790 29.761 29.761 30.049 -0.288 19502 3115 1 8 . 1 1 790 790 ARG H H 790 8.293 8.293 7.644 0.649 19502 3116 1 8 . 1 1 791 791 VAL N N 791 120.700 120.700 120.955 -0.255 19502 3117 1 8 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.624 0.288 19502 3118 1 8 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.561 -0.077 19502 3119 1 8 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.650 0.086 19502 3120 1 8 . 1 1 791 791 VAL H H 791 7.455 7.455 7.990 -0.535 19502 3121 1 8 . 1 1 792 792 LEU N N 792 120.706 120.706 119.843 0.863 19502 3122 1 8 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.918 0.114 19502 3123 1 8 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.800 0.067 19502 3124 1 8 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.134 1.113 19502 3125 1 8 . 1 1 792 792 LEU H H 792 8.007 8.007 7.592 0.415 19502 3126 1 8 . 1 1 793 793 ILE N N 793 118.876 118.876 119.640 -0.764 19502 3127 1 8 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.555 0.174 19502 3128 1 8 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.956 -0.955 19502 3129 1 8 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.571 1.384 19502 3130 1 8 . 1 1 793 793 ILE H H 793 8.778 8.778 8.776 0.002 19502 3131 1 8 . 1 1 794 794 GLY N N 794 107.008 107.008 106.830 0.178 19502 3132 1 8 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.110 -0.477 19502 3133 1 8 . 1 1 794 794 GLY H H 794 7.810 7.810 8.337 -0.527 19502 3134 1 8 . 1 1 795 795 GLU N N 795 119.866 119.866 121.880 -2.014 19502 3135 1 8 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.057 0.299 19502 3136 1 8 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.200 -1.496 19502 3137 1 8 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.430 0.650 19502 3138 1 8 . 1 1 795 795 GLU H H 795 7.978 7.978 8.062 -0.084 19502 3139 1 8 . 1 1 796 796 ASN N N 796 118.365 118.365 117.480 0.885 19502 3140 1 8 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.647 0.135 19502 3141 1 8 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.945 -1.363 19502 3142 1 8 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.156 0.889 19502 3143 1 8 . 1 1 796 796 ASN H H 796 8.053 8.053 7.849 0.204 19502 3144 1 8 . 1 1 797 797 GLU N N 797 120.368 120.368 118.563 1.805 19502 3145 1 8 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.169 0.167 19502 3146 1 8 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.201 -0.577 19502 3147 1 8 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.634 0.708 19502 3148 1 8 . 1 1 797 797 GLU H H 797 8.225 8.225 8.187 0.038 19502 3149 1 8 . 1 1 798 798 LYS N N 798 120.614 120.614 116.605 4.009 19502 3150 1 8 . 1 1 798 798 LYS H H 798 8.088 8.088 7.615 0.473 19502 3151 1 8 . 1 1 799 799 ALA N N 799 124.642 124.642 122.617 2.025 19502 3152 1 8 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.537 -0.096 19502 3153 1 8 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.031 1.661 19502 3154 1 8 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.080 -0.463 19502 3155 1 8 . 1 1 799 799 ALA H H 799 8.138 8.138 7.417 0.721 19502 3156 1 8 . 1 1 800 800 GLU N N 800 120.408 120.408 119.759 0.649 19502 3157 1 8 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.321 0.074 19502 3158 1 8 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.495 0.315 19502 3159 1 8 . 1 1 800 800 GLU CB C 800 30.604 30.604 28.784 1.820 19502 3160 1 8 . 1 1 800 800 GLU H H 800 8.337 8.337 8.620 -0.283 19502 3161 1 9 . 1 1 713 713 VAL N N 713 120.649 120.649 119.899 0.750 19502 3162 1 9 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.105 0.015 19502 3163 1 9 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.955 1.054 19502 3164 1 9 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.730 0.017 19502 3165 1 9 . 1 1 713 713 VAL H H 713 8.051 8.051 8.199 -0.148 19502 3166 1 9 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.613 -0.132 19502 3167 1 9 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.193 1.561 19502 3168 1 9 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.742 0.273 19502 3169 1 9 . 1 1 716 716 ILE N N 716 121.593 121.593 119.652 1.941 19502 3170 1 9 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.947 0.152 19502 3171 1 9 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.702 0.127 19502 3172 1 9 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.189 0.977 19502 3173 1 9 . 1 1 716 716 ILE H H 716 8.406 8.406 8.252 0.154 19502 3174 1 9 . 1 1 717 717 GLY N N 717 108.628 108.628 107.631 0.997 19502 3175 1 9 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.175 -0.501 19502 3176 1 9 . 1 1 717 717 GLY H H 717 8.476 8.476 8.722 -0.246 19502 3177 1 9 . 1 1 718 718 GLU N N 718 119.944 119.944 121.771 -1.827 19502 3178 1 9 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.155 0.122 19502 3179 1 9 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.705 -0.518 19502 3180 1 9 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.168 0.869 19502 3181 1 9 . 1 1 718 718 GLU H H 718 8.055 8.055 7.863 0.192 19502 3182 1 9 . 1 1 719 719 LEU N N 719 118.538 118.538 119.686 -1.148 19502 3183 1 9 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.384 -0.006 19502 3184 1 9 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.070 0.272 19502 3185 1 9 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.756 1.284 19502 3186 1 9 . 1 1 719 719 LEU H H 719 8.098 8.098 7.536 0.562 19502 3187 1 9 . 1 1 720 720 VAL N N 720 117.613 117.613 118.937 -1.324 19502 3188 1 9 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.646 0.058 19502 3189 1 9 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.789 -1.170 19502 3190 1 9 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.234 0.690 19502 3191 1 9 . 1 1 720 720 VAL H H 720 7.838 7.838 8.237 -0.399 19502 3192 1 9 . 1 1 721 721 ARG N N 721 118.905 118.905 120.162 -1.257 19502 3193 1 9 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.934 0.245 19502 3194 1 9 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.432 -1.012 19502 3195 1 9 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.661 -0.074 19502 3196 1 9 . 1 1 721 721 ARG H H 721 7.614 7.614 7.587 0.027 19502 3197 1 9 . 1 1 722 722 TYR N N 722 117.574 117.574 117.506 0.068 19502 3198 1 9 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.342 0.007 19502 3199 1 9 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.036 -0.971 19502 3200 1 9 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.260 0.571 19502 3201 1 9 . 1 1 722 722 TYR H H 722 7.885 7.885 7.743 0.142 19502 3202 1 9 . 1 1 723 723 LEU N N 723 120.520 120.520 117.685 2.835 19502 3203 1 9 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.087 -0.092 19502 3204 1 9 . 1 1 723 723 LEU CA C 723 57.555 57.555 57.038 0.518 19502 3205 1 9 . 1 1 723 723 LEU CB C 723 42.038 42.038 42.154 -0.116 19502 3206 1 9 . 1 1 723 723 LEU H H 723 7.794 7.794 7.616 0.178 19502 3207 1 9 . 1 1 724 724 ASN N N 724 115.161 115.161 114.929 0.232 19502 3208 1 9 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.721 -0.109 19502 3209 1 9 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.111 0.126 19502 3210 1 9 . 1 1 724 724 ASN CB C 724 39.277 39.277 38.990 0.287 19502 3211 1 9 . 1 1 724 724 ASN H H 724 8.892 8.892 7.848 1.044 19502 3212 1 9 . 1 1 725 725 THR N N 725 110.273 110.273 114.510 -4.237 19502 3213 1 9 . 1 1 725 725 THR HA H 725 4.527 4.527 4.352 0.175 19502 3214 1 9 . 1 1 725 725 THR CA C 725 62.903 62.903 63.640 -0.737 19502 3215 1 9 . 1 1 725 725 THR CB C 725 70.619 70.619 69.910 0.709 19502 3216 1 9 . 1 1 725 725 THR H H 725 7.874 7.874 7.599 0.275 19502 3217 1 9 . 1 1 726 726 ASN N N 726 117.048 117.048 118.812 -1.764 19502 3218 1 9 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.110 0.029 19502 3219 1 9 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.424 1.414 19502 3220 1 9 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.839 -1.932 19502 3221 1 9 . 1 1 726 726 ASN H H 726 8.613 8.613 8.072 0.541 19502 3222 1 9 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.334 -0.270 19502 3223 1 9 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.233 0.276 19502 3224 1 9 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.345 -0.900 19502 3225 1 9 . 1 1 728 728 VAL N N 728 118.643 118.643 118.998 -0.355 19502 3226 1 9 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.680 -0.280 19502 3227 1 9 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.453 1.113 19502 3228 1 9 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.616 0.810 19502 3229 1 9 . 1 1 728 728 VAL H H 728 8.182 8.182 7.639 0.543 19502 3230 1 9 . 1 1 729 729 GLY N N 729 105.307 105.307 107.176 -1.869 19502 3231 1 9 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.682 0.968 19502 3232 1 9 . 1 1 729 729 GLY H H 729 7.297 7.297 8.491 -1.194 19502 3233 1 9 . 1 1 730 730 GLY N N 730 109.038 109.038 109.635 -0.597 19502 3234 1 9 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.795 0.897 19502 3235 1 9 . 1 1 730 730 GLY H H 730 8.080 8.080 7.341 0.739 19502 3236 1 9 . 1 1 731 731 LEU N N 731 123.822 123.822 123.704 0.118 19502 3237 1 9 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.044 -0.008 19502 3238 1 9 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.458 0.138 19502 3239 1 9 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.528 0.687 19502 3240 1 9 . 1 1 731 731 LEU H H 731 8.287 8.287 8.292 -0.005 19502 3241 1 9 . 1 1 732 732 LEU N N 732 118.759 118.759 118.664 0.095 19502 3242 1 9 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.909 0.177 19502 3243 1 9 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.255 0.253 19502 3244 1 9 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.460 -0.477 19502 3245 1 9 . 1 1 732 732 LEU H H 732 8.412 8.412 7.990 0.422 19502 3246 1 9 . 1 1 733 733 GLU N N 733 121.155 121.155 120.034 1.121 19502 3247 1 9 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.978 0.295 19502 3248 1 9 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.105 -0.032 19502 3249 1 9 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.966 0.014 19502 3250 1 9 . 1 1 733 733 GLU H H 733 8.003 8.003 7.954 0.049 19502 3251 1 9 . 1 1 734 734 TYR N N 734 122.518 122.518 121.800 0.718 19502 3252 1 9 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.996 0.185 19502 3253 1 9 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.552 0.407 19502 3254 1 9 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.139 -0.295 19502 3255 1 9 . 1 1 734 734 TYR H H 734 8.419 8.419 8.512 -0.093 19502 3256 1 9 . 1 1 735 735 ALA N N 735 122.353 122.353 120.814 1.539 19502 3257 1 9 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.689 0.123 19502 3258 1 9 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.055 1.117 19502 3259 1 9 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.311 0.522 19502 3260 1 9 . 1 1 735 735 ALA H H 735 8.777 8.777 7.862 0.915 19502 3261 1 9 . 1 1 736 736 ARG N N 736 118.852 118.852 119.178 -0.326 19502 3262 1 9 . 1 1 736 736 ARG HA H 736 4.173 4.173 3.962 0.211 19502 3263 1 9 . 1 1 736 736 ARG CA C 736 59.523 59.523 59.318 0.205 19502 3264 1 9 . 1 1 736 736 ARG CB C 736 30.156 30.156 30.198 -0.042 19502 3265 1 9 . 1 1 736 736 ARG H H 736 8.570 8.570 8.581 -0.011 19502 3266 1 9 . 1 1 737 737 SER N N 737 115.125 115.125 111.566 3.559 19502 3267 1 9 . 1 1 737 737 SER HA H 737 4.149 4.149 4.348 -0.199 19502 3268 1 9 . 1 1 737 737 SER CA C 737 61.300 61.300 60.513 0.787 19502 3269 1 9 . 1 1 737 737 SER CB C 737 63.166 63.166 63.431 -0.265 19502 3270 1 9 . 1 1 737 737 SER H H 737 8.257 8.257 8.343 -0.086 19502 3271 1 9 . 1 1 738 738 HIS N N 738 117.591 117.591 117.154 0.437 19502 3272 1 9 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.571 -0.231 19502 3273 1 9 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.261 0.747 19502 3274 1 9 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.051 -0.521 19502 3275 1 9 . 1 1 738 738 HIS H H 738 7.300 7.300 7.629 -0.329 19502 3276 1 9 . 1 1 739 739 GLY N N 739 107.604 107.604 107.365 0.239 19502 3277 1 9 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.788 1.343 19502 3278 1 9 . 1 1 739 739 GLY H H 739 7.638 7.638 8.214 -0.576 19502 3279 1 9 . 1 1 740 740 PHE N N 740 118.114 118.114 119.514 -1.400 19502 3280 1 9 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.671 0.516 19502 3281 1 9 . 1 1 740 740 PHE CA C 740 54.403 54.403 55.916 -1.513 19502 3282 1 9 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.814 2.168 19502 3283 1 9 . 1 1 740 740 PHE H H 740 8.138 8.138 7.840 0.298 19502 3284 1 9 . 1 1 741 741 ALA N N 741 122.577 122.577 121.923 0.654 19502 3285 1 9 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.549 0.106 19502 3286 1 9 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.808 0.463 19502 3287 1 9 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.591 -0.615 19502 3288 1 9 . 1 1 741 741 ALA H H 741 8.550 8.550 8.588 -0.038 19502 3289 1 9 . 1 1 742 742 ALA N N 742 124.016 124.016 128.364 -4.348 19502 3290 1 9 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.727 0.179 19502 3291 1 9 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.925 0.104 19502 3292 1 9 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.338 1.022 19502 3293 1 9 . 1 1 742 742 ALA H H 742 8.511 8.511 8.699 -0.188 19502 3294 1 9 . 1 1 743 743 GLU N N 743 120.968 120.968 125.158 -4.190 19502 3295 1 9 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.671 -0.121 19502 3296 1 9 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.663 0.103 19502 3297 1 9 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.037 1.952 19502 3298 1 9 . 1 1 743 743 GLU H H 743 8.628 8.628 8.784 -0.156 19502 3299 1 9 . 1 1 744 744 PHE N N 744 120.078 120.078 125.082 -5.004 19502 3300 1 9 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.837 -0.022 19502 3301 1 9 . 1 1 744 744 PHE CA C 744 57.171 57.171 58.063 -0.892 19502 3302 1 9 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.903 0.472 19502 3303 1 9 . 1 1 744 744 PHE H H 744 8.792 8.792 9.055 -0.263 19502 3304 1 9 . 1 1 745 745 LYS N N 745 124.937 124.937 124.487 0.450 19502 3305 1 9 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.819 -0.226 19502 3306 1 9 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.347 0.723 19502 3307 1 9 . 1 1 745 745 LYS CB C 745 33.545 33.545 36.125 -2.580 19502 3308 1 9 . 1 1 745 745 LYS H H 745 9.180 9.180 8.425 0.755 19502 3309 1 9 . 1 1 746 746 LEU N N 746 129.002 129.002 125.852 3.150 19502 3310 1 9 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.587 0.337 19502 3311 1 9 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.571 0.127 19502 3312 1 9 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.817 -1.238 19502 3313 1 9 . 1 1 746 746 LEU H H 746 8.687 8.687 8.629 0.058 19502 3314 1 9 . 1 1 747 747 VAL N N 747 131.114 131.114 126.163 4.951 19502 3315 1 9 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.991 -0.246 19502 3316 1 9 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.008 0.126 19502 3317 1 9 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.389 0.582 19502 3318 1 9 . 1 1 747 747 VAL H H 747 9.033 9.033 8.766 0.267 19502 3319 1 9 . 1 1 748 748 ASP N N 748 113.346 113.346 119.287 -5.941 19502 3320 1 9 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.802 -0.018 19502 3321 1 9 . 1 1 748 748 ASP CA C 748 54.334 54.334 52.999 1.335 19502 3322 1 9 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.996 2.195 19502 3323 1 9 . 1 1 748 748 ASP H H 748 7.426 7.426 7.664 -0.238 19502 3324 1 9 . 1 1 749 749 GLN N N 749 120.867 120.867 123.549 -2.682 19502 3325 1 9 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.042 0.028 19502 3326 1 9 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.031 -0.428 19502 3327 1 9 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.495 1.428 19502 3328 1 9 . 1 1 749 749 GLN H H 749 7.647 7.647 8.648 -1.001 19502 3329 1 9 . 1 1 750 750 SER N N 750 119.661 119.661 121.340 -1.679 19502 3330 1 9 . 1 1 750 750 SER HA H 750 4.791 4.791 4.983 -0.192 19502 3331 1 9 . 1 1 750 750 SER CA C 750 57.575 57.575 57.548 0.027 19502 3332 1 9 . 1 1 750 750 SER CB C 750 65.910 65.910 64.868 1.042 19502 3333 1 9 . 1 1 750 750 SER H H 750 8.891 8.891 8.605 0.286 19502 3334 1 9 . 1 1 751 751 GLY N N 751 106.531 106.531 108.339 -1.808 19502 3335 1 9 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.323 -0.109 19502 3336 1 9 . 1 1 751 751 GLY H H 751 8.183 8.183 8.076 0.107 19502 3337 1 9 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.674 0.174 19502 3338 1 9 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.218 0.320 19502 3339 1 9 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.928 -0.030 19502 3340 1 9 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.287 -0.061 19502 3341 1 9 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.511 0.834 19502 3342 1 9 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.586 0.321 19502 3343 1 9 . 1 1 754 754 HIS N N 754 109.780 109.780 115.173 -5.393 19502 3344 1 9 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.570 0.188 19502 3345 1 9 . 1 1 754 754 HIS CA C 754 56.229 56.229 57.201 -0.972 19502 3346 1 9 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.695 0.799 19502 3347 1 9 . 1 1 754 754 HIS H H 754 7.707 7.707 8.044 -0.337 19502 3348 1 9 . 1 1 755 755 GLU N N 755 122.843 122.843 120.795 2.048 19502 3349 1 9 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.773 -0.161 19502 3350 1 9 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.129 1.520 19502 3351 1 9 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.494 0.319 19502 3352 1 9 . 1 1 755 755 GLU H H 755 7.404 7.404 7.872 -0.468 19502 3353 1 9 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.187 0.430 19502 3354 1 9 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.710 0.406 19502 3355 1 9 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.870 1.381 19502 3356 1 9 . 1 1 757 757 LYS N N 757 119.032 119.032 126.441 -7.409 19502 3357 1 9 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.719 -0.115 19502 3358 1 9 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.889 0.755 19502 3359 1 9 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.357 1.839 19502 3360 1 9 . 1 1 757 757 LYS H H 757 8.195 8.195 8.769 -0.574 19502 3361 1 9 . 1 1 758 758 PHE N N 758 120.288 120.288 127.100 -6.812 19502 3362 1 9 . 1 1 758 758 PHE HA H 758 5.040 5.040 5.135 -0.095 19502 3363 1 9 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.607 0.209 19502 3364 1 9 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.649 2.651 19502 3365 1 9 . 1 1 758 758 PHE H H 758 8.844 8.844 9.474 -0.630 19502 3366 1 9 . 1 1 759 759 VAL N N 759 121.385 121.385 124.333 -2.948 19502 3367 1 9 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.774 0.618 19502 3368 1 9 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.285 -0.635 19502 3369 1 9 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.399 1.839 19502 3370 1 9 . 1 1 759 759 VAL H H 759 8.609 8.609 9.211 -0.602 19502 3371 1 9 . 1 1 760 760 TYR N N 760 126.374 126.374 128.564 -2.190 19502 3372 1 9 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.233 0.564 19502 3373 1 9 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.153 -0.233 19502 3374 1 9 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.226 4.627 19502 3375 1 9 . 1 1 760 760 TYR H H 760 8.903 8.903 9.141 -0.238 19502 3376 1 9 . 1 1 761 761 GLN N N 761 115.228 115.228 122.864 -7.636 19502 3377 1 9 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.738 -0.914 19502 3378 1 9 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.605 1.921 19502 3379 1 9 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.916 -0.598 19502 3380 1 9 . 1 1 761 761 GLN H H 761 9.016 9.016 8.355 0.661 19502 3381 1 9 . 1 1 762 762 ALA N N 762 128.023 128.023 129.296 -1.273 19502 3382 1 9 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.546 0.635 19502 3383 1 9 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.460 0.415 19502 3384 1 9 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.749 0.402 19502 3385 1 9 . 1 1 762 762 ALA H H 762 9.500 9.500 8.466 1.034 19502 3386 1 9 . 1 1 763 763 LYS N N 763 122.022 122.022 127.316 -5.294 19502 3387 1 9 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.391 0.472 19502 3388 1 9 . 1 1 763 763 LYS CA C 763 55.145 55.145 55.062 0.083 19502 3389 1 9 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.054 3.402 19502 3390 1 9 . 1 1 763 763 LYS H H 763 8.347 8.347 8.847 -0.500 19502 3391 1 9 . 1 1 764 764 VAL N N 764 123.980 123.980 128.037 -4.057 19502 3392 1 9 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.890 -0.263 19502 3393 1 9 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.872 0.094 19502 3394 1 9 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.000 3.820 19502 3395 1 9 . 1 1 764 764 VAL H H 764 8.703 8.703 8.459 0.244 19502 3396 1 9 . 1 1 765 765 GLY N N 765 119.292 119.292 118.379 0.913 19502 3397 1 9 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.441 0.182 19502 3398 1 9 . 1 1 765 765 GLY H H 765 9.151 9.151 8.900 0.251 19502 3399 1 9 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.305 0.885 19502 3400 1 9 . 1 1 767 767 ARG N N 767 119.571 119.571 122.182 -2.611 19502 3401 1 9 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.694 -0.301 19502 3402 1 9 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.768 1.581 19502 3403 1 9 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.734 0.585 19502 3404 1 9 . 1 1 767 767 ARG H H 767 7.595 7.595 7.542 0.053 19502 3405 1 9 . 1 1 768 768 TRP N N 768 122.976 122.976 127.481 -4.505 19502 3406 1 9 . 1 1 768 768 TRP HA H 768 4.570 4.570 4.945 -0.375 19502 3407 1 9 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.357 0.109 19502 3408 1 9 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.328 0.890 19502 3409 1 9 . 1 1 768 768 TRP H H 768 8.056 8.056 8.834 -0.778 19502 3410 1 9 . 1 1 769 769 PHE N N 769 116.997 116.997 123.234 -6.237 19502 3411 1 9 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.806 -0.056 19502 3412 1 9 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.473 2.256 19502 3413 1 9 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.088 -0.791 19502 3414 1 9 . 1 1 769 769 PHE H H 769 7.532 7.532 8.816 -1.284 19502 3415 1 9 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.741 -0.017 19502 3416 1 9 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.738 2.561 19502 3417 1 9 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.781 -0.006 19502 3418 1 9 . 1 1 771 771 ALA N N 771 125.979 125.979 122.419 3.560 19502 3419 1 9 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.107 0.127 19502 3420 1 9 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.614 0.028 19502 3421 1 9 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.608 0.047 19502 3422 1 9 . 1 1 771 771 ALA H H 771 9.069 9.069 8.149 0.920 19502 3423 1 9 . 1 1 772 772 VAL N N 772 113.901 113.901 119.847 -5.946 19502 3424 1 9 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.851 -0.040 19502 3425 1 9 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.364 -0.215 19502 3426 1 9 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.958 0.288 19502 3427 1 9 . 1 1 772 772 VAL H H 772 9.024 9.024 9.061 -0.037 19502 3428 1 9 . 1 1 773 773 CYS N N 773 119.222 119.222 117.486 1.736 19502 3429 1 9 . 1 1 773 773 CYS HA H 773 5.607 5.607 6.036 -0.429 19502 3430 1 9 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.016 0.742 19502 3431 1 9 . 1 1 773 773 CYS CB C 773 29.841 29.841 31.832 -1.991 19502 3432 1 9 . 1 1 773 773 CYS H H 773 8.597 8.597 8.388 0.209 19502 3433 1 9 . 1 1 774 774 ALA N N 774 124.328 124.328 125.439 -1.111 19502 3434 1 9 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.716 0.087 19502 3435 1 9 . 1 1 774 774 ALA CA C 774 51.231 51.231 51.443 -0.212 19502 3436 1 9 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.638 2.487 19502 3437 1 9 . 1 1 774 774 ALA H H 774 9.238 9.238 8.817 0.421 19502 3438 1 9 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.128 0.128 19502 3439 1 9 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.439 1.090 19502 3440 1 9 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.351 -0.218 19502 3441 1 9 . 1 1 776 776 SER N N 776 110.366 110.366 115.116 -4.750 19502 3442 1 9 . 1 1 776 776 SER HA H 776 4.766 4.766 4.781 -0.015 19502 3443 1 9 . 1 1 776 776 SER CA C 776 57.029 57.029 57.373 -0.344 19502 3444 1 9 . 1 1 776 776 SER H H 776 7.550 7.550 7.823 -0.273 19502 3445 1 9 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.479 0.108 19502 3446 1 9 . 1 1 777 777 LYS CA C 777 60.436 60.436 60.473 -0.037 19502 3447 1 9 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.876 0.328 19502 3448 1 9 . 1 1 778 778 LYS N N 778 118.469 118.469 117.704 0.765 19502 3449 1 9 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.838 -0.074 19502 3450 1 9 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.177 0.734 19502 3451 1 9 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.530 2.155 19502 3452 1 9 . 1 1 778 778 LYS H H 778 8.151 8.151 8.350 -0.199 19502 3453 1 9 . 1 1 779 779 GLN N N 779 117.975 117.975 118.639 -0.664 19502 3454 1 9 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.054 -0.041 19502 3455 1 9 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.646 -0.737 19502 3456 1 9 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.350 0.210 19502 3457 1 9 . 1 1 779 779 GLN H H 779 7.773 7.773 8.416 -0.643 19502 3458 1 9 . 1 1 780 780 GLY N N 780 108.214 108.214 108.560 -0.346 19502 3459 1 9 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.017 0.994 19502 3460 1 9 . 1 1 780 780 GLY H H 780 8.273 8.273 8.207 0.066 19502 3461 1 9 . 1 1 781 781 LYS N N 781 120.027 120.027 121.956 -1.929 19502 3462 1 9 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.653 -0.564 19502 3463 1 9 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.650 0.708 19502 3464 1 9 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.788 -0.102 19502 3465 1 9 . 1 1 781 781 LYS H H 781 7.307 7.307 7.751 -0.444 19502 3466 1 9 . 1 1 782 782 GLN N N 782 117.131 117.131 118.749 -1.618 19502 3467 1 9 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.821 -0.053 19502 3468 1 9 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.417 0.378 19502 3469 1 9 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.607 -0.054 19502 3470 1 9 . 1 1 782 782 GLN H H 782 7.227 7.227 8.062 -0.835 19502 3471 1 9 . 1 1 783 783 GLU N N 783 117.958 117.958 119.040 -1.082 19502 3472 1 9 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.055 0.148 19502 3473 1 9 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.056 -0.092 19502 3474 1 9 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.159 -0.200 19502 3475 1 9 . 1 1 783 783 GLU H H 783 8.896 8.896 8.598 0.298 19502 3476 1 9 . 1 1 784 784 ALA N N 784 124.176 124.176 122.784 1.392 19502 3477 1 9 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.021 0.113 19502 3478 1 9 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.455 -0.240 19502 3479 1 9 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.418 -0.821 19502 3480 1 9 . 1 1 784 784 ALA H H 784 8.532 8.532 8.236 0.296 19502 3481 1 9 . 1 1 785 785 ALA N N 785 121.847 121.847 120.621 1.226 19502 3482 1 9 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.941 0.101 19502 3483 1 9 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.080 0.089 19502 3484 1 9 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.475 -0.082 19502 3485 1 9 . 1 1 785 785 ALA H H 785 8.402 8.402 7.985 0.417 19502 3486 1 9 . 1 1 786 786 ASP N N 786 120.625 120.625 120.189 0.436 19502 3487 1 9 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.230 -0.078 19502 3488 1 9 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.579 0.592 19502 3489 1 9 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.627 1.889 19502 3490 1 9 . 1 1 786 786 ASP H H 786 8.524 8.524 8.437 0.087 19502 3491 1 9 . 1 1 787 787 ALA N N 787 118.408 118.408 120.881 -2.473 19502 3492 1 9 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.137 -0.161 19502 3493 1 9 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.919 0.197 19502 3494 1 9 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.383 -0.113 19502 3495 1 9 . 1 1 787 787 ALA H H 787 8.191 8.191 8.109 0.082 19502 3496 1 9 . 1 1 788 788 ALA N N 788 118.510 118.510 121.493 -2.983 19502 3497 1 9 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.103 -0.399 19502 3498 1 9 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.824 0.069 19502 3499 1 9 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.922 0.651 19502 3500 1 9 . 1 1 788 788 ALA H H 788 7.533 7.533 7.898 -0.365 19502 3501 1 9 . 1 1 789 789 LEU N N 789 117.413 117.413 118.770 -1.357 19502 3502 1 9 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.795 -0.105 19502 3503 1 9 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.872 0.308 19502 3504 1 9 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.403 0.701 19502 3505 1 9 . 1 1 789 789 LEU H H 789 8.520 8.520 8.033 0.487 19502 3506 1 9 . 1 1 790 790 ARG N N 790 116.360 116.360 119.113 -2.753 19502 3507 1 9 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.035 -0.117 19502 3508 1 9 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.334 1.470 19502 3509 1 9 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.504 0.257 19502 3510 1 9 . 1 1 790 790 ARG H H 790 8.293 8.293 7.576 0.717 19502 3511 1 9 . 1 1 791 791 VAL N N 791 120.700 120.700 120.662 0.038 19502 3512 1 9 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.645 0.267 19502 3513 1 9 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.848 -0.364 19502 3514 1 9 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.525 0.211 19502 3515 1 9 . 1 1 791 791 VAL H H 791 7.455 7.455 7.536 -0.081 19502 3516 1 9 . 1 1 792 792 LEU N N 792 120.706 120.706 119.762 0.944 19502 3517 1 9 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.855 0.177 19502 3518 1 9 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.893 -0.026 19502 3519 1 9 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.121 1.126 19502 3520 1 9 . 1 1 792 792 LEU H H 792 8.007 8.007 7.639 0.368 19502 3521 1 9 . 1 1 793 793 ILE N N 793 118.876 118.876 119.200 -0.324 19502 3522 1 9 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.586 0.143 19502 3523 1 9 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.525 -0.524 19502 3524 1 9 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.613 1.342 19502 3525 1 9 . 1 1 793 793 ILE H H 793 8.778 8.778 8.664 0.114 19502 3526 1 9 . 1 1 794 794 GLY N N 794 107.008 107.008 106.561 0.447 19502 3527 1 9 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.802 -0.169 19502 3528 1 9 . 1 1 794 794 GLY H H 794 7.810 7.810 8.140 -0.330 19502 3529 1 9 . 1 1 795 795 GLU N N 795 119.866 119.866 121.338 -1.472 19502 3530 1 9 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.017 0.339 19502 3531 1 9 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.148 -1.444 19502 3532 1 9 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.579 0.501 19502 3533 1 9 . 1 1 795 795 GLU H H 795 7.978 7.978 8.162 -0.184 19502 3534 1 9 . 1 1 796 796 ASN N N 796 118.365 118.365 118.096 0.269 19502 3535 1 9 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.583 0.199 19502 3536 1 9 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.699 -1.117 19502 3537 1 9 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.524 1.521 19502 3538 1 9 . 1 1 796 796 ASN H H 796 8.053 8.053 8.164 -0.111 19502 3539 1 9 . 1 1 797 797 GLU N N 797 120.368 120.368 119.452 0.916 19502 3540 1 9 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.145 0.191 19502 3541 1 9 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.865 -1.241 19502 3542 1 9 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.099 1.242 19502 3543 1 9 . 1 1 797 797 GLU H H 797 8.225 8.225 8.016 0.209 19502 3544 1 9 . 1 1 798 798 LYS N N 798 120.614 120.614 116.998 3.616 19502 3545 1 9 . 1 1 798 798 LYS H H 798 8.088 8.088 7.566 0.522 19502 3546 1 9 . 1 1 799 799 ALA N N 799 124.642 124.642 120.686 3.956 19502 3547 1 9 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.455 -0.014 19502 3548 1 9 . 1 1 799 799 ALA CA C 799 52.692 52.692 52.267 0.425 19502 3549 1 9 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.658 -0.041 19502 3550 1 9 . 1 1 799 799 ALA H H 799 8.138 8.138 7.728 0.410 19502 3551 1 9 . 1 1 800 800 GLU N N 800 120.408 120.408 118.594 1.814 19502 3552 1 9 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.275 0.120 19502 3553 1 9 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.967 0.843 19502 3554 1 9 . 1 1 800 800 GLU CB C 800 30.604 30.604 28.179 2.425 19502 3555 1 9 . 1 1 800 800 GLU H H 800 8.337 8.337 8.316 0.021 19502 3556 1 10 . 1 1 713 713 VAL N N 713 120.649 120.649 122.432 -1.783 19502 3557 1 10 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.166 -0.046 19502 3558 1 10 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.869 1.140 19502 3559 1 10 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.964 -0.217 19502 3560 1 10 . 1 1 713 713 VAL H H 713 8.051 8.051 8.272 -0.221 19502 3561 1 10 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.427 0.054 19502 3562 1 10 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.439 1.315 19502 3563 1 10 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.959 0.056 19502 3564 1 10 . 1 1 716 716 ILE N N 716 121.593 121.593 127.082 -5.489 19502 3565 1 10 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.966 0.133 19502 3566 1 10 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.347 0.482 19502 3567 1 10 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.419 0.747 19502 3568 1 10 . 1 1 716 716 ILE H H 716 8.406 8.406 8.575 -0.169 19502 3569 1 10 . 1 1 717 717 GLY N N 717 108.628 108.628 107.464 1.164 19502 3570 1 10 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.821 -0.147 19502 3571 1 10 . 1 1 717 717 GLY H H 717 8.476 8.476 8.579 -0.103 19502 3572 1 10 . 1 1 718 718 GLU N N 718 119.944 119.944 121.900 -1.956 19502 3573 1 10 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.156 0.121 19502 3574 1 10 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.745 -0.558 19502 3575 1 10 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.620 0.416 19502 3576 1 10 . 1 1 718 718 GLU H H 718 8.055 8.055 7.740 0.315 19502 3577 1 10 . 1 1 719 719 LEU N N 719 118.538 118.538 119.517 -0.979 19502 3578 1 10 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.379 -0.001 19502 3579 1 10 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.259 0.083 19502 3580 1 10 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.672 1.369 19502 3581 1 10 . 1 1 719 719 LEU H H 719 8.098 8.098 7.530 0.568 19502 3582 1 10 . 1 1 720 720 VAL N N 720 117.613 117.613 117.860 -0.247 19502 3583 1 10 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.640 0.064 19502 3584 1 10 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.845 -1.226 19502 3585 1 10 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.366 0.558 19502 3586 1 10 . 1 1 720 720 VAL H H 720 7.838 7.838 8.003 -0.165 19502 3587 1 10 . 1 1 721 721 ARG N N 721 118.905 118.905 120.097 -1.192 19502 3588 1 10 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.951 0.228 19502 3589 1 10 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.400 -0.980 19502 3590 1 10 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.458 0.129 19502 3591 1 10 . 1 1 721 721 ARG H H 721 7.614 7.614 7.569 0.045 19502 3592 1 10 . 1 1 722 722 TYR N N 722 117.574 117.574 119.425 -1.851 19502 3593 1 10 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.332 0.017 19502 3594 1 10 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.419 -1.355 19502 3595 1 10 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.236 0.595 19502 3596 1 10 . 1 1 722 722 TYR H H 722 7.885 7.885 7.790 0.095 19502 3597 1 10 . 1 1 723 723 LEU N N 723 120.520 120.520 118.123 2.397 19502 3598 1 10 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.101 -0.106 19502 3599 1 10 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.873 0.682 19502 3600 1 10 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.833 0.205 19502 3601 1 10 . 1 1 723 723 LEU H H 723 7.794 7.794 7.566 0.228 19502 3602 1 10 . 1 1 724 724 ASN N N 724 115.161 115.161 114.617 0.544 19502 3603 1 10 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.731 -0.119 19502 3604 1 10 . 1 1 724 724 ASN CA C 724 55.237 55.237 54.789 0.448 19502 3605 1 10 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.384 -0.107 19502 3606 1 10 . 1 1 724 724 ASN H H 724 8.892 8.892 7.780 1.112 19502 3607 1 10 . 1 1 725 725 THR N N 725 110.273 110.273 113.851 -3.578 19502 3608 1 10 . 1 1 725 725 THR HA H 725 4.527 4.527 4.395 0.132 19502 3609 1 10 . 1 1 725 725 THR CA C 725 62.903 62.903 63.505 -0.602 19502 3610 1 10 . 1 1 725 725 THR CB C 725 70.619 70.619 70.175 0.444 19502 3611 1 10 . 1 1 725 725 THR H H 725 7.874 7.874 7.399 0.475 19502 3612 1 10 . 1 1 726 726 ASN N N 726 117.048 117.048 119.095 -2.047 19502 3613 1 10 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.099 0.040 19502 3614 1 10 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.841 0.997 19502 3615 1 10 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.630 -1.723 19502 3616 1 10 . 1 1 726 726 ASN H H 726 8.613 8.613 7.645 0.968 19502 3617 1 10 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.357 -0.293 19502 3618 1 10 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.323 0.187 19502 3619 1 10 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.399 -0.954 19502 3620 1 10 . 1 1 728 728 VAL N N 728 118.643 118.643 118.984 -0.341 19502 3621 1 10 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.683 -0.283 19502 3622 1 10 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.474 1.092 19502 3623 1 10 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.641 0.785 19502 3624 1 10 . 1 1 728 728 VAL H H 728 8.182 8.182 7.650 0.532 19502 3625 1 10 . 1 1 729 729 GLY N N 729 105.307 105.307 107.273 -1.966 19502 3626 1 10 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.716 0.934 19502 3627 1 10 . 1 1 729 729 GLY H H 729 7.297 7.297 8.508 -1.211 19502 3628 1 10 . 1 1 730 730 GLY N N 730 109.038 109.038 109.664 -0.626 19502 3629 1 10 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.833 0.859 19502 3630 1 10 . 1 1 730 730 GLY H H 730 8.080 8.080 7.556 0.524 19502 3631 1 10 . 1 1 731 731 LEU N N 731 123.822 123.822 123.626 0.196 19502 3632 1 10 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.021 0.015 19502 3633 1 10 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.496 0.100 19502 3634 1 10 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.553 0.662 19502 3635 1 10 . 1 1 731 731 LEU H H 731 8.287 8.287 8.318 -0.031 19502 3636 1 10 . 1 1 732 732 LEU N N 732 118.759 118.759 118.450 0.309 19502 3637 1 10 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.905 0.181 19502 3638 1 10 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.145 0.363 19502 3639 1 10 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.451 -0.468 19502 3640 1 10 . 1 1 732 732 LEU H H 732 8.412 8.412 8.041 0.371 19502 3641 1 10 . 1 1 733 733 GLU N N 733 121.155 121.155 120.213 0.942 19502 3642 1 10 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.975 0.298 19502 3643 1 10 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.148 -0.075 19502 3644 1 10 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.040 -0.060 19502 3645 1 10 . 1 1 733 733 GLU H H 733 8.003 8.003 7.965 0.038 19502 3646 1 10 . 1 1 734 734 TYR N N 734 122.518 122.518 121.574 0.944 19502 3647 1 10 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.984 0.197 19502 3648 1 10 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.491 0.468 19502 3649 1 10 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.142 -0.298 19502 3650 1 10 . 1 1 734 734 TYR H H 734 8.419 8.419 8.434 -0.015 19502 3651 1 10 . 1 1 735 735 ALA N N 735 122.353 122.353 121.031 1.322 19502 3652 1 10 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.780 0.032 19502 3653 1 10 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.048 1.124 19502 3654 1 10 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.590 0.243 19502 3655 1 10 . 1 1 735 735 ALA H H 735 8.777 8.777 7.977 0.800 19502 3656 1 10 . 1 1 736 736 ARG N N 736 118.852 118.852 117.995 0.857 19502 3657 1 10 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.094 0.079 19502 3658 1 10 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.587 0.937 19502 3659 1 10 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.857 0.299 19502 3660 1 10 . 1 1 736 736 ARG H H 736 8.570 8.570 8.332 0.238 19502 3661 1 10 . 1 1 737 737 SER N N 737 115.125 115.125 113.685 1.440 19502 3662 1 10 . 1 1 737 737 SER HA H 737 4.149 4.149 4.369 -0.220 19502 3663 1 10 . 1 1 737 737 SER CA C 737 61.300 61.300 60.242 1.058 19502 3664 1 10 . 1 1 737 737 SER CB C 737 63.166 63.166 63.564 -0.398 19502 3665 1 10 . 1 1 737 737 SER H H 737 8.257 8.257 8.321 -0.064 19502 3666 1 10 . 1 1 738 738 HIS N N 738 117.591 117.591 116.567 1.024 19502 3667 1 10 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.596 -0.256 19502 3668 1 10 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.012 0.996 19502 3669 1 10 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.239 -0.709 19502 3670 1 10 . 1 1 738 738 HIS H H 738 7.300 7.300 7.680 -0.380 19502 3671 1 10 . 1 1 739 739 GLY N N 739 107.604 107.604 107.859 -0.255 19502 3672 1 10 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.168 0.963 19502 3673 1 10 . 1 1 739 739 GLY H H 739 7.638 7.638 8.021 -0.383 19502 3674 1 10 . 1 1 740 740 PHE N N 740 118.114 118.114 119.973 -1.859 19502 3675 1 10 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.552 0.635 19502 3676 1 10 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.371 -1.968 19502 3677 1 10 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.639 2.343 19502 3678 1 10 . 1 1 740 740 PHE H H 740 8.138 8.138 7.910 0.228 19502 3679 1 10 . 1 1 741 741 ALA N N 741 122.577 122.577 121.958 0.619 19502 3680 1 10 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.538 0.117 19502 3681 1 10 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.923 0.348 19502 3682 1 10 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.671 0.305 19502 3683 1 10 . 1 1 741 741 ALA H H 741 8.550 8.550 8.701 -0.151 19502 3684 1 10 . 1 1 742 742 ALA N N 742 124.016 124.016 128.641 -4.625 19502 3685 1 10 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.646 0.260 19502 3686 1 10 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.133 -0.104 19502 3687 1 10 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.794 0.566 19502 3688 1 10 . 1 1 742 742 ALA H H 742 8.511 8.511 8.666 -0.155 19502 3689 1 10 . 1 1 743 743 GLU N N 743 120.968 120.968 122.565 -1.597 19502 3690 1 10 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.661 -0.111 19502 3691 1 10 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.370 0.396 19502 3692 1 10 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.846 0.142 19502 3693 1 10 . 1 1 743 743 GLU H H 743 8.628 8.628 8.259 0.369 19502 3694 1 10 . 1 1 744 744 PHE N N 744 120.078 120.078 118.991 1.087 19502 3695 1 10 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.128 -0.313 19502 3696 1 10 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.091 0.080 19502 3697 1 10 . 1 1 744 744 PHE CB C 744 40.375 40.375 41.209 -0.834 19502 3698 1 10 . 1 1 744 744 PHE H H 744 8.792 8.792 8.702 0.090 19502 3699 1 10 . 1 1 745 745 LYS N N 745 124.937 124.937 123.875 1.062 19502 3700 1 10 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.814 -0.221 19502 3701 1 10 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.401 0.668 19502 3702 1 10 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.622 -2.077 19502 3703 1 10 . 1 1 745 745 LYS H H 745 9.180 9.180 8.863 0.317 19502 3704 1 10 . 1 1 746 746 LEU N N 746 129.002 129.002 126.034 2.968 19502 3705 1 10 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.977 -0.053 19502 3706 1 10 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.665 0.033 19502 3707 1 10 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.559 -0.980 19502 3708 1 10 . 1 1 746 746 LEU H H 746 8.687 8.687 8.563 0.124 19502 3709 1 10 . 1 1 747 747 VAL N N 747 131.114 131.114 126.595 4.519 19502 3710 1 10 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.974 -0.229 19502 3711 1 10 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.724 -0.590 19502 3712 1 10 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.712 0.259 19502 3713 1 10 . 1 1 747 747 VAL H H 747 9.033 9.033 8.904 0.129 19502 3714 1 10 . 1 1 748 748 ASP N N 748 113.346 113.346 119.081 -5.735 19502 3715 1 10 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.811 -0.027 19502 3716 1 10 . 1 1 748 748 ASP CA C 748 54.334 54.334 52.906 1.428 19502 3717 1 10 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.928 2.263 19502 3718 1 10 . 1 1 748 748 ASP H H 748 7.426 7.426 7.578 -0.152 19502 3719 1 10 . 1 1 749 749 GLN N N 749 120.867 120.867 123.871 -3.004 19502 3720 1 10 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.831 0.239 19502 3721 1 10 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.111 -0.508 19502 3722 1 10 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.755 1.168 19502 3723 1 10 . 1 1 749 749 GLN H H 749 7.647 7.647 8.683 -1.036 19502 3724 1 10 . 1 1 750 750 SER N N 750 119.661 119.661 124.262 -4.601 19502 3725 1 10 . 1 1 750 750 SER HA H 750 4.791 4.791 4.626 0.165 19502 3726 1 10 . 1 1 750 750 SER CA C 750 57.575 57.575 57.492 0.083 19502 3727 1 10 . 1 1 750 750 SER CB C 750 65.910 65.910 63.105 2.805 19502 3728 1 10 . 1 1 750 750 SER H H 750 8.891 8.891 8.290 0.601 19502 3729 1 10 . 1 1 751 751 GLY N N 751 106.531 106.531 110.620 -4.089 19502 3730 1 10 . 1 1 751 751 GLY CA C 751 44.214 44.214 42.690 1.524 19502 3731 1 10 . 1 1 751 751 GLY H H 751 8.183 8.183 7.612 0.571 19502 3732 1 10 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.553 0.295 19502 3733 1 10 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.442 0.096 19502 3734 1 10 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.835 0.063 19502 3735 1 10 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.211 0.015 19502 3736 1 10 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.980 0.365 19502 3737 1 10 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.512 0.395 19502 3738 1 10 . 1 1 754 754 HIS N N 754 109.780 109.780 114.073 -4.293 19502 3739 1 10 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.649 0.109 19502 3740 1 10 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.787 -0.558 19502 3741 1 10 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.901 0.594 19502 3742 1 10 . 1 1 754 754 HIS H H 754 7.707 7.707 8.310 -0.603 19502 3743 1 10 . 1 1 755 755 GLU N N 755 122.843 122.843 120.492 2.351 19502 3744 1 10 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.764 -0.152 19502 3745 1 10 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.127 1.522 19502 3746 1 10 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.946 -0.133 19502 3747 1 10 . 1 1 755 755 GLU H H 755 7.404 7.404 7.116 0.288 19502 3748 1 10 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.099 0.518 19502 3749 1 10 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.546 0.570 19502 3750 1 10 . 1 1 756 756 PRO CB C 756 33.251 33.251 30.396 2.855 19502 3751 1 10 . 1 1 757 757 LYS N N 757 119.032 119.032 125.314 -6.282 19502 3752 1 10 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.500 0.104 19502 3753 1 10 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.511 0.133 19502 3754 1 10 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.151 2.045 19502 3755 1 10 . 1 1 757 757 LYS H H 757 8.195 8.195 7.631 0.564 19502 3756 1 10 . 1 1 758 758 PHE N N 758 120.288 120.288 125.509 -5.221 19502 3757 1 10 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.989 0.051 19502 3758 1 10 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.651 0.165 19502 3759 1 10 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.493 1.807 19502 3760 1 10 . 1 1 758 758 PHE H H 758 8.844 8.844 9.241 -0.397 19502 3761 1 10 . 1 1 759 759 VAL N N 759 121.385 121.385 121.285 0.100 19502 3762 1 10 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.938 0.454 19502 3763 1 10 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.087 -0.437 19502 3764 1 10 . 1 1 759 759 VAL CB C 759 33.238 33.238 32.096 1.142 19502 3765 1 10 . 1 1 759 759 VAL H H 759 8.609 8.609 9.250 -0.641 19502 3766 1 10 . 1 1 760 760 TYR N N 760 126.374 126.374 128.224 -1.850 19502 3767 1 10 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.398 0.399 19502 3768 1 10 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.906 0.014 19502 3769 1 10 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.050 4.803 19502 3770 1 10 . 1 1 760 760 TYR H H 760 8.903 8.903 9.260 -0.357 19502 3771 1 10 . 1 1 761 761 GLN N N 761 115.228 115.228 123.014 -7.786 19502 3772 1 10 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.750 -0.926 19502 3773 1 10 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.279 2.247 19502 3774 1 10 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.851 -0.533 19502 3775 1 10 . 1 1 761 761 GLN H H 761 9.016 9.016 8.912 0.104 19502 3776 1 10 . 1 1 762 762 ALA N N 762 128.023 128.023 129.227 -1.204 19502 3777 1 10 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.724 0.457 19502 3778 1 10 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.164 0.711 19502 3779 1 10 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.864 0.287 19502 3780 1 10 . 1 1 762 762 ALA H H 762 9.500 9.500 8.528 0.972 19502 3781 1 10 . 1 1 763 763 LYS N N 763 122.022 122.022 127.201 -5.179 19502 3782 1 10 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.289 0.575 19502 3783 1 10 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.826 0.319 19502 3784 1 10 . 1 1 763 763 LYS CB C 763 36.456 36.456 32.913 3.543 19502 3785 1 10 . 1 1 763 763 LYS H H 763 8.347 8.347 8.356 -0.009 19502 3786 1 10 . 1 1 764 764 VAL N N 764 123.980 123.980 128.212 -4.232 19502 3787 1 10 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.129 0.498 19502 3788 1 10 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.896 0.070 19502 3789 1 10 . 1 1 764 764 VAL CB C 764 34.820 34.820 29.565 5.255 19502 3790 1 10 . 1 1 764 764 VAL H H 764 8.703 8.703 8.411 0.292 19502 3791 1 10 . 1 1 765 765 GLY N N 765 119.292 119.292 118.358 0.934 19502 3792 1 10 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.783 -0.160 19502 3793 1 10 . 1 1 765 765 GLY H H 765 9.151 9.151 9.042 0.109 19502 3794 1 10 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.462 0.728 19502 3795 1 10 . 1 1 767 767 ARG N N 767 119.571 119.571 122.401 -2.830 19502 3796 1 10 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.774 -0.381 19502 3797 1 10 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.823 1.526 19502 3798 1 10 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.678 0.641 19502 3799 1 10 . 1 1 767 767 ARG H H 767 7.595 7.595 7.811 -0.216 19502 3800 1 10 . 1 1 768 768 TRP N N 768 122.976 122.976 127.379 -4.403 19502 3801 1 10 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.024 -0.454 19502 3802 1 10 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.278 0.188 19502 3803 1 10 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.418 0.800 19502 3804 1 10 . 1 1 768 768 TRP H H 768 8.056 8.056 8.862 -0.806 19502 3805 1 10 . 1 1 769 769 PHE N N 769 116.997 116.997 123.283 -6.286 19502 3806 1 10 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.757 -0.007 19502 3807 1 10 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.891 1.838 19502 3808 1 10 . 1 1 769 769 PHE CB C 769 39.297 39.297 39.967 -0.670 19502 3809 1 10 . 1 1 769 769 PHE H H 769 7.532 7.532 8.869 -1.337 19502 3810 1 10 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.758 -0.034 19502 3811 1 10 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.580 2.719 19502 3812 1 10 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.782 -0.007 19502 3813 1 10 . 1 1 771 771 ALA N N 771 125.979 125.979 121.726 4.253 19502 3814 1 10 . 1 1 771 771 ALA HA H 771 5.234 5.234 4.997 0.237 19502 3815 1 10 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.757 -0.115 19502 3816 1 10 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.976 -0.321 19502 3817 1 10 . 1 1 771 771 ALA H H 771 9.069 9.069 8.296 0.773 19502 3818 1 10 . 1 1 772 772 VAL N N 772 113.901 113.901 120.114 -6.213 19502 3819 1 10 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.860 -0.049 19502 3820 1 10 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.659 -0.510 19502 3821 1 10 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.344 -0.098 19502 3822 1 10 . 1 1 772 772 VAL H H 772 9.024 9.024 8.829 0.195 19502 3823 1 10 . 1 1 773 773 CYS N N 773 119.222 119.222 117.983 1.239 19502 3824 1 10 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.984 -0.377 19502 3825 1 10 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.557 1.201 19502 3826 1 10 . 1 1 773 773 CYS CB C 773 29.841 29.841 31.645 -1.804 19502 3827 1 10 . 1 1 773 773 CYS H H 773 8.597 8.597 8.428 0.169 19502 3828 1 10 . 1 1 774 774 ALA N N 774 124.328 124.328 125.414 -1.086 19502 3829 1 10 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.556 0.247 19502 3830 1 10 . 1 1 774 774 ALA CA C 774 51.231 51.231 51.386 -0.155 19502 3831 1 10 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.638 2.487 19502 3832 1 10 . 1 1 774 774 ALA H H 774 9.238 9.238 9.015 0.223 19502 3833 1 10 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.806 0.450 19502 3834 1 10 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.396 1.133 19502 3835 1 10 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.442 0.691 19502 3836 1 10 . 1 1 776 776 SER N N 776 110.366 110.366 114.668 -4.302 19502 3837 1 10 . 1 1 776 776 SER HA H 776 4.766 4.766 4.861 -0.095 19502 3838 1 10 . 1 1 776 776 SER CA C 776 57.029 57.029 56.247 0.782 19502 3839 1 10 . 1 1 776 776 SER H H 776 7.550 7.550 7.721 -0.171 19502 3840 1 10 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.937 -0.350 19502 3841 1 10 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.618 0.818 19502 3842 1 10 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.149 0.055 19502 3843 1 10 . 1 1 778 778 LYS N N 778 118.469 118.469 118.487 -0.018 19502 3844 1 10 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.823 -0.059 19502 3845 1 10 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.568 0.343 19502 3846 1 10 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.129 1.556 19502 3847 1 10 . 1 1 778 778 LYS H H 778 8.151 8.151 7.895 0.256 19502 3848 1 10 . 1 1 779 779 GLN N N 779 117.975 117.975 118.481 -0.506 19502 3849 1 10 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.983 0.030 19502 3850 1 10 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.667 -0.758 19502 3851 1 10 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.548 0.012 19502 3852 1 10 . 1 1 779 779 GLN H H 779 7.773 7.773 7.675 0.098 19502 3853 1 10 . 1 1 780 780 GLY N N 780 108.214 108.214 107.915 0.299 19502 3854 1 10 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.081 0.930 19502 3855 1 10 . 1 1 780 780 GLY H H 780 8.273 8.273 8.460 -0.187 19502 3856 1 10 . 1 1 781 781 LYS N N 781 120.027 120.027 121.700 -1.673 19502 3857 1 10 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.719 -0.630 19502 3858 1 10 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.383 0.975 19502 3859 1 10 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.854 -0.168 19502 3860 1 10 . 1 1 781 781 LYS H H 781 7.307 7.307 7.480 -0.173 19502 3861 1 10 . 1 1 782 782 GLN N N 782 117.131 117.131 118.889 -1.758 19502 3862 1 10 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.844 -0.076 19502 3863 1 10 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.414 0.380 19502 3864 1 10 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.667 -0.114 19502 3865 1 10 . 1 1 782 782 GLN H H 782 7.227 7.227 8.103 -0.876 19502 3866 1 10 . 1 1 783 783 GLU N N 783 117.958 117.958 118.986 -1.028 19502 3867 1 10 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.073 0.130 19502 3868 1 10 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.751 0.213 19502 3869 1 10 . 1 1 783 783 GLU CB C 783 28.959 28.959 28.982 -0.023 19502 3870 1 10 . 1 1 783 783 GLU H H 783 8.896 8.896 8.675 0.221 19502 3871 1 10 . 1 1 784 784 ALA N N 784 124.176 124.176 123.131 1.045 19502 3872 1 10 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.029 0.105 19502 3873 1 10 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.456 -0.241 19502 3874 1 10 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.384 -0.786 19502 3875 1 10 . 1 1 784 784 ALA H H 784 8.532 8.532 7.753 0.779 19502 3876 1 10 . 1 1 785 785 ALA N N 785 121.847 121.847 120.461 1.386 19502 3877 1 10 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.971 0.071 19502 3878 1 10 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.069 0.100 19502 3879 1 10 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.485 -0.092 19502 3880 1 10 . 1 1 785 785 ALA H H 785 8.402 8.402 8.103 0.299 19502 3881 1 10 . 1 1 786 786 ASP N N 786 120.625 120.625 120.121 0.504 19502 3882 1 10 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.241 -0.089 19502 3883 1 10 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.752 0.419 19502 3884 1 10 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.731 1.785 19502 3885 1 10 . 1 1 786 786 ASP H H 786 8.524 8.524 8.246 0.278 19502 3886 1 10 . 1 1 787 787 ALA N N 787 118.408 118.408 121.125 -2.717 19502 3887 1 10 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.150 -0.174 19502 3888 1 10 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.928 0.188 19502 3889 1 10 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.359 -0.089 19502 3890 1 10 . 1 1 787 787 ALA H H 787 8.191 8.191 8.242 -0.051 19502 3891 1 10 . 1 1 788 788 ALA N N 788 118.510 118.510 121.830 -3.320 19502 3892 1 10 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.088 -0.384 19502 3893 1 10 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.975 -0.082 19502 3894 1 10 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.926 0.647 19502 3895 1 10 . 1 1 788 788 ALA H H 788 7.533 7.533 8.041 -0.508 19502 3896 1 10 . 1 1 789 789 LEU N N 789 117.413 117.413 118.286 -0.873 19502 3897 1 10 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.766 -0.076 19502 3898 1 10 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.789 0.391 19502 3899 1 10 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.376 0.728 19502 3900 1 10 . 1 1 789 789 LEU H H 789 8.520 8.520 8.124 0.396 19502 3901 1 10 . 1 1 790 790 ARG N N 790 116.360 116.360 119.391 -3.031 19502 3902 1 10 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.978 -0.060 19502 3903 1 10 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.583 1.220 19502 3904 1 10 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.853 -0.092 19502 3905 1 10 . 1 1 790 790 ARG H H 790 8.293 8.293 7.566 0.727 19502 3906 1 10 . 1 1 791 791 VAL N N 791 120.700 120.700 120.483 0.217 19502 3907 1 10 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.646 0.266 19502 3908 1 10 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.782 -0.298 19502 3909 1 10 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.431 0.305 19502 3910 1 10 . 1 1 791 791 VAL H H 791 7.455 7.455 7.826 -0.371 19502 3911 1 10 . 1 1 792 792 LEU N N 792 120.706 120.706 119.537 1.169 19502 3912 1 10 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.795 0.237 19502 3913 1 10 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.047 -0.180 19502 3914 1 10 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.065 1.182 19502 3915 1 10 . 1 1 792 792 LEU H H 792 8.007 8.007 7.480 0.527 19502 3916 1 10 . 1 1 793 793 ILE N N 793 118.876 118.876 119.026 -0.150 19502 3917 1 10 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.638 0.091 19502 3918 1 10 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.412 -0.411 19502 3919 1 10 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.497 1.458 19502 3920 1 10 . 1 1 793 793 ILE H H 793 8.778 8.778 8.703 0.075 19502 3921 1 10 . 1 1 794 794 GLY N N 794 107.008 107.008 106.989 0.019 19502 3922 1 10 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.902 -0.269 19502 3923 1 10 . 1 1 794 794 GLY H H 794 7.810 7.810 8.310 -0.500 19502 3924 1 10 . 1 1 795 795 GLU N N 795 119.866 119.866 121.802 -1.936 19502 3925 1 10 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.079 0.277 19502 3926 1 10 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.634 -0.930 19502 3927 1 10 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.654 0.426 19502 3928 1 10 . 1 1 795 795 GLU H H 795 7.978 7.978 8.228 -0.250 19502 3929 1 10 . 1 1 796 796 ASN N N 796 118.365 118.365 116.624 1.741 19502 3930 1 10 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.609 0.173 19502 3931 1 10 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.308 -0.726 19502 3932 1 10 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.900 1.145 19502 3933 1 10 . 1 1 796 796 ASN H H 796 8.053 8.053 8.176 -0.123 19502 3934 1 10 . 1 1 797 797 GLU N N 797 120.368 120.368 121.306 -0.938 19502 3935 1 10 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.027 0.309 19502 3936 1 10 . 1 1 797 797 GLU CA C 797 57.624 57.624 59.416 -1.792 19502 3937 1 10 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.727 0.615 19502 3938 1 10 . 1 1 797 797 GLU H H 797 8.225 8.225 8.169 0.056 19502 3939 1 10 . 1 1 798 798 LYS N N 798 120.614 120.614 115.104 5.510 19502 3940 1 10 . 1 1 798 798 LYS H H 798 8.088 8.088 7.554 0.534 19502 3941 1 10 . 1 1 799 799 ALA N N 799 124.642 124.642 123.574 1.068 19502 3942 1 10 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.652 -0.211 19502 3943 1 10 . 1 1 799 799 ALA CA C 799 52.692 52.692 50.883 1.809 19502 3944 1 10 . 1 1 799 799 ALA CB C 799 19.617 19.617 21.450 -1.833 19502 3945 1 10 . 1 1 799 799 ALA H H 799 8.138 8.138 7.691 0.447 19502 3946 1 10 . 1 1 800 800 GLU N N 800 120.408 120.408 122.659 -2.251 19502 3947 1 10 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.370 0.024 19502 3948 1 10 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.854 0.956 19502 3949 1 10 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.414 1.190 19502 3950 1 10 . 1 1 800 800 GLU H H 800 8.337 8.337 8.625 -0.288 19502 3951 1 11 . 1 1 713 713 VAL N N 713 120.649 120.649 122.061 -1.412 19502 3952 1 11 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.064 0.056 19502 3953 1 11 . 1 1 713 713 VAL CA C 713 63.009 63.009 62.490 0.519 19502 3954 1 11 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.753 -0.006 19502 3955 1 11 . 1 1 713 713 VAL H H 713 8.051 8.051 8.344 -0.293 19502 3956 1 11 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.499 -0.018 19502 3957 1 11 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.098 1.656 19502 3958 1 11 . 1 1 715 715 LYS CB C 715 33.015 33.015 33.252 -0.237 19502 3959 1 11 . 1 1 716 716 ILE N N 716 121.593 121.593 120.199 1.394 19502 3960 1 11 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.003 0.096 19502 3961 1 11 . 1 1 716 716 ILE CA C 716 62.829 62.829 63.507 -0.678 19502 3962 1 11 . 1 1 716 716 ILE CB C 716 38.166 38.166 36.943 1.223 19502 3963 1 11 . 1 1 716 716 ILE H H 716 8.406 8.406 8.739 -0.333 19502 3964 1 11 . 1 1 717 717 GLY N N 717 108.628 108.628 106.828 1.800 19502 3965 1 11 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.000 -0.326 19502 3966 1 11 . 1 1 717 717 GLY H H 717 8.476 8.476 8.743 -0.267 19502 3967 1 11 . 1 1 718 718 GLU N N 718 119.944 119.944 121.218 -1.274 19502 3968 1 11 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.197 0.080 19502 3969 1 11 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.841 -0.654 19502 3970 1 11 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.302 0.735 19502 3971 1 11 . 1 1 718 718 GLU H H 718 8.055 8.055 7.749 0.306 19502 3972 1 11 . 1 1 719 719 LEU N N 719 118.538 118.538 119.252 -0.714 19502 3973 1 11 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.428 -0.050 19502 3974 1 11 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.429 0.913 19502 3975 1 11 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.750 1.290 19502 3976 1 11 . 1 1 719 719 LEU H H 719 8.098 8.098 7.764 0.334 19502 3977 1 11 . 1 1 720 720 VAL N N 720 117.613 117.613 119.552 -1.939 19502 3978 1 11 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.653 0.051 19502 3979 1 11 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.845 -1.226 19502 3980 1 11 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.269 0.655 19502 3981 1 11 . 1 1 720 720 VAL H H 720 7.838 7.838 7.551 0.287 19502 3982 1 11 . 1 1 721 721 ARG N N 721 118.905 118.905 119.728 -0.823 19502 3983 1 11 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.946 0.233 19502 3984 1 11 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.441 -1.021 19502 3985 1 11 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.359 0.228 19502 3986 1 11 . 1 1 721 721 ARG H H 721 7.614 7.614 7.654 -0.040 19502 3987 1 11 . 1 1 722 722 TYR N N 722 117.574 117.574 118.712 -1.138 19502 3988 1 11 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.366 -0.017 19502 3989 1 11 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.057 -0.992 19502 3990 1 11 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.355 0.476 19502 3991 1 11 . 1 1 722 722 TYR H H 722 7.885 7.885 7.374 0.511 19502 3992 1 11 . 1 1 723 723 LEU N N 723 120.520 120.520 116.875 3.645 19502 3993 1 11 . 1 1 723 723 LEU HA H 723 3.995 3.995 3.987 0.008 19502 3994 1 11 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.864 0.691 19502 3995 1 11 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.937 0.101 19502 3996 1 11 . 1 1 723 723 LEU H H 723 7.794 7.794 7.772 0.022 19502 3997 1 11 . 1 1 724 724 ASN N N 724 115.161 115.161 115.570 -0.409 19502 3998 1 11 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.608 0.004 19502 3999 1 11 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.237 -0.000 19502 4000 1 11 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.489 -0.212 19502 4001 1 11 . 1 1 724 724 ASN H H 724 8.892 8.892 7.652 1.240 19502 4002 1 11 . 1 1 725 725 THR N N 725 110.273 110.273 115.269 -4.996 19502 4003 1 11 . 1 1 725 725 THR HA H 725 4.527 4.527 4.237 0.290 19502 4004 1 11 . 1 1 725 725 THR CA C 725 62.903 62.903 64.957 -2.054 19502 4005 1 11 . 1 1 725 725 THR CB C 725 70.619 70.619 69.481 1.138 19502 4006 1 11 . 1 1 725 725 THR H H 725 7.874 7.874 8.218 -0.344 19502 4007 1 11 . 1 1 726 726 ASN N N 726 117.048 117.048 118.425 -1.377 19502 4008 1 11 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.102 0.037 19502 4009 1 11 . 1 1 726 726 ASN CA C 726 51.838 51.838 51.074 0.764 19502 4010 1 11 . 1 1 726 726 ASN CB C 726 37.907 37.907 40.516 -2.609 19502 4011 1 11 . 1 1 726 726 ASN H H 726 8.613 8.613 8.235 0.378 19502 4012 1 11 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.363 -0.299 19502 4013 1 11 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.502 0.007 19502 4014 1 11 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.430 -0.985 19502 4015 1 11 . 1 1 728 728 VAL N N 728 118.643 118.643 119.346 -0.703 19502 4016 1 11 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.654 -0.254 19502 4017 1 11 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.491 1.075 19502 4018 1 11 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.912 0.514 19502 4019 1 11 . 1 1 728 728 VAL H H 728 8.182 8.182 7.855 0.327 19502 4020 1 11 . 1 1 729 729 GLY N N 729 105.307 105.307 106.323 -1.016 19502 4021 1 11 . 1 1 729 729 GLY CA C 729 47.650 47.650 47.122 0.528 19502 4022 1 11 . 1 1 729 729 GLY H H 729 7.297 7.297 9.156 -1.859 19502 4023 1 11 . 1 1 730 730 GLY N N 730 109.038 109.038 109.710 -0.672 19502 4024 1 11 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.981 0.711 19502 4025 1 11 . 1 1 730 730 GLY H H 730 8.080 8.080 7.383 0.697 19502 4026 1 11 . 1 1 731 731 LEU N N 731 123.822 123.822 123.564 0.258 19502 4027 1 11 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.042 -0.006 19502 4028 1 11 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.446 0.150 19502 4029 1 11 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.594 0.621 19502 4030 1 11 . 1 1 731 731 LEU H H 731 8.287 8.287 8.154 0.133 19502 4031 1 11 . 1 1 732 732 LEU N N 732 118.759 118.759 117.998 0.761 19502 4032 1 11 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.959 0.127 19502 4033 1 11 . 1 1 732 732 LEU CA C 732 58.508 58.508 57.965 0.543 19502 4034 1 11 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.421 -0.438 19502 4035 1 11 . 1 1 732 732 LEU H H 732 8.412 8.412 7.987 0.425 19502 4036 1 11 . 1 1 733 733 GLU N N 733 121.155 121.155 120.503 0.652 19502 4037 1 11 . 1 1 733 733 GLU HA H 733 4.273 4.273 4.015 0.258 19502 4038 1 11 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.078 -0.005 19502 4039 1 11 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.122 -0.142 19502 4040 1 11 . 1 1 733 733 GLU H H 733 8.003 8.003 7.930 0.073 19502 4041 1 11 . 1 1 734 734 TYR N N 734 122.518 122.518 121.452 1.066 19502 4042 1 11 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.993 0.188 19502 4043 1 11 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.531 0.428 19502 4044 1 11 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.215 -0.371 19502 4045 1 11 . 1 1 734 734 TYR H H 734 8.419 8.419 8.418 0.001 19502 4046 1 11 . 1 1 735 735 ALA N N 735 122.353 122.353 121.074 1.279 19502 4047 1 11 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.809 0.003 19502 4048 1 11 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.239 0.933 19502 4049 1 11 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.485 0.348 19502 4050 1 11 . 1 1 735 735 ALA H H 735 8.777 8.777 7.997 0.780 19502 4051 1 11 . 1 1 736 736 ARG N N 736 118.852 118.852 118.283 0.569 19502 4052 1 11 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.065 0.108 19502 4053 1 11 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.775 0.748 19502 4054 1 11 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.804 0.352 19502 4055 1 11 . 1 1 736 736 ARG H H 736 8.570 8.570 8.057 0.513 19502 4056 1 11 . 1 1 737 737 SER N N 737 115.125 115.125 113.426 1.699 19502 4057 1 11 . 1 1 737 737 SER HA H 737 4.149 4.149 4.347 -0.198 19502 4058 1 11 . 1 1 737 737 SER CA C 737 61.300 61.300 60.382 0.918 19502 4059 1 11 . 1 1 737 737 SER CB C 737 63.166 63.166 63.550 -0.384 19502 4060 1 11 . 1 1 737 737 SER H H 737 8.257 8.257 8.275 -0.018 19502 4061 1 11 . 1 1 738 738 HIS N N 738 117.591 117.591 116.646 0.945 19502 4062 1 11 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.517 -0.177 19502 4063 1 11 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.346 0.662 19502 4064 1 11 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.276 -0.746 19502 4065 1 11 . 1 1 738 738 HIS H H 738 7.300 7.300 7.757 -0.457 19502 4066 1 11 . 1 1 739 739 GLY N N 739 107.604 107.604 107.323 0.281 19502 4067 1 11 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.729 1.402 19502 4068 1 11 . 1 1 739 739 GLY H H 739 7.638 7.638 8.228 -0.590 19502 4069 1 11 . 1 1 740 740 PHE N N 740 118.114 118.114 120.021 -1.907 19502 4070 1 11 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.591 0.596 19502 4071 1 11 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.286 -1.883 19502 4072 1 11 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.671 2.311 19502 4073 1 11 . 1 1 740 740 PHE H H 740 8.138 8.138 8.015 0.123 19502 4074 1 11 . 1 1 741 741 ALA N N 741 122.577 122.577 122.769 -0.192 19502 4075 1 11 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.590 0.065 19502 4076 1 11 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.772 0.499 19502 4077 1 11 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.027 -0.051 19502 4078 1 11 . 1 1 741 741 ALA H H 741 8.550 8.550 8.755 -0.205 19502 4079 1 11 . 1 1 742 742 ALA N N 742 124.016 124.016 128.442 -4.426 19502 4080 1 11 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.016 -0.110 19502 4081 1 11 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.021 0.008 19502 4082 1 11 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.858 0.502 19502 4083 1 11 . 1 1 742 742 ALA H H 742 8.511 8.511 8.642 -0.131 19502 4084 1 11 . 1 1 743 743 GLU N N 743 120.968 120.968 122.686 -1.718 19502 4085 1 11 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.650 -0.100 19502 4086 1 11 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.967 -0.201 19502 4087 1 11 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.601 0.388 19502 4088 1 11 . 1 1 743 743 GLU H H 743 8.628 8.628 8.344 0.284 19502 4089 1 11 . 1 1 744 744 PHE N N 744 120.078 120.078 122.518 -2.440 19502 4090 1 11 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.909 -0.094 19502 4091 1 11 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.360 -0.189 19502 4092 1 11 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.657 0.718 19502 4093 1 11 . 1 1 744 744 PHE H H 744 8.792 8.792 8.890 -0.098 19502 4094 1 11 . 1 1 745 745 LYS N N 745 124.937 124.937 124.106 0.831 19502 4095 1 11 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.842 -0.249 19502 4096 1 11 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.349 0.721 19502 4097 1 11 . 1 1 745 745 LYS CB C 745 33.545 33.545 36.031 -2.486 19502 4098 1 11 . 1 1 745 745 LYS H H 745 9.180 9.180 8.219 0.961 19502 4099 1 11 . 1 1 746 746 LEU N N 746 129.002 129.002 126.405 2.597 19502 4100 1 11 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.627 0.297 19502 4101 1 11 . 1 1 746 746 LEU CA C 746 54.698 54.698 55.072 -0.373 19502 4102 1 11 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.801 -1.222 19502 4103 1 11 . 1 1 746 746 LEU H H 746 8.687 8.687 8.670 0.017 19502 4104 1 11 . 1 1 747 747 VAL N N 747 131.114 131.114 127.800 3.314 19502 4105 1 11 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.913 -0.168 19502 4106 1 11 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.788 -0.654 19502 4107 1 11 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.590 0.381 19502 4108 1 11 . 1 1 747 747 VAL H H 747 9.033 9.033 8.743 0.290 19502 4109 1 11 . 1 1 748 748 ASP N N 748 113.346 113.346 115.927 -2.581 19502 4110 1 11 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.834 -0.050 19502 4111 1 11 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.679 0.655 19502 4112 1 11 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.342 2.849 19502 4113 1 11 . 1 1 748 748 ASP H H 748 7.426 7.426 7.526 -0.100 19502 4114 1 11 . 1 1 749 749 GLN N N 749 120.867 120.867 121.430 -0.563 19502 4115 1 11 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.141 -0.071 19502 4116 1 11 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.658 -0.055 19502 4117 1 11 . 1 1 749 749 GLN CB C 749 31.923 31.923 31.349 0.574 19502 4118 1 11 . 1 1 749 749 GLN H H 749 7.647 7.647 8.408 -0.761 19502 4119 1 11 . 1 1 750 750 SER N N 750 119.661 119.661 121.809 -2.148 19502 4120 1 11 . 1 1 750 750 SER HA H 750 4.791 4.791 4.617 0.174 19502 4121 1 11 . 1 1 750 750 SER CA C 750 57.575 57.575 58.099 -0.524 19502 4122 1 11 . 1 1 750 750 SER CB C 750 65.910 65.910 63.892 2.018 19502 4123 1 11 . 1 1 750 750 SER H H 750 8.891 8.891 8.135 0.756 19502 4124 1 11 . 1 1 751 751 GLY N N 751 106.531 106.531 109.013 -2.482 19502 4125 1 11 . 1 1 751 751 GLY CA C 751 44.214 44.214 42.752 1.462 19502 4126 1 11 . 1 1 751 751 GLY H H 751 8.183 8.183 7.569 0.614 19502 4127 1 11 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.593 0.255 19502 4128 1 11 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.325 0.213 19502 4129 1 11 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.736 0.162 19502 4130 1 11 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.217 0.009 19502 4131 1 11 . 1 1 753 753 PRO CA C 753 65.345 65.345 65.022 0.323 19502 4132 1 11 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.480 0.427 19502 4133 1 11 . 1 1 754 754 HIS N N 754 109.780 109.780 112.291 -2.511 19502 4134 1 11 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.700 0.058 19502 4135 1 11 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.547 -0.318 19502 4136 1 11 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.352 0.142 19502 4137 1 11 . 1 1 754 754 HIS H H 754 7.707 7.707 7.965 -0.258 19502 4138 1 11 . 1 1 755 755 GLU N N 755 122.843 122.843 120.430 2.413 19502 4139 1 11 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.801 -0.189 19502 4140 1 11 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.689 0.960 19502 4141 1 11 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.772 0.041 19502 4142 1 11 . 1 1 755 755 GLU H H 755 7.404 7.404 7.230 0.174 19502 4143 1 11 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.210 0.407 19502 4144 1 11 . 1 1 756 756 PRO CA C 756 63.116 63.116 63.053 0.063 19502 4145 1 11 . 1 1 756 756 PRO CB C 756 33.251 33.251 32.405 0.846 19502 4146 1 11 . 1 1 757 757 LYS N N 757 119.032 119.032 122.550 -3.518 19502 4147 1 11 . 1 1 757 757 LYS HA H 757 4.604 4.604 5.200 -0.596 19502 4148 1 11 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.892 0.752 19502 4149 1 11 . 1 1 757 757 LYS CB C 757 35.196 35.196 34.870 0.326 19502 4150 1 11 . 1 1 757 757 LYS H H 757 8.195 8.195 7.921 0.274 19502 4151 1 11 . 1 1 758 758 PHE N N 758 120.288 120.288 125.817 -5.529 19502 4152 1 11 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.917 0.123 19502 4153 1 11 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.511 0.305 19502 4154 1 11 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.634 1.666 19502 4155 1 11 . 1 1 758 758 PHE H H 758 8.844 8.844 9.361 -0.517 19502 4156 1 11 . 1 1 759 759 VAL N N 759 121.385 121.385 124.713 -3.328 19502 4157 1 11 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.648 0.744 19502 4158 1 11 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.832 -1.182 19502 4159 1 11 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.734 2.504 19502 4160 1 11 . 1 1 759 759 VAL H H 759 8.609 8.609 9.315 -0.706 19502 4161 1 11 . 1 1 760 760 TYR N N 760 126.374 126.374 128.486 -2.112 19502 4162 1 11 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.042 0.755 19502 4163 1 11 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.271 -0.351 19502 4164 1 11 . 1 1 760 760 TYR CB C 760 46.853 46.853 41.828 5.025 19502 4165 1 11 . 1 1 760 760 TYR H H 760 8.903 8.903 9.528 -0.625 19502 4166 1 11 . 1 1 761 761 GLN N N 761 115.228 115.228 123.477 -8.249 19502 4167 1 11 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.818 -0.994 19502 4168 1 11 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.679 1.847 19502 4169 1 11 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.881 -0.563 19502 4170 1 11 . 1 1 761 761 GLN H H 761 9.016 9.016 8.308 0.708 19502 4171 1 11 . 1 1 762 762 ALA N N 762 128.023 128.023 129.531 -1.508 19502 4172 1 11 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.865 0.316 19502 4173 1 11 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.297 0.578 19502 4174 1 11 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.919 0.232 19502 4175 1 11 . 1 1 762 762 ALA H H 762 9.500 9.500 8.390 1.110 19502 4176 1 11 . 1 1 763 763 LYS N N 763 122.022 122.022 126.652 -4.630 19502 4177 1 11 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.515 0.349 19502 4178 1 11 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.674 0.471 19502 4179 1 11 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.294 3.162 19502 4180 1 11 . 1 1 763 763 LYS H H 763 8.347 8.347 8.658 -0.311 19502 4181 1 11 . 1 1 764 764 VAL N N 764 123.980 123.980 128.019 -4.039 19502 4182 1 11 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.344 0.283 19502 4183 1 11 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.552 0.414 19502 4184 1 11 . 1 1 764 764 VAL CB C 764 34.820 34.820 29.953 4.867 19502 4185 1 11 . 1 1 764 764 VAL H H 764 8.703 8.703 8.495 0.208 19502 4186 1 11 . 1 1 765 765 GLY N N 765 119.292 119.292 118.360 0.932 19502 4187 1 11 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.698 -0.075 19502 4188 1 11 . 1 1 765 765 GLY H H 765 9.151 9.151 9.068 0.083 19502 4189 1 11 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.537 0.653 19502 4190 1 11 . 1 1 767 767 ARG N N 767 119.571 119.571 121.376 -1.805 19502 4191 1 11 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.742 -0.349 19502 4192 1 11 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.973 1.376 19502 4193 1 11 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.135 0.184 19502 4194 1 11 . 1 1 767 767 ARG H H 767 7.595 7.595 7.738 -0.143 19502 4195 1 11 . 1 1 768 768 TRP N N 768 122.976 122.976 124.067 -1.091 19502 4196 1 11 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.136 -0.566 19502 4197 1 11 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.112 0.354 19502 4198 1 11 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.030 0.188 19502 4199 1 11 . 1 1 768 768 TRP H H 768 8.056 8.056 8.798 -0.742 19502 4200 1 11 . 1 1 769 769 PHE N N 769 116.997 116.997 122.950 -5.953 19502 4201 1 11 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.823 -0.073 19502 4202 1 11 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.637 2.092 19502 4203 1 11 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.234 -0.937 19502 4204 1 11 . 1 1 769 769 PHE H H 769 7.532 7.532 8.773 -1.241 19502 4205 1 11 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.747 -0.023 19502 4206 1 11 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.770 2.529 19502 4207 1 11 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.881 -0.106 19502 4208 1 11 . 1 1 771 771 ALA N N 771 125.979 125.979 122.376 3.603 19502 4209 1 11 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.163 0.071 19502 4210 1 11 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.551 0.091 19502 4211 1 11 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.532 0.123 19502 4212 1 11 . 1 1 771 771 ALA H H 771 9.069 9.069 8.145 0.924 19502 4213 1 11 . 1 1 772 772 VAL N N 772 113.901 113.901 118.611 -4.710 19502 4214 1 11 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.829 -0.018 19502 4215 1 11 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.979 -0.830 19502 4216 1 11 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.725 0.521 19502 4217 1 11 . 1 1 772 772 VAL H H 772 9.024 9.024 9.269 -0.245 19502 4218 1 11 . 1 1 773 773 CYS N N 773 119.222 119.222 122.288 -3.066 19502 4219 1 11 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.428 0.179 19502 4220 1 11 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.248 1.510 19502 4221 1 11 . 1 1 773 773 CYS CB C 773 29.841 29.841 26.415 3.426 19502 4222 1 11 . 1 1 773 773 CYS H H 773 8.597 8.597 8.586 0.011 19502 4223 1 11 . 1 1 774 774 ALA N N 774 124.328 124.328 128.357 -4.029 19502 4224 1 11 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.706 0.097 19502 4225 1 11 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.943 0.288 19502 4226 1 11 . 1 1 774 774 ALA CB C 774 24.125 24.125 20.756 3.369 19502 4227 1 11 . 1 1 774 774 ALA H H 774 9.238 9.238 9.086 0.152 19502 4228 1 11 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.218 0.038 19502 4229 1 11 . 1 1 775 775 HIS CA C 775 56.529 56.529 57.025 -0.496 19502 4230 1 11 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.912 -0.779 19502 4231 1 11 . 1 1 776 776 SER N N 776 110.366 110.366 110.908 -0.542 19502 4232 1 11 . 1 1 776 776 SER HA H 776 4.766 4.766 4.728 0.038 19502 4233 1 11 . 1 1 776 776 SER CA C 776 57.029 57.029 57.487 -0.458 19502 4234 1 11 . 1 1 776 776 SER H H 776 7.550 7.550 7.467 0.083 19502 4235 1 11 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.643 -0.056 19502 4236 1 11 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.489 0.947 19502 4237 1 11 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.033 0.171 19502 4238 1 11 . 1 1 778 778 LYS N N 778 118.469 118.469 118.434 0.035 19502 4239 1 11 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.802 -0.038 19502 4240 1 11 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.178 0.733 19502 4241 1 11 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.017 1.668 19502 4242 1 11 . 1 1 778 778 LYS H H 778 8.151 8.151 8.085 0.066 19502 4243 1 11 . 1 1 779 779 GLN N N 779 117.975 117.975 118.124 -0.149 19502 4244 1 11 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.983 0.030 19502 4245 1 11 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.731 -0.822 19502 4246 1 11 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.471 0.089 19502 4247 1 11 . 1 1 779 779 GLN H H 779 7.773 7.773 7.632 0.141 19502 4248 1 11 . 1 1 780 780 GLY N N 780 108.214 108.214 108.018 0.196 19502 4249 1 11 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.769 1.242 19502 4250 1 11 . 1 1 780 780 GLY H H 780 8.273 8.273 7.748 0.525 19502 4251 1 11 . 1 1 781 781 LYS N N 781 120.027 120.027 121.804 -1.777 19502 4252 1 11 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.729 -0.640 19502 4253 1 11 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.594 0.764 19502 4254 1 11 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.907 -0.221 19502 4255 1 11 . 1 1 781 781 LYS H H 781 7.307 7.307 7.536 -0.229 19502 4256 1 11 . 1 1 782 782 GLN N N 782 117.131 117.131 118.885 -1.754 19502 4257 1 11 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.959 -0.191 19502 4258 1 11 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.018 0.777 19502 4259 1 11 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.745 -0.192 19502 4260 1 11 . 1 1 782 782 GLN H H 782 7.227 7.227 7.935 -0.708 19502 4261 1 11 . 1 1 783 783 GLU N N 783 117.958 117.958 119.614 -1.656 19502 4262 1 11 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.038 0.165 19502 4263 1 11 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.184 -0.220 19502 4264 1 11 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.224 -0.265 19502 4265 1 11 . 1 1 783 783 GLU H H 783 8.896 8.896 8.667 0.229 19502 4266 1 11 . 1 1 784 784 ALA N N 784 124.176 124.176 122.343 1.833 19502 4267 1 11 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.064 0.070 19502 4268 1 11 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.463 -0.248 19502 4269 1 11 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.476 -0.879 19502 4270 1 11 . 1 1 784 784 ALA H H 784 8.532 8.532 8.303 0.229 19502 4271 1 11 . 1 1 785 785 ALA N N 785 121.847 121.847 120.413 1.434 19502 4272 1 11 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.022 0.020 19502 4273 1 11 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.094 0.075 19502 4274 1 11 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.307 0.086 19502 4275 1 11 . 1 1 785 785 ALA H H 785 8.402 8.402 7.768 0.634 19502 4276 1 11 . 1 1 786 786 ASP N N 786 120.625 120.625 120.340 0.285 19502 4277 1 11 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.262 -0.110 19502 4278 1 11 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.826 0.345 19502 4279 1 11 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.789 1.727 19502 4280 1 11 . 1 1 786 786 ASP H H 786 8.524 8.524 8.531 -0.007 19502 4281 1 11 . 1 1 787 787 ALA N N 787 118.408 118.408 121.397 -2.989 19502 4282 1 11 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.120 -0.144 19502 4283 1 11 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.913 0.203 19502 4284 1 11 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.433 -0.163 19502 4285 1 11 . 1 1 787 787 ALA H H 787 8.191 8.191 8.184 0.007 19502 4286 1 11 . 1 1 788 788 ALA N N 788 118.510 118.510 121.992 -3.482 19502 4287 1 11 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.139 -0.435 19502 4288 1 11 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.984 -0.091 19502 4289 1 11 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.026 0.547 19502 4290 1 11 . 1 1 788 788 ALA H H 788 7.533 7.533 7.960 -0.427 19502 4291 1 11 . 1 1 789 789 LEU N N 789 117.413 117.413 118.765 -1.352 19502 4292 1 11 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.743 -0.053 19502 4293 1 11 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.918 0.262 19502 4294 1 11 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.364 0.741 19502 4295 1 11 . 1 1 789 789 LEU H H 789 8.520 8.520 8.450 0.070 19502 4296 1 11 . 1 1 790 790 ARG N N 790 116.360 116.360 119.325 -2.965 19502 4297 1 11 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.989 -0.071 19502 4298 1 11 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.717 1.086 19502 4299 1 11 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.839 -0.078 19502 4300 1 11 . 1 1 790 790 ARG H H 790 8.293 8.293 7.874 0.419 19502 4301 1 11 . 1 1 791 791 VAL N N 791 120.700 120.700 120.513 0.187 19502 4302 1 11 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.650 0.262 19502 4303 1 11 . 1 1 791 791 VAL CA C 791 66.484 66.484 67.021 -0.537 19502 4304 1 11 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.532 0.204 19502 4305 1 11 . 1 1 791 791 VAL H H 791 7.455 7.455 7.759 -0.304 19502 4306 1 11 . 1 1 792 792 LEU N N 792 120.706 120.706 119.862 0.844 19502 4307 1 11 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.769 0.263 19502 4308 1 11 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.164 -0.297 19502 4309 1 11 . 1 1 792 792 LEU CB C 792 42.247 42.247 40.913 1.334 19502 4310 1 11 . 1 1 792 792 LEU H H 792 8.007 8.007 8.006 0.001 19502 4311 1 11 . 1 1 793 793 ILE N N 793 118.876 118.876 118.736 0.140 19502 4312 1 11 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.631 0.098 19502 4313 1 11 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.571 -0.570 19502 4314 1 11 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.485 1.470 19502 4315 1 11 . 1 1 793 793 ILE H H 793 8.778 8.778 8.772 0.006 19502 4316 1 11 . 1 1 794 794 GLY N N 794 107.008 107.008 107.365 -0.357 19502 4317 1 11 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.108 -0.475 19502 4318 1 11 . 1 1 794 794 GLY H H 794 7.810 7.810 8.254 -0.444 19502 4319 1 11 . 1 1 795 795 GLU N N 795 119.866 119.866 121.464 -1.598 19502 4320 1 11 . 1 1 795 795 GLU HA H 795 4.356 4.356 3.971 0.385 19502 4321 1 11 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.579 -1.875 19502 4322 1 11 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.213 0.867 19502 4323 1 11 . 1 1 795 795 GLU H H 795 7.978 7.978 8.477 -0.499 19502 4324 1 11 . 1 1 796 796 ASN N N 796 118.365 118.365 117.349 1.016 19502 4325 1 11 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.458 0.324 19502 4326 1 11 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.571 -0.989 19502 4327 1 11 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.901 1.143 19502 4328 1 11 . 1 1 796 796 ASN H H 796 8.053 8.053 8.188 -0.135 19502 4329 1 11 . 1 1 797 797 GLU N N 797 120.368 120.368 118.773 1.595 19502 4330 1 11 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.154 0.182 19502 4331 1 11 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.621 -0.997 19502 4332 1 11 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.823 0.519 19502 4333 1 11 . 1 1 797 797 GLU H H 797 8.225 8.225 8.083 0.142 19502 4334 1 11 . 1 1 798 798 LYS N N 798 120.614 120.614 118.099 2.515 19502 4335 1 11 . 1 1 798 798 LYS H H 798 8.088 8.088 7.566 0.522 19502 4336 1 11 . 1 1 799 799 ALA N N 799 124.642 124.642 123.493 1.149 19502 4337 1 11 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.501 -0.060 19502 4338 1 11 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.274 1.418 19502 4339 1 11 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.589 0.028 19502 4340 1 11 . 1 1 799 799 ALA H H 799 8.138 8.138 8.137 0.001 19502 4341 1 11 . 1 1 800 800 GLU N N 800 120.408 120.408 124.000 -3.592 19502 4342 1 11 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.361 0.034 19502 4343 1 11 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.168 0.642 19502 4344 1 11 . 1 1 800 800 GLU CB C 800 30.604 30.604 30.434 0.170 19502 4345 1 11 . 1 1 800 800 GLU H H 800 8.337 8.337 8.610 -0.273 19502 4346 1 12 . 1 1 713 713 VAL N N 713 120.649 120.649 120.400 0.249 19502 4347 1 12 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.076 0.044 19502 4348 1 12 . 1 1 713 713 VAL CA C 713 63.009 63.009 62.149 0.860 19502 4349 1 12 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.903 -0.156 19502 4350 1 12 . 1 1 713 713 VAL H H 713 8.051 8.051 7.790 0.261 19502 4351 1 12 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.467 0.014 19502 4352 1 12 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.285 1.469 19502 4353 1 12 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.885 0.130 19502 4354 1 12 . 1 1 716 716 ILE N N 716 121.593 121.593 127.169 -5.576 19502 4355 1 12 . 1 1 716 716 ILE HA H 716 4.099 4.099 3.942 0.157 19502 4356 1 12 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.238 0.591 19502 4357 1 12 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.505 0.660 19502 4358 1 12 . 1 1 716 716 ILE H H 716 8.406 8.406 8.581 -0.175 19502 4359 1 12 . 1 1 717 717 GLY N N 717 108.628 108.628 107.495 1.133 19502 4360 1 12 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.044 -0.370 19502 4361 1 12 . 1 1 717 717 GLY H H 717 8.476 8.476 8.568 -0.092 19502 4362 1 12 . 1 1 718 718 GLU N N 718 119.944 119.944 121.143 -1.199 19502 4363 1 12 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.177 0.100 19502 4364 1 12 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.589 -0.402 19502 4365 1 12 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.104 0.933 19502 4366 1 12 . 1 1 718 718 GLU H H 718 8.055 8.055 7.864 0.191 19502 4367 1 12 . 1 1 719 719 LEU N N 719 118.538 118.538 119.452 -0.914 19502 4368 1 12 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.394 -0.016 19502 4369 1 12 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.648 0.694 19502 4370 1 12 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.836 1.204 19502 4371 1 12 . 1 1 719 719 LEU H H 719 8.098 8.098 7.670 0.428 19502 4372 1 12 . 1 1 720 720 VAL N N 720 117.613 117.613 119.087 -1.474 19502 4373 1 12 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.667 0.037 19502 4374 1 12 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.698 -1.079 19502 4375 1 12 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.243 0.681 19502 4376 1 12 . 1 1 720 720 VAL H H 720 7.838 7.838 7.879 -0.041 19502 4377 1 12 . 1 1 721 721 ARG N N 721 118.905 118.905 120.204 -1.299 19502 4378 1 12 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.932 0.247 19502 4379 1 12 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.479 -1.059 19502 4380 1 12 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.420 0.167 19502 4381 1 12 . 1 1 721 721 ARG H H 721 7.614 7.614 7.702 -0.088 19502 4382 1 12 . 1 1 722 722 TYR N N 722 117.574 117.574 118.334 -0.760 19502 4383 1 12 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.357 -0.008 19502 4384 1 12 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.965 -0.900 19502 4385 1 12 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.327 0.504 19502 4386 1 12 . 1 1 722 722 TYR H H 722 7.885 7.885 7.432 0.453 19502 4387 1 12 . 1 1 723 723 LEU N N 723 120.520 120.520 117.507 3.013 19502 4388 1 12 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.069 -0.074 19502 4389 1 12 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.799 0.756 19502 4390 1 12 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.954 0.084 19502 4391 1 12 . 1 1 723 723 LEU H H 723 7.794 7.794 7.668 0.126 19502 4392 1 12 . 1 1 724 724 ASN N N 724 115.161 115.161 114.645 0.516 19502 4393 1 12 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.664 -0.052 19502 4394 1 12 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.345 -0.108 19502 4395 1 12 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.342 -0.065 19502 4396 1 12 . 1 1 724 724 ASN H H 724 8.892 8.892 7.618 1.274 19502 4397 1 12 . 1 1 725 725 THR N N 725 110.273 110.273 115.661 -5.388 19502 4398 1 12 . 1 1 725 725 THR HA H 725 4.527 4.527 4.277 0.250 19502 4399 1 12 . 1 1 725 725 THR CA C 725 62.903 62.903 64.590 -1.687 19502 4400 1 12 . 1 1 725 725 THR CB C 725 70.619 70.619 69.548 1.071 19502 4401 1 12 . 1 1 725 725 THR H H 725 7.874 7.874 8.054 -0.180 19502 4402 1 12 . 1 1 726 726 ASN N N 726 117.048 117.048 118.484 -1.436 19502 4403 1 12 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.127 0.012 19502 4404 1 12 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.822 1.016 19502 4405 1 12 . 1 1 726 726 ASN CB C 726 37.907 37.907 40.409 -2.502 19502 4406 1 12 . 1 1 726 726 ASN H H 726 8.613 8.613 8.109 0.504 19502 4407 1 12 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.413 -0.349 19502 4408 1 12 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.101 0.408 19502 4409 1 12 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.791 -1.345 19502 4410 1 12 . 1 1 728 728 VAL N N 728 118.643 118.643 118.291 0.352 19502 4411 1 12 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.669 -0.269 19502 4412 1 12 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.397 1.169 19502 4413 1 12 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.066 0.360 19502 4414 1 12 . 1 1 728 728 VAL H H 728 8.182 8.182 8.533 -0.351 19502 4415 1 12 . 1 1 729 729 GLY N N 729 105.307 105.307 106.174 -0.867 19502 4416 1 12 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.891 0.759 19502 4417 1 12 . 1 1 729 729 GLY H H 729 7.297 7.297 7.942 -0.645 19502 4418 1 12 . 1 1 730 730 GLY N N 730 109.038 109.038 109.450 -0.412 19502 4419 1 12 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.606 1.086 19502 4420 1 12 . 1 1 730 730 GLY H H 730 8.080 8.080 7.329 0.751 19502 4421 1 12 . 1 1 731 731 LEU N N 731 123.822 123.822 123.973 -0.151 19502 4422 1 12 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.045 -0.009 19502 4423 1 12 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.503 0.093 19502 4424 1 12 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.629 0.586 19502 4425 1 12 . 1 1 731 731 LEU H H 731 8.287 8.287 8.431 -0.144 19502 4426 1 12 . 1 1 732 732 LEU N N 732 118.759 118.759 118.089 0.670 19502 4427 1 12 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.906 0.180 19502 4428 1 12 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.151 0.356 19502 4429 1 12 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.332 -0.349 19502 4430 1 12 . 1 1 732 732 LEU H H 732 8.412 8.412 8.138 0.274 19502 4431 1 12 . 1 1 733 733 GLU N N 733 121.155 121.155 120.119 1.036 19502 4432 1 12 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.952 0.321 19502 4433 1 12 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.188 -0.115 19502 4434 1 12 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.983 -0.003 19502 4435 1 12 . 1 1 733 733 GLU H H 733 8.003 8.003 7.597 0.406 19502 4436 1 12 . 1 1 734 734 TYR N N 734 122.518 122.518 120.930 1.588 19502 4437 1 12 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.922 0.259 19502 4438 1 12 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.432 0.527 19502 4439 1 12 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.190 -0.346 19502 4440 1 12 . 1 1 734 734 TYR H H 734 8.419 8.419 8.388 0.031 19502 4441 1 12 . 1 1 735 735 ALA N N 735 122.353 122.353 121.217 1.136 19502 4442 1 12 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.806 0.006 19502 4443 1 12 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.974 1.198 19502 4444 1 12 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.588 0.245 19502 4445 1 12 . 1 1 735 735 ALA H H 735 8.777 8.777 7.975 0.802 19502 4446 1 12 . 1 1 736 736 ARG N N 736 118.852 118.852 118.076 0.776 19502 4447 1 12 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.053 0.120 19502 4448 1 12 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.674 0.849 19502 4449 1 12 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.781 0.375 19502 4450 1 12 . 1 1 736 736 ARG H H 736 8.570 8.570 8.389 0.181 19502 4451 1 12 . 1 1 737 737 SER N N 737 115.125 115.125 114.145 0.980 19502 4452 1 12 . 1 1 737 737 SER HA H 737 4.149 4.149 4.376 -0.227 19502 4453 1 12 . 1 1 737 737 SER CA C 737 61.300 61.300 60.377 0.923 19502 4454 1 12 . 1 1 737 737 SER CB C 737 63.166 63.166 63.580 -0.414 19502 4455 1 12 . 1 1 737 737 SER H H 737 8.257 8.257 8.068 0.189 19502 4456 1 12 . 1 1 738 738 HIS N N 738 117.591 117.591 117.033 0.558 19502 4457 1 12 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.569 -0.229 19502 4458 1 12 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.956 1.052 19502 4459 1 12 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.699 -0.169 19502 4460 1 12 . 1 1 738 738 HIS H H 738 7.300 7.300 7.776 -0.476 19502 4461 1 12 . 1 1 739 739 GLY N N 739 107.604 107.604 107.413 0.191 19502 4462 1 12 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.149 0.982 19502 4463 1 12 . 1 1 739 739 GLY H H 739 7.638 7.638 8.018 -0.380 19502 4464 1 12 . 1 1 740 740 PHE N N 740 118.114 118.114 120.302 -2.188 19502 4465 1 12 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.538 0.649 19502 4466 1 12 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.547 -2.144 19502 4467 1 12 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.532 2.450 19502 4468 1 12 . 1 1 740 740 PHE H H 740 8.138 8.138 7.813 0.325 19502 4469 1 12 . 1 1 741 741 ALA N N 741 122.577 122.577 123.251 -0.674 19502 4470 1 12 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.467 0.188 19502 4471 1 12 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.813 0.458 19502 4472 1 12 . 1 1 741 741 ALA CB C 741 19.976 19.976 19.695 0.281 19502 4473 1 12 . 1 1 741 741 ALA H H 741 8.550 8.550 8.624 -0.074 19502 4474 1 12 . 1 1 742 742 ALA N N 742 124.016 124.016 129.424 -5.408 19502 4475 1 12 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.723 0.183 19502 4476 1 12 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.218 -0.189 19502 4477 1 12 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.400 0.960 19502 4478 1 12 . 1 1 742 742 ALA H H 742 8.511 8.511 8.725 -0.214 19502 4479 1 12 . 1 1 743 743 GLU N N 743 120.968 120.968 124.161 -3.193 19502 4480 1 12 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.680 -0.130 19502 4481 1 12 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.794 -0.028 19502 4482 1 12 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.303 0.686 19502 4483 1 12 . 1 1 743 743 GLU H H 743 8.628 8.628 8.702 -0.074 19502 4484 1 12 . 1 1 744 744 PHE N N 744 120.078 120.078 123.438 -3.360 19502 4485 1 12 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.141 -0.326 19502 4486 1 12 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.236 -0.065 19502 4487 1 12 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.462 0.913 19502 4488 1 12 . 1 1 744 744 PHE H H 744 8.792 8.792 8.989 -0.197 19502 4489 1 12 . 1 1 745 745 LYS N N 745 124.937 124.937 124.301 0.636 19502 4490 1 12 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.809 -0.216 19502 4491 1 12 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.527 0.543 19502 4492 1 12 . 1 1 745 745 LYS CB C 745 33.545 33.545 34.695 -1.150 19502 4493 1 12 . 1 1 745 745 LYS H H 745 9.180 9.180 8.534 0.646 19502 4494 1 12 . 1 1 746 746 LEU N N 746 129.002 129.002 126.191 2.811 19502 4495 1 12 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.744 0.179 19502 4496 1 12 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.509 0.189 19502 4497 1 12 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.696 -1.117 19502 4498 1 12 . 1 1 746 746 LEU H H 746 8.687 8.687 8.528 0.159 19502 4499 1 12 . 1 1 747 747 VAL N N 747 131.114 131.114 127.251 3.863 19502 4500 1 12 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.885 -0.140 19502 4501 1 12 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.660 -0.526 19502 4502 1 12 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.503 0.468 19502 4503 1 12 . 1 1 747 747 VAL H H 747 9.033 9.033 8.653 0.380 19502 4504 1 12 . 1 1 748 748 ASP N N 748 113.346 113.346 114.541 -1.195 19502 4505 1 12 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.847 -0.063 19502 4506 1 12 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.865 0.469 19502 4507 1 12 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.177 3.014 19502 4508 1 12 . 1 1 748 748 ASP H H 748 7.426 7.426 7.598 -0.172 19502 4509 1 12 . 1 1 749 749 GLN N N 749 120.867 120.867 121.985 -1.118 19502 4510 1 12 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.557 0.513 19502 4511 1 12 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.099 -0.496 19502 4512 1 12 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.389 1.534 19502 4513 1 12 . 1 1 749 749 GLN H H 749 7.647 7.647 8.377 -0.730 19502 4514 1 12 . 1 1 750 750 SER N N 750 119.661 119.661 119.807 -0.146 19502 4515 1 12 . 1 1 750 750 SER HA H 750 4.791 4.791 4.461 0.330 19502 4516 1 12 . 1 1 750 750 SER CA C 750 57.575 57.575 57.369 0.206 19502 4517 1 12 . 1 1 750 750 SER CB C 750 65.910 65.910 63.138 2.772 19502 4518 1 12 . 1 1 750 750 SER H H 750 8.891 8.891 8.260 0.631 19502 4519 1 12 . 1 1 751 751 GLY N N 751 106.531 106.531 114.524 -7.993 19502 4520 1 12 . 1 1 751 751 GLY CA C 751 44.214 44.214 42.517 1.697 19502 4521 1 12 . 1 1 751 751 GLY H H 751 8.183 8.183 8.053 0.130 19502 4522 1 12 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.643 0.205 19502 4523 1 12 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.340 0.198 19502 4524 1 12 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.967 -0.069 19502 4525 1 12 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.276 -0.050 19502 4526 1 12 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.987 0.358 19502 4527 1 12 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.527 0.380 19502 4528 1 12 . 1 1 754 754 HIS N N 754 109.780 109.780 112.496 -2.716 19502 4529 1 12 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.763 -0.005 19502 4530 1 12 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.294 -0.065 19502 4531 1 12 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.571 -0.077 19502 4532 1 12 . 1 1 754 754 HIS H H 754 7.707 7.707 8.055 -0.348 19502 4533 1 12 . 1 1 755 755 GLU N N 755 122.843 122.843 120.197 2.646 19502 4534 1 12 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.706 -0.094 19502 4535 1 12 . 1 1 755 755 GLU CA C 755 54.649 54.649 54.062 0.587 19502 4536 1 12 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.196 -0.383 19502 4537 1 12 . 1 1 755 755 GLU H H 755 7.404 7.404 7.306 0.098 19502 4538 1 12 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.049 0.568 19502 4539 1 12 . 1 1 756 756 PRO CA C 756 63.116 63.116 63.198 -0.082 19502 4540 1 12 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.408 1.843 19502 4541 1 12 . 1 1 757 757 LYS N N 757 119.032 119.032 123.753 -4.721 19502 4542 1 12 . 1 1 757 757 LYS HA H 757 4.604 4.604 5.137 -0.533 19502 4543 1 12 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.705 0.939 19502 4544 1 12 . 1 1 757 757 LYS CB C 757 35.196 35.196 36.299 -1.103 19502 4545 1 12 . 1 1 757 757 LYS H H 757 8.195 8.195 7.457 0.738 19502 4546 1 12 . 1 1 758 758 PHE N N 758 120.288 120.288 123.907 -3.619 19502 4547 1 12 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.713 0.327 19502 4548 1 12 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.728 0.088 19502 4549 1 12 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.759 1.541 19502 4550 1 12 . 1 1 758 758 PHE H H 758 8.844 8.844 9.203 -0.359 19502 4551 1 12 . 1 1 759 759 VAL N N 759 121.385 121.385 123.622 -2.237 19502 4552 1 12 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.954 0.438 19502 4553 1 12 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.320 -0.670 19502 4554 1 12 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.653 1.585 19502 4555 1 12 . 1 1 759 759 VAL H H 759 8.609 8.609 9.109 -0.500 19502 4556 1 12 . 1 1 760 760 TYR N N 760 126.374 126.374 128.310 -1.936 19502 4557 1 12 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.161 0.636 19502 4558 1 12 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.913 0.007 19502 4559 1 12 . 1 1 760 760 TYR CB C 760 46.853 46.853 43.211 3.642 19502 4560 1 12 . 1 1 760 760 TYR H H 760 8.903 8.903 9.432 -0.529 19502 4561 1 12 . 1 1 761 761 GLN N N 761 115.228 115.228 121.763 -6.535 19502 4562 1 12 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.724 -0.900 19502 4563 1 12 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.488 2.038 19502 4564 1 12 . 1 1 761 761 GLN CB C 761 33.318 33.318 34.064 -0.746 19502 4565 1 12 . 1 1 761 761 GLN H H 761 9.016 9.016 8.953 0.063 19502 4566 1 12 . 1 1 762 762 ALA N N 762 128.023 128.023 128.770 -0.747 19502 4567 1 12 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.621 0.560 19502 4568 1 12 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.390 0.485 19502 4569 1 12 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.786 0.365 19502 4570 1 12 . 1 1 762 762 ALA H H 762 9.500 9.500 8.518 0.982 19502 4571 1 12 . 1 1 763 763 LYS N N 763 122.022 122.022 127.439 -5.417 19502 4572 1 12 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.583 0.281 19502 4573 1 12 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.815 0.330 19502 4574 1 12 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.162 3.294 19502 4575 1 12 . 1 1 763 763 LYS H H 763 8.347 8.347 8.801 -0.454 19502 4576 1 12 . 1 1 764 764 VAL N N 764 123.980 123.980 127.811 -3.831 19502 4577 1 12 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.460 0.167 19502 4578 1 12 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.955 0.011 19502 4579 1 12 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.997 3.823 19502 4580 1 12 . 1 1 764 764 VAL H H 764 8.703 8.703 7.954 0.749 19502 4581 1 12 . 1 1 765 765 GLY N N 765 119.292 119.292 118.332 0.960 19502 4582 1 12 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.357 0.266 19502 4583 1 12 . 1 1 765 765 GLY H H 765 9.151 9.151 8.914 0.237 19502 4584 1 12 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.429 0.761 19502 4585 1 12 . 1 1 767 767 ARG N N 767 119.571 119.571 120.331 -0.760 19502 4586 1 12 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.697 -0.303 19502 4587 1 12 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.834 1.515 19502 4588 1 12 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.211 0.108 19502 4589 1 12 . 1 1 767 767 ARG H H 767 7.595 7.595 7.573 0.022 19502 4590 1 12 . 1 1 768 768 TRP N N 768 122.976 122.976 122.034 0.942 19502 4591 1 12 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.019 -0.449 19502 4592 1 12 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.056 0.410 19502 4593 1 12 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.188 0.030 19502 4594 1 12 . 1 1 768 768 TRP H H 768 8.056 8.056 8.653 -0.597 19502 4595 1 12 . 1 1 769 769 PHE N N 769 116.997 116.997 122.227 -5.230 19502 4596 1 12 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.815 -0.065 19502 4597 1 12 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.811 1.918 19502 4598 1 12 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.060 -0.763 19502 4599 1 12 . 1 1 769 769 PHE H H 769 7.532 7.532 8.666 -1.134 19502 4600 1 12 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.753 -0.029 19502 4601 1 12 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.708 2.591 19502 4602 1 12 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.661 0.114 19502 4603 1 12 . 1 1 771 771 ALA N N 771 125.979 125.979 120.654 5.325 19502 4604 1 12 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.234 0.000 19502 4605 1 12 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.860 -0.218 19502 4606 1 12 . 1 1 771 771 ALA CB C 771 19.655 19.655 20.066 -0.411 19502 4607 1 12 . 1 1 771 771 ALA H H 771 9.069 9.069 8.228 0.841 19502 4608 1 12 . 1 1 772 772 VAL N N 772 113.901 113.901 117.567 -3.666 19502 4609 1 12 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.891 -0.081 19502 4610 1 12 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.656 -0.507 19502 4611 1 12 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.204 0.042 19502 4612 1 12 . 1 1 772 772 VAL H H 772 9.024 9.024 9.154 -0.130 19502 4613 1 12 . 1 1 773 773 CYS N N 773 119.222 119.222 119.707 -0.485 19502 4614 1 12 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.511 0.096 19502 4615 1 12 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.925 0.834 19502 4616 1 12 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.015 1.826 19502 4617 1 12 . 1 1 773 773 CYS H H 773 8.597 8.597 8.493 0.104 19502 4618 1 12 . 1 1 774 774 ALA N N 774 124.328 124.328 127.970 -3.642 19502 4619 1 12 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.504 0.299 19502 4620 1 12 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.292 0.939 19502 4621 1 12 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.542 2.583 19502 4622 1 12 . 1 1 774 774 ALA H H 774 9.238 9.238 8.578 0.660 19502 4623 1 12 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.026 0.230 19502 4624 1 12 . 1 1 775 775 HIS CA C 775 56.529 56.529 57.591 -1.062 19502 4625 1 12 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.800 -0.667 19502 4626 1 12 . 1 1 776 776 SER N N 776 110.366 110.366 113.059 -2.693 19502 4627 1 12 . 1 1 776 776 SER HA H 776 4.766 4.766 4.655 0.111 19502 4628 1 12 . 1 1 776 776 SER CA C 776 57.029 57.029 57.311 -0.282 19502 4629 1 12 . 1 1 776 776 SER H H 776 7.550 7.550 7.781 -0.231 19502 4630 1 12 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.799 -0.212 19502 4631 1 12 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.764 0.672 19502 4632 1 12 . 1 1 777 777 LYS CB C 777 32.204 32.204 31.947 0.257 19502 4633 1 12 . 1 1 778 778 LYS N N 778 118.469 118.469 117.651 0.818 19502 4634 1 12 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.917 -0.153 19502 4635 1 12 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.824 1.087 19502 4636 1 12 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.703 1.982 19502 4637 1 12 . 1 1 778 778 LYS H H 778 8.151 8.151 8.204 -0.053 19502 4638 1 12 . 1 1 779 779 GLN N N 779 117.975 117.975 118.902 -0.927 19502 4639 1 12 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.085 -0.072 19502 4640 1 12 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.850 -0.941 19502 4641 1 12 . 1 1 779 779 GLN CB C 779 28.560 28.560 27.963 0.597 19502 4642 1 12 . 1 1 779 779 GLN H H 779 7.773 7.773 8.365 -0.592 19502 4643 1 12 . 1 1 780 780 GLY N N 780 108.214 108.214 108.406 -0.192 19502 4644 1 12 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.197 0.814 19502 4645 1 12 . 1 1 780 780 GLY H H 780 8.273 8.273 8.413 -0.140 19502 4646 1 12 . 1 1 781 781 LYS N N 781 120.027 120.027 121.813 -1.786 19502 4647 1 12 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.623 -0.534 19502 4648 1 12 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.622 0.736 19502 4649 1 12 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.722 -0.036 19502 4650 1 12 . 1 1 781 781 LYS H H 781 7.307 7.307 7.209 0.098 19502 4651 1 12 . 1 1 782 782 GLN N N 782 117.131 117.131 118.596 -1.465 19502 4652 1 12 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.865 -0.097 19502 4653 1 12 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.358 0.437 19502 4654 1 12 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.671 -0.118 19502 4655 1 12 . 1 1 782 782 GLN H H 782 7.227 7.227 8.058 -0.831 19502 4656 1 12 . 1 1 783 783 GLU N N 783 117.958 117.958 119.431 -1.473 19502 4657 1 12 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.058 0.145 19502 4658 1 12 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.136 -0.172 19502 4659 1 12 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.234 -0.275 19502 4660 1 12 . 1 1 783 783 GLU H H 783 8.896 8.896 8.750 0.146 19502 4661 1 12 . 1 1 784 784 ALA N N 784 124.176 124.176 122.468 1.708 19502 4662 1 12 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.068 0.066 19502 4663 1 12 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.360 -0.145 19502 4664 1 12 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.467 -0.870 19502 4665 1 12 . 1 1 784 784 ALA H H 784 8.532 8.532 8.426 0.106 19502 4666 1 12 . 1 1 785 785 ALA N N 785 121.847 121.847 120.900 0.947 19502 4667 1 12 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.014 0.028 19502 4668 1 12 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.310 -0.142 19502 4669 1 12 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.299 0.094 19502 4670 1 12 . 1 1 785 785 ALA H H 785 8.402 8.402 8.210 0.192 19502 4671 1 12 . 1 1 786 786 ASP N N 786 120.625 120.625 119.951 0.674 19502 4672 1 12 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.254 -0.102 19502 4673 1 12 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.916 0.255 19502 4674 1 12 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.935 1.581 19502 4675 1 12 . 1 1 786 786 ASP H H 786 8.524 8.524 8.477 0.047 19502 4676 1 12 . 1 1 787 787 ALA N N 787 118.408 118.408 121.622 -3.214 19502 4677 1 12 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.079 -0.103 19502 4678 1 12 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.936 0.180 19502 4679 1 12 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.338 -0.068 19502 4680 1 12 . 1 1 787 787 ALA H H 787 8.191 8.191 8.170 0.021 19502 4681 1 12 . 1 1 788 788 ALA N N 788 118.510 118.510 121.941 -3.431 19502 4682 1 12 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.041 -0.337 19502 4683 1 12 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.977 -0.084 19502 4684 1 12 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.017 0.556 19502 4685 1 12 . 1 1 788 788 ALA H H 788 7.533 7.533 7.896 -0.363 19502 4686 1 12 . 1 1 789 789 LEU N N 789 117.413 117.413 118.323 -0.910 19502 4687 1 12 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.757 -0.067 19502 4688 1 12 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.865 0.315 19502 4689 1 12 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.220 0.884 19502 4690 1 12 . 1 1 789 789 LEU H H 789 8.520 8.520 8.180 0.340 19502 4691 1 12 . 1 1 790 790 ARG N N 790 116.360 116.360 119.051 -2.691 19502 4692 1 12 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.031 -0.113 19502 4693 1 12 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.560 2.243 19502 4694 1 12 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.148 0.612 19502 4695 1 12 . 1 1 790 790 ARG H H 790 8.293 8.293 8.159 0.134 19502 4696 1 12 . 1 1 791 791 VAL N N 791 120.700 120.700 120.358 0.342 19502 4697 1 12 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.649 0.263 19502 4698 1 12 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.529 -0.045 19502 4699 1 12 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.576 0.160 19502 4700 1 12 . 1 1 791 791 VAL H H 791 7.455 7.455 7.758 -0.303 19502 4701 1 12 . 1 1 792 792 LEU N N 792 120.706 120.706 119.761 0.945 19502 4702 1 12 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.870 0.162 19502 4703 1 12 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.918 -0.051 19502 4704 1 12 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.084 1.163 19502 4705 1 12 . 1 1 792 792 LEU H H 792 8.007 8.007 7.956 0.051 19502 4706 1 12 . 1 1 793 793 ILE N N 793 118.876 118.876 118.566 0.310 19502 4707 1 12 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.660 0.069 19502 4708 1 12 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.138 -0.137 19502 4709 1 12 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.617 1.338 19502 4710 1 12 . 1 1 793 793 ILE H H 793 8.778 8.778 8.624 0.154 19502 4711 1 12 . 1 1 794 794 GLY N N 794 107.008 107.008 107.357 -0.349 19502 4712 1 12 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.029 -0.396 19502 4713 1 12 . 1 1 794 794 GLY H H 794 7.810 7.810 8.286 -0.476 19502 4714 1 12 . 1 1 795 795 GLU N N 795 119.866 119.866 120.238 -0.372 19502 4715 1 12 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.221 0.135 19502 4716 1 12 . 1 1 795 795 GLU CA C 795 57.704 57.704 57.477 0.227 19502 4717 1 12 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.310 0.770 19502 4718 1 12 . 1 1 795 795 GLU H H 795 7.978 7.978 8.479 -0.501 19502 4719 1 12 . 1 1 796 796 ASN N N 796 118.365 118.365 116.925 1.440 19502 4720 1 12 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.705 0.077 19502 4721 1 12 . 1 1 796 796 ASN CA C 796 54.582 54.582 54.643 -0.061 19502 4722 1 12 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.924 1.121 19502 4723 1 12 . 1 1 796 796 ASN H H 796 8.053 8.053 7.745 0.308 19502 4724 1 12 . 1 1 797 797 GLU N N 797 120.368 120.368 120.549 -0.181 19502 4725 1 12 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.200 0.136 19502 4726 1 12 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.523 -0.898 19502 4727 1 12 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.607 0.735 19502 4728 1 12 . 1 1 797 797 GLU H H 797 8.225 8.225 7.597 0.628 19502 4729 1 12 . 1 1 798 798 LYS N N 798 120.614 120.614 115.796 4.818 19502 4730 1 12 . 1 1 798 798 LYS H H 798 8.088 8.088 7.804 0.284 19502 4731 1 12 . 1 1 799 799 ALA N N 799 124.642 124.642 122.780 1.862 19502 4732 1 12 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.488 -0.047 19502 4733 1 12 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.500 1.192 19502 4734 1 12 . 1 1 799 799 ALA CB C 799 19.617 19.617 21.070 -1.453 19502 4735 1 12 . 1 1 799 799 ALA H H 799 8.138 8.138 7.292 0.846 19502 4736 1 12 . 1 1 800 800 GLU N N 800 120.408 120.408 120.267 0.141 19502 4737 1 12 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.642 -0.247 19502 4738 1 12 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.524 1.286 19502 4739 1 12 . 1 1 800 800 GLU CB C 800 30.604 30.604 31.207 -0.603 19502 4740 1 12 . 1 1 800 800 GLU H H 800 8.337 8.337 8.553 -0.216 19502 4741 1 13 . 1 1 713 713 VAL N N 713 120.649 120.649 119.741 0.908 19502 4742 1 13 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.085 0.035 19502 4743 1 13 . 1 1 713 713 VAL CA C 713 63.009 63.009 60.786 2.223 19502 4744 1 13 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.796 -1.049 19502 4745 1 13 . 1 1 713 713 VAL H H 713 8.051 8.051 8.310 -0.259 19502 4746 1 13 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.614 -0.133 19502 4747 1 13 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.308 1.446 19502 4748 1 13 . 1 1 715 715 LYS CB C 715 33.015 33.015 33.336 -0.320 19502 4749 1 13 . 1 1 716 716 ILE N N 716 121.593 121.593 124.195 -2.602 19502 4750 1 13 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.017 0.082 19502 4751 1 13 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.813 1.016 19502 4752 1 13 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.854 0.312 19502 4753 1 13 . 1 1 716 716 ILE H H 716 8.406 8.406 8.701 -0.295 19502 4754 1 13 . 1 1 717 717 GLY N N 717 108.628 108.628 107.863 0.765 19502 4755 1 13 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.980 -0.306 19502 4756 1 13 . 1 1 717 717 GLY H H 717 8.476 8.476 8.648 -0.172 19502 4757 1 13 . 1 1 718 718 GLU N N 718 119.944 119.944 121.410 -1.466 19502 4758 1 13 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.033 0.244 19502 4759 1 13 . 1 1 718 718 GLU CA C 718 58.187 58.187 59.206 -1.019 19502 4760 1 13 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.125 0.912 19502 4761 1 13 . 1 1 718 718 GLU H H 718 8.055 8.055 7.718 0.337 19502 4762 1 13 . 1 1 719 719 LEU N N 719 118.538 118.538 118.452 0.086 19502 4763 1 13 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.369 0.009 19502 4764 1 13 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.629 0.713 19502 4765 1 13 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.566 1.474 19502 4766 1 13 . 1 1 719 719 LEU H H 719 8.098 8.098 7.589 0.509 19502 4767 1 13 . 1 1 720 720 VAL N N 720 117.613 117.613 118.760 -1.147 19502 4768 1 13 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.671 0.033 19502 4769 1 13 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.972 -1.353 19502 4770 1 13 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.448 0.476 19502 4771 1 13 . 1 1 720 720 VAL H H 720 7.838 7.838 7.585 0.253 19502 4772 1 13 . 1 1 721 721 ARG N N 721 118.905 118.905 119.752 -0.847 19502 4773 1 13 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.944 0.235 19502 4774 1 13 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.329 -0.909 19502 4775 1 13 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.358 0.229 19502 4776 1 13 . 1 1 721 721 ARG H H 721 7.614 7.614 8.148 -0.534 19502 4777 1 13 . 1 1 722 722 TYR N N 722 117.574 117.574 119.304 -1.730 19502 4778 1 13 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.321 0.028 19502 4779 1 13 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.090 -1.024 19502 4780 1 13 . 1 1 722 722 TYR CB C 722 38.831 38.831 37.954 0.877 19502 4781 1 13 . 1 1 722 722 TYR H H 722 7.885 7.885 7.733 0.152 19502 4782 1 13 . 1 1 723 723 LEU N N 723 120.520 120.520 117.169 3.351 19502 4783 1 13 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.108 -0.113 19502 4784 1 13 . 1 1 723 723 LEU CA C 723 57.555 57.555 57.059 0.496 19502 4785 1 13 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.788 0.250 19502 4786 1 13 . 1 1 723 723 LEU H H 723 7.794 7.794 7.457 0.337 19502 4787 1 13 . 1 1 724 724 ASN N N 724 115.161 115.161 115.274 -0.113 19502 4788 1 13 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.777 -0.165 19502 4789 1 13 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.091 0.146 19502 4790 1 13 . 1 1 724 724 ASN CB C 724 39.277 39.277 38.818 0.459 19502 4791 1 13 . 1 1 724 724 ASN H H 724 8.892 8.892 7.784 1.108 19502 4792 1 13 . 1 1 725 725 THR N N 725 110.273 110.273 113.143 -2.870 19502 4793 1 13 . 1 1 725 725 THR HA H 725 4.527 4.527 4.416 0.111 19502 4794 1 13 . 1 1 725 725 THR CA C 725 62.903 62.903 63.624 -0.721 19502 4795 1 13 . 1 1 725 725 THR CB C 725 70.619 70.619 69.998 0.621 19502 4796 1 13 . 1 1 725 725 THR H H 725 7.874 7.874 7.305 0.569 19502 4797 1 13 . 1 1 726 726 ASN N N 726 117.048 117.048 119.072 -2.024 19502 4798 1 13 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.119 0.020 19502 4799 1 13 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.445 1.393 19502 4800 1 13 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.950 -2.043 19502 4801 1 13 . 1 1 726 726 ASN H H 726 8.613 8.613 8.060 0.553 19502 4802 1 13 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.386 -0.322 19502 4803 1 13 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.319 0.190 19502 4804 1 13 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.389 -0.944 19502 4805 1 13 . 1 1 728 728 VAL N N 728 118.643 118.643 118.970 -0.327 19502 4806 1 13 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.696 -0.296 19502 4807 1 13 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.673 0.893 19502 4808 1 13 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.866 0.559 19502 4809 1 13 . 1 1 728 728 VAL H H 728 8.182 8.182 7.586 0.596 19502 4810 1 13 . 1 1 729 729 GLY N N 729 105.307 105.307 107.175 -1.868 19502 4811 1 13 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.725 0.925 19502 4812 1 13 . 1 1 729 729 GLY H H 729 7.297 7.297 8.246 -0.949 19502 4813 1 13 . 1 1 730 730 GLY N N 730 109.038 109.038 109.476 -0.438 19502 4814 1 13 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.976 0.716 19502 4815 1 13 . 1 1 730 730 GLY H H 730 8.080 8.080 7.268 0.812 19502 4816 1 13 . 1 1 731 731 LEU N N 731 123.822 123.822 123.423 0.399 19502 4817 1 13 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.013 0.023 19502 4818 1 13 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.344 0.252 19502 4819 1 13 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.493 0.722 19502 4820 1 13 . 1 1 731 731 LEU H H 731 8.287 8.287 7.987 0.300 19502 4821 1 13 . 1 1 732 732 LEU N N 732 118.759 118.759 118.141 0.618 19502 4822 1 13 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.874 0.212 19502 4823 1 13 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.337 0.171 19502 4824 1 13 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.602 -0.619 19502 4825 1 13 . 1 1 732 732 LEU H H 732 8.412 8.412 8.238 0.174 19502 4826 1 13 . 1 1 733 733 GLU N N 733 121.155 121.155 119.235 1.920 19502 4827 1 13 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.977 0.296 19502 4828 1 13 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.922 0.151 19502 4829 1 13 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.853 0.127 19502 4830 1 13 . 1 1 733 733 GLU H H 733 8.003 8.003 8.285 -0.282 19502 4831 1 13 . 1 1 734 734 TYR N N 734 122.518 122.518 122.651 -0.133 19502 4832 1 13 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.979 0.202 19502 4833 1 13 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.453 0.506 19502 4834 1 13 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.334 -0.490 19502 4835 1 13 . 1 1 734 734 TYR H H 734 8.419 8.419 8.236 0.183 19502 4836 1 13 . 1 1 735 735 ALA N N 735 122.353 122.353 120.866 1.487 19502 4837 1 13 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.755 0.057 19502 4838 1 13 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.952 1.220 19502 4839 1 13 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.602 0.231 19502 4840 1 13 . 1 1 735 735 ALA H H 735 8.777 8.777 7.663 1.114 19502 4841 1 13 . 1 1 736 736 ARG N N 736 118.852 118.852 117.763 1.089 19502 4842 1 13 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.092 0.081 19502 4843 1 13 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.594 0.928 19502 4844 1 13 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.792 0.364 19502 4845 1 13 . 1 1 736 736 ARG H H 736 8.570 8.570 8.012 0.558 19502 4846 1 13 . 1 1 737 737 SER N N 737 115.125 115.125 112.694 2.431 19502 4847 1 13 . 1 1 737 737 SER HA H 737 4.149 4.149 4.412 -0.263 19502 4848 1 13 . 1 1 737 737 SER CA C 737 61.300 61.300 59.476 1.824 19502 4849 1 13 . 1 1 737 737 SER CB C 737 63.166 63.166 63.568 -0.402 19502 4850 1 13 . 1 1 737 737 SER H H 737 8.257 8.257 8.044 0.213 19502 4851 1 13 . 1 1 738 738 HIS N N 738 117.591 117.591 116.516 1.075 19502 4852 1 13 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.619 -0.279 19502 4853 1 13 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.984 1.024 19502 4854 1 13 . 1 1 738 738 HIS CB C 738 30.530 30.530 32.100 -1.570 19502 4855 1 13 . 1 1 738 738 HIS H H 738 7.300 7.300 7.792 -0.492 19502 4856 1 13 . 1 1 739 739 GLY N N 739 107.604 107.604 108.112 -0.508 19502 4857 1 13 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.003 1.128 19502 4858 1 13 . 1 1 739 739 GLY H H 739 7.638 7.638 8.138 -0.500 19502 4859 1 13 . 1 1 740 740 PHE N N 740 118.114 118.114 120.068 -1.954 19502 4860 1 13 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.565 0.622 19502 4861 1 13 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.302 -1.899 19502 4862 1 13 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.659 2.323 19502 4863 1 13 . 1 1 740 740 PHE H H 740 8.138 8.138 7.964 0.174 19502 4864 1 13 . 1 1 741 741 ALA N N 741 122.577 122.577 121.504 1.073 19502 4865 1 13 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.588 0.067 19502 4866 1 13 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.755 0.516 19502 4867 1 13 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.285 -0.309 19502 4868 1 13 . 1 1 741 741 ALA H H 741 8.550 8.550 8.603 -0.053 19502 4869 1 13 . 1 1 742 742 ALA N N 742 124.016 124.016 127.921 -3.905 19502 4870 1 13 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.098 -0.192 19502 4871 1 13 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.889 0.140 19502 4872 1 13 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.057 0.303 19502 4873 1 13 . 1 1 742 742 ALA H H 742 8.511 8.511 8.641 -0.130 19502 4874 1 13 . 1 1 743 743 GLU N N 743 120.968 120.968 122.385 -1.417 19502 4875 1 13 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.569 -0.019 19502 4876 1 13 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.823 -0.057 19502 4877 1 13 . 1 1 743 743 GLU CB C 743 33.989 33.989 34.073 -0.084 19502 4878 1 13 . 1 1 743 743 GLU H H 743 8.628 8.628 8.447 0.181 19502 4879 1 13 . 1 1 744 744 PHE N N 744 120.078 120.078 120.130 -0.052 19502 4880 1 13 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.143 -0.328 19502 4881 1 13 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.018 0.153 19502 4882 1 13 . 1 1 744 744 PHE CB C 744 40.375 40.375 41.288 -0.913 19502 4883 1 13 . 1 1 744 744 PHE H H 744 8.792 8.792 8.843 -0.051 19502 4884 1 13 . 1 1 745 745 LYS N N 745 124.937 124.937 123.880 1.057 19502 4885 1 13 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.782 -0.189 19502 4886 1 13 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.561 0.509 19502 4887 1 13 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.538 -1.993 19502 4888 1 13 . 1 1 745 745 LYS H H 745 9.180 9.180 8.455 0.725 19502 4889 1 13 . 1 1 746 746 LEU N N 746 129.002 129.002 125.106 3.896 19502 4890 1 13 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.777 0.147 19502 4891 1 13 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.262 0.436 19502 4892 1 13 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.783 -1.204 19502 4893 1 13 . 1 1 746 746 LEU H H 746 8.687 8.687 8.414 0.273 19502 4894 1 13 . 1 1 747 747 VAL N N 747 131.114 131.114 127.632 3.482 19502 4895 1 13 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.843 -0.098 19502 4896 1 13 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.613 -0.479 19502 4897 1 13 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.583 0.388 19502 4898 1 13 . 1 1 747 747 VAL H H 747 9.033 9.033 8.898 0.135 19502 4899 1 13 . 1 1 748 748 ASP N N 748 113.346 113.346 115.483 -2.137 19502 4900 1 13 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.868 -0.084 19502 4901 1 13 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.863 0.471 19502 4902 1 13 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.189 3.002 19502 4903 1 13 . 1 1 748 748 ASP H H 748 7.426 7.426 7.647 -0.221 19502 4904 1 13 . 1 1 749 749 GLN N N 749 120.867 120.867 122.027 -1.160 19502 4905 1 13 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.339 -0.269 19502 4906 1 13 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.375 0.228 19502 4907 1 13 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.856 1.067 19502 4908 1 13 . 1 1 749 749 GLN H H 749 7.647 7.647 8.412 -0.765 19502 4909 1 13 . 1 1 750 750 SER N N 750 119.661 119.661 118.440 1.221 19502 4910 1 13 . 1 1 750 750 SER HA H 750 4.791 4.791 4.940 -0.149 19502 4911 1 13 . 1 1 750 750 SER CA C 750 57.575 57.575 57.245 0.330 19502 4912 1 13 . 1 1 750 750 SER CB C 750 65.910 65.910 66.578 -0.668 19502 4913 1 13 . 1 1 750 750 SER H H 750 8.891 8.891 8.749 0.142 19502 4914 1 13 . 1 1 751 751 GLY N N 751 106.531 106.531 107.393 -0.862 19502 4915 1 13 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.332 -0.118 19502 4916 1 13 . 1 1 751 751 GLY H H 751 8.183 8.183 8.280 -0.097 19502 4917 1 13 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.655 0.193 19502 4918 1 13 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.360 0.178 19502 4919 1 13 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.687 0.211 19502 4920 1 13 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.254 -0.028 19502 4921 1 13 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.844 0.501 19502 4922 1 13 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.558 0.349 19502 4923 1 13 . 1 1 754 754 HIS N N 754 109.780 109.780 112.516 -2.736 19502 4924 1 13 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.734 0.024 19502 4925 1 13 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.477 -0.248 19502 4926 1 13 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.094 0.400 19502 4927 1 13 . 1 1 754 754 HIS H H 754 7.707 7.707 8.017 -0.310 19502 4928 1 13 . 1 1 755 755 GLU N N 755 122.843 122.843 120.610 2.233 19502 4929 1 13 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.874 -0.262 19502 4930 1 13 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.158 1.490 19502 4931 1 13 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.767 0.046 19502 4932 1 13 . 1 1 755 755 GLU H H 755 7.404 7.404 7.162 0.242 19502 4933 1 13 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.402 0.215 19502 4934 1 13 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.585 0.531 19502 4935 1 13 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.776 1.474 19502 4936 1 13 . 1 1 757 757 LYS N N 757 119.032 119.032 126.218 -7.186 19502 4937 1 13 . 1 1 757 757 LYS HA H 757 4.604 4.604 5.078 -0.474 19502 4938 1 13 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.107 0.537 19502 4939 1 13 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.911 1.285 19502 4940 1 13 . 1 1 757 757 LYS H H 757 8.195 8.195 8.841 -0.646 19502 4941 1 13 . 1 1 758 758 PHE N N 758 120.288 120.288 127.222 -6.934 19502 4942 1 13 . 1 1 758 758 PHE HA H 758 5.040 5.040 5.137 -0.097 19502 4943 1 13 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.645 0.171 19502 4944 1 13 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.285 3.015 19502 4945 1 13 . 1 1 758 758 PHE H H 758 8.844 8.844 9.404 -0.560 19502 4946 1 13 . 1 1 759 759 VAL N N 759 121.385 121.385 125.021 -3.636 19502 4947 1 13 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.704 0.688 19502 4948 1 13 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.689 -1.039 19502 4949 1 13 . 1 1 759 759 VAL CB C 759 33.238 33.238 30.908 2.330 19502 4950 1 13 . 1 1 759 759 VAL H H 759 8.609 8.609 9.312 -0.703 19502 4951 1 13 . 1 1 760 760 TYR N N 760 126.374 126.374 128.682 -2.308 19502 4952 1 13 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.270 0.527 19502 4953 1 13 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.035 -0.115 19502 4954 1 13 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.679 4.173 19502 4955 1 13 . 1 1 760 760 TYR H H 760 8.903 8.903 9.409 -0.506 19502 4956 1 13 . 1 1 761 761 GLN N N 761 115.228 115.228 122.913 -7.685 19502 4957 1 13 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.799 -0.975 19502 4958 1 13 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.789 1.737 19502 4959 1 13 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.846 -0.528 19502 4960 1 13 . 1 1 761 761 GLN H H 761 9.016 9.016 8.411 0.605 19502 4961 1 13 . 1 1 762 762 ALA N N 762 128.023 128.023 129.623 -1.600 19502 4962 1 13 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.633 0.548 19502 4963 1 13 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.692 0.183 19502 4964 1 13 . 1 1 762 762 ALA CB C 762 20.151 20.151 20.196 -0.045 19502 4965 1 13 . 1 1 762 762 ALA H H 762 9.500 9.500 8.438 1.062 19502 4966 1 13 . 1 1 763 763 LYS N N 763 122.022 122.022 125.653 -3.631 19502 4967 1 13 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.375 0.489 19502 4968 1 13 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.629 0.516 19502 4969 1 13 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.889 2.567 19502 4970 1 13 . 1 1 763 763 LYS H H 763 8.347 8.347 8.708 -0.361 19502 4971 1 13 . 1 1 764 764 VAL N N 764 123.980 123.980 127.819 -3.839 19502 4972 1 13 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.498 0.129 19502 4973 1 13 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.287 0.679 19502 4974 1 13 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.439 4.381 19502 4975 1 13 . 1 1 764 764 VAL H H 764 8.703 8.703 8.531 0.172 19502 4976 1 13 . 1 1 765 765 GLY N N 765 119.292 119.292 119.151 0.141 19502 4977 1 13 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.123 0.500 19502 4978 1 13 . 1 1 765 765 GLY H H 765 9.151 9.151 8.704 0.447 19502 4979 1 13 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.665 0.525 19502 4980 1 13 . 1 1 767 767 ARG N N 767 119.571 119.571 122.152 -2.581 19502 4981 1 13 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.679 -0.286 19502 4982 1 13 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.850 0.499 19502 4983 1 13 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.250 1.069 19502 4984 1 13 . 1 1 767 767 ARG H H 767 7.595 7.595 7.689 -0.094 19502 4985 1 13 . 1 1 768 768 TRP N N 768 122.976 122.976 126.481 -3.505 19502 4986 1 13 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.129 -0.559 19502 4987 1 13 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.144 0.322 19502 4988 1 13 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.637 0.582 19502 4989 1 13 . 1 1 768 768 TRP H H 768 8.056 8.056 8.914 -0.858 19502 4990 1 13 . 1 1 769 769 PHE N N 769 116.997 116.997 122.789 -5.792 19502 4991 1 13 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.840 -0.090 19502 4992 1 13 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.579 2.150 19502 4993 1 13 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.152 -0.855 19502 4994 1 13 . 1 1 769 769 PHE H H 769 7.532 7.532 8.684 -1.152 19502 4995 1 13 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.766 -0.042 19502 4996 1 13 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.785 2.514 19502 4997 1 13 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.804 -0.029 19502 4998 1 13 . 1 1 771 771 ALA N N 771 125.979 125.979 122.496 3.483 19502 4999 1 13 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.229 0.005 19502 5000 1 13 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.617 0.025 19502 5001 1 13 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.495 0.160 19502 5002 1 13 . 1 1 771 771 ALA H H 771 9.069 9.069 8.153 0.916 19502 5003 1 13 . 1 1 772 772 VAL N N 772 113.901 113.901 119.076 -5.175 19502 5004 1 13 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.742 0.069 19502 5005 1 13 . 1 1 772 772 VAL CA C 772 59.149 59.149 60.159 -1.010 19502 5006 1 13 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.378 -0.132 19502 5007 1 13 . 1 1 772 772 VAL H H 772 9.024 9.024 9.262 -0.238 19502 5008 1 13 . 1 1 773 773 CYS N N 773 119.222 119.222 120.707 -1.485 19502 5009 1 13 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.662 -0.055 19502 5010 1 13 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.679 1.079 19502 5011 1 13 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.357 1.484 19502 5012 1 13 . 1 1 773 773 CYS H H 773 8.597 8.597 8.453 0.144 19502 5013 1 13 . 1 1 774 774 ALA N N 774 124.328 124.328 128.768 -4.440 19502 5014 1 13 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.800 0.003 19502 5015 1 13 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.470 0.761 19502 5016 1 13 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.355 2.770 19502 5017 1 13 . 1 1 774 774 ALA H H 774 9.238 9.238 8.710 0.528 19502 5018 1 13 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.574 -0.318 19502 5019 1 13 . 1 1 775 775 HIS CA C 775 56.529 56.529 54.806 1.723 19502 5020 1 13 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.909 -0.776 19502 5021 1 13 . 1 1 776 776 SER N N 776 110.366 110.366 114.678 -4.312 19502 5022 1 13 . 1 1 776 776 SER HA H 776 4.766 4.766 4.506 0.260 19502 5023 1 13 . 1 1 776 776 SER CA C 776 57.029 57.029 57.024 0.005 19502 5024 1 13 . 1 1 776 776 SER H H 776 7.550 7.550 7.571 -0.021 19502 5025 1 13 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.630 -0.043 19502 5026 1 13 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.234 1.202 19502 5027 1 13 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.051 0.153 19502 5028 1 13 . 1 1 778 778 LYS N N 778 118.469 118.469 117.769 0.700 19502 5029 1 13 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.868 -0.104 19502 5030 1 13 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.926 0.985 19502 5031 1 13 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.646 2.039 19502 5032 1 13 . 1 1 778 778 LYS H H 778 8.151 8.151 8.182 -0.031 19502 5033 1 13 . 1 1 779 779 GLN N N 779 117.975 117.975 118.223 -0.248 19502 5034 1 13 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.073 -0.060 19502 5035 1 13 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.295 -0.386 19502 5036 1 13 . 1 1 779 779 GLN CB C 779 28.560 28.560 27.904 0.656 19502 5037 1 13 . 1 1 779 779 GLN H H 779 7.773 7.773 8.188 -0.415 19502 5038 1 13 . 1 1 780 780 GLY N N 780 108.214 108.214 108.578 -0.364 19502 5039 1 13 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.970 1.041 19502 5040 1 13 . 1 1 780 780 GLY H H 780 8.273 8.273 8.300 -0.027 19502 5041 1 13 . 1 1 781 781 LYS N N 781 120.027 120.027 121.808 -1.781 19502 5042 1 13 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.417 -0.328 19502 5043 1 13 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.598 0.760 19502 5044 1 13 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.739 -0.053 19502 5045 1 13 . 1 1 781 781 LYS H H 781 7.307 7.307 7.321 -0.014 19502 5046 1 13 . 1 1 782 782 GLN N N 782 117.131 117.131 118.515 -1.384 19502 5047 1 13 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.806 -0.038 19502 5048 1 13 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.317 0.478 19502 5049 1 13 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.570 -0.017 19502 5050 1 13 . 1 1 782 782 GLN H H 782 7.227 7.227 7.800 -0.573 19502 5051 1 13 . 1 1 783 783 GLU N N 783 117.958 117.958 119.252 -1.294 19502 5052 1 13 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.004 0.199 19502 5053 1 13 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.274 -0.310 19502 5054 1 13 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.221 -0.262 19502 5055 1 13 . 1 1 783 783 GLU H H 783 8.896 8.896 8.586 0.310 19502 5056 1 13 . 1 1 784 784 ALA N N 784 124.176 124.176 122.323 1.853 19502 5057 1 13 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.074 0.060 19502 5058 1 13 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.422 -0.207 19502 5059 1 13 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.515 -0.918 19502 5060 1 13 . 1 1 784 784 ALA H H 784 8.532 8.532 8.203 0.329 19502 5061 1 13 . 1 1 785 785 ALA N N 785 121.847 121.847 120.430 1.417 19502 5062 1 13 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.010 0.032 19502 5063 1 13 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.185 -0.016 19502 5064 1 13 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.370 0.023 19502 5065 1 13 . 1 1 785 785 ALA H H 785 8.402 8.402 8.103 0.299 19502 5066 1 13 . 1 1 786 786 ASP N N 786 120.625 120.625 120.081 0.544 19502 5067 1 13 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.265 -0.113 19502 5068 1 13 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.937 0.234 19502 5069 1 13 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.926 1.590 19502 5070 1 13 . 1 1 786 786 ASP H H 786 8.524 8.524 8.550 -0.026 19502 5071 1 13 . 1 1 787 787 ALA N N 787 118.408 118.408 121.571 -3.163 19502 5072 1 13 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.127 -0.151 19502 5073 1 13 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.904 0.212 19502 5074 1 13 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.419 -0.149 19502 5075 1 13 . 1 1 787 787 ALA H H 787 8.191 8.191 8.305 -0.114 19502 5076 1 13 . 1 1 788 788 ALA N N 788 118.510 118.510 122.037 -3.527 19502 5077 1 13 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.121 -0.417 19502 5078 1 13 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.008 -0.115 19502 5079 1 13 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.987 0.586 19502 5080 1 13 . 1 1 788 788 ALA H H 788 7.533 7.533 7.925 -0.392 19502 5081 1 13 . 1 1 789 789 LEU N N 789 117.413 117.413 118.622 -1.209 19502 5082 1 13 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.708 -0.018 19502 5083 1 13 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.955 0.226 19502 5084 1 13 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.329 0.775 19502 5085 1 13 . 1 1 789 789 LEU H H 789 8.520 8.520 8.417 0.103 19502 5086 1 13 . 1 1 790 790 ARG N N 790 116.360 116.360 118.974 -2.614 19502 5087 1 13 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.986 -0.068 19502 5088 1 13 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.447 1.357 19502 5089 1 13 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.877 -0.116 19502 5090 1 13 . 1 1 790 790 ARG H H 790 8.293 8.293 7.710 0.583 19502 5091 1 13 . 1 1 791 791 VAL N N 791 120.700 120.700 120.280 0.420 19502 5092 1 13 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.702 0.210 19502 5093 1 13 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.082 0.402 19502 5094 1 13 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.056 0.680 19502 5095 1 13 . 1 1 791 791 VAL H H 791 7.455 7.455 7.910 -0.455 19502 5096 1 13 . 1 1 792 792 LEU N N 792 120.706 120.706 120.152 0.554 19502 5097 1 13 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.839 0.193 19502 5098 1 13 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.147 -0.280 19502 5099 1 13 . 1 1 792 792 LEU CB C 792 42.247 42.247 40.999 1.248 19502 5100 1 13 . 1 1 792 792 LEU H H 792 8.007 8.007 8.134 -0.127 19502 5101 1 13 . 1 1 793 793 ILE N N 793 118.876 118.876 118.996 -0.120 19502 5102 1 13 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.628 0.101 19502 5103 1 13 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.310 -0.309 19502 5104 1 13 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.591 1.364 19502 5105 1 13 . 1 1 793 793 ILE H H 793 8.778 8.778 8.679 0.099 19502 5106 1 13 . 1 1 794 794 GLY N N 794 107.008 107.008 106.950 0.058 19502 5107 1 13 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.030 -0.397 19502 5108 1 13 . 1 1 794 794 GLY H H 794 7.810 7.810 8.229 -0.419 19502 5109 1 13 . 1 1 795 795 GLU N N 795 119.866 119.866 122.601 -2.735 19502 5110 1 13 . 1 1 795 795 GLU HA H 795 4.356 4.356 3.984 0.372 19502 5111 1 13 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.382 -1.677 19502 5112 1 13 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.517 0.563 19502 5113 1 13 . 1 1 795 795 GLU H H 795 7.978 7.978 8.349 -0.371 19502 5114 1 13 . 1 1 796 796 ASN N N 796 118.365 118.365 115.891 2.474 19502 5115 1 13 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.638 0.144 19502 5116 1 13 . 1 1 796 796 ASN CA C 796 54.582 54.582 54.536 0.046 19502 5117 1 13 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.936 1.109 19502 5118 1 13 . 1 1 796 796 ASN H H 796 8.053 8.053 7.933 0.120 19502 5119 1 13 . 1 1 797 797 GLU N N 797 120.368 120.368 120.484 -0.116 19502 5120 1 13 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.181 0.155 19502 5121 1 13 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.636 -1.012 19502 5122 1 13 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.917 0.425 19502 5123 1 13 . 1 1 797 797 GLU H H 797 8.225 8.225 7.677 0.548 19502 5124 1 13 . 1 1 798 798 LYS N N 798 120.614 120.614 116.661 3.953 19502 5125 1 13 . 1 1 798 798 LYS H H 798 8.088 8.088 7.950 0.138 19502 5126 1 13 . 1 1 799 799 ALA N N 799 124.642 124.642 122.793 1.849 19502 5127 1 13 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.446 -0.005 19502 5128 1 13 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.533 1.159 19502 5129 1 13 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.129 -0.512 19502 5130 1 13 . 1 1 799 799 ALA H H 799 8.138 8.138 7.535 0.603 19502 5131 1 13 . 1 1 800 800 GLU N N 800 120.408 120.408 121.305 -0.897 19502 5132 1 13 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.481 -0.086 19502 5133 1 13 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.442 1.368 19502 5134 1 13 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.759 0.845 19502 5135 1 13 . 1 1 800 800 GLU H H 800 8.337 8.337 8.570 -0.233 19502 5136 1 14 . 1 1 713 713 VAL N N 713 120.649 120.649 122.773 -2.124 19502 5137 1 14 . 1 1 713 713 VAL HA H 713 4.120 4.120 3.936 0.184 19502 5138 1 14 . 1 1 713 713 VAL CA C 713 63.009 63.009 62.536 0.473 19502 5139 1 14 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.213 -0.466 19502 5140 1 14 . 1 1 713 713 VAL H H 713 8.051 8.051 8.313 -0.262 19502 5141 1 14 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.660 -0.179 19502 5142 1 14 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.220 1.534 19502 5143 1 14 . 1 1 715 715 LYS CB C 715 33.015 33.015 31.553 1.462 19502 5144 1 14 . 1 1 716 716 ILE N N 716 121.593 121.593 121.999 -0.406 19502 5145 1 14 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.396 -0.297 19502 5146 1 14 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.556 1.273 19502 5147 1 14 . 1 1 716 716 ILE CB C 716 38.166 38.166 40.184 -2.018 19502 5148 1 14 . 1 1 716 716 ILE H H 716 8.406 8.406 8.038 0.368 19502 5149 1 14 . 1 1 717 717 GLY N N 717 108.628 108.628 109.713 -1.085 19502 5150 1 14 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.742 -1.068 19502 5151 1 14 . 1 1 717 717 GLY H H 717 8.476 8.476 8.896 -0.420 19502 5152 1 14 . 1 1 718 718 GLU N N 718 119.944 119.944 121.798 -1.854 19502 5153 1 14 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.072 0.205 19502 5154 1 14 . 1 1 718 718 GLU CA C 718 58.187 58.187 59.404 -1.217 19502 5155 1 14 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.029 1.008 19502 5156 1 14 . 1 1 718 718 GLU H H 718 8.055 8.055 8.742 -0.687 19502 5157 1 14 . 1 1 719 719 LEU N N 719 118.538 118.538 119.388 -0.850 19502 5158 1 14 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.355 0.023 19502 5159 1 14 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.996 0.346 19502 5160 1 14 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.970 1.070 19502 5161 1 14 . 1 1 719 719 LEU H H 719 8.098 8.098 7.574 0.524 19502 5162 1 14 . 1 1 720 720 VAL N N 720 117.613 117.613 119.149 -1.536 19502 5163 1 14 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.555 0.149 19502 5164 1 14 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.702 -1.083 19502 5165 1 14 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.376 0.548 19502 5166 1 14 . 1 1 720 720 VAL H H 720 7.838 7.838 7.883 -0.045 19502 5167 1 14 . 1 1 721 721 ARG N N 721 118.905 118.905 118.874 0.031 19502 5168 1 14 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.982 0.197 19502 5169 1 14 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.090 -0.670 19502 5170 1 14 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.363 0.225 19502 5171 1 14 . 1 1 721 721 ARG H H 721 7.614 7.614 7.832 -0.218 19502 5172 1 14 . 1 1 722 722 TYR N N 722 117.574 117.574 118.383 -0.809 19502 5173 1 14 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.436 -0.087 19502 5174 1 14 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.649 -0.584 19502 5175 1 14 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.345 0.486 19502 5176 1 14 . 1 1 722 722 TYR H H 722 7.885 7.885 7.236 0.649 19502 5177 1 14 . 1 1 723 723 LEU N N 723 120.520 120.520 116.983 3.537 19502 5178 1 14 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.040 -0.045 19502 5179 1 14 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.917 0.638 19502 5180 1 14 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.860 0.178 19502 5181 1 14 . 1 1 723 723 LEU H H 723 7.794 7.794 7.659 0.135 19502 5182 1 14 . 1 1 724 724 ASN N N 724 115.161 115.161 115.398 -0.237 19502 5183 1 14 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.659 -0.047 19502 5184 1 14 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.495 -0.258 19502 5185 1 14 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.636 -0.360 19502 5186 1 14 . 1 1 724 724 ASN H H 724 8.892 8.892 7.628 1.264 19502 5187 1 14 . 1 1 725 725 THR N N 725 110.273 110.273 115.249 -4.976 19502 5188 1 14 . 1 1 725 725 THR HA H 725 4.527 4.527 4.364 0.163 19502 5189 1 14 . 1 1 725 725 THR CA C 725 62.903 62.903 64.675 -1.772 19502 5190 1 14 . 1 1 725 725 THR CB C 725 70.619 70.619 69.745 0.874 19502 5191 1 14 . 1 1 725 725 THR H H 725 7.874 7.874 8.081 -0.207 19502 5192 1 14 . 1 1 726 726 ASN N N 726 117.048 117.048 118.261 -1.213 19502 5193 1 14 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.108 0.031 19502 5194 1 14 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.620 1.218 19502 5195 1 14 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.675 -1.768 19502 5196 1 14 . 1 1 726 726 ASN H H 726 8.613 8.613 8.075 0.538 19502 5197 1 14 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.388 -0.324 19502 5198 1 14 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.364 0.145 19502 5199 1 14 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.416 -0.971 19502 5200 1 14 . 1 1 728 728 VAL N N 728 118.643 118.643 119.039 -0.396 19502 5201 1 14 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.667 -0.267 19502 5202 1 14 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.703 0.864 19502 5203 1 14 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.872 0.554 19502 5204 1 14 . 1 1 728 728 VAL H H 728 8.182 8.182 7.533 0.649 19502 5205 1 14 . 1 1 729 729 GLY N N 729 105.307 105.307 107.035 -1.728 19502 5206 1 14 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.644 1.006 19502 5207 1 14 . 1 1 729 729 GLY H H 729 7.297 7.297 8.305 -1.008 19502 5208 1 14 . 1 1 730 730 GLY N N 730 109.038 109.038 109.373 -0.335 19502 5209 1 14 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.130 0.562 19502 5210 1 14 . 1 1 730 730 GLY H H 730 8.080 8.080 7.171 0.909 19502 5211 1 14 . 1 1 731 731 LEU N N 731 123.822 123.822 123.423 0.399 19502 5212 1 14 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.026 0.010 19502 5213 1 14 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.346 0.250 19502 5214 1 14 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.482 0.733 19502 5215 1 14 . 1 1 731 731 LEU H H 731 8.287 8.287 8.020 0.267 19502 5216 1 14 . 1 1 732 732 LEU N N 732 118.759 118.759 117.792 0.967 19502 5217 1 14 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.892 0.194 19502 5218 1 14 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.211 0.297 19502 5219 1 14 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.727 -0.744 19502 5220 1 14 . 1 1 732 732 LEU H H 732 8.412 8.412 7.965 0.447 19502 5221 1 14 . 1 1 733 733 GLU N N 733 121.155 121.155 118.955 2.200 19502 5222 1 14 . 1 1 733 733 GLU HA H 733 4.273 4.273 4.011 0.262 19502 5223 1 14 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.658 0.415 19502 5224 1 14 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.279 -0.299 19502 5225 1 14 . 1 1 733 733 GLU H H 733 8.003 8.003 8.044 -0.041 19502 5226 1 14 . 1 1 734 734 TYR N N 734 122.518 122.518 122.572 -0.054 19502 5227 1 14 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.969 0.212 19502 5228 1 14 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.571 0.388 19502 5229 1 14 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.293 -0.449 19502 5230 1 14 . 1 1 734 734 TYR H H 734 8.419 8.419 8.463 -0.044 19502 5231 1 14 . 1 1 735 735 ALA N N 735 122.353 122.353 121.063 1.290 19502 5232 1 14 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.766 0.046 19502 5233 1 14 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.918 1.254 19502 5234 1 14 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.513 0.320 19502 5235 1 14 . 1 1 735 735 ALA H H 735 8.777 8.777 7.662 1.115 19502 5236 1 14 . 1 1 736 736 ARG N N 736 118.852 118.852 117.848 1.004 19502 5237 1 14 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.051 0.122 19502 5238 1 14 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.566 0.957 19502 5239 1 14 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.713 0.443 19502 5240 1 14 . 1 1 736 736 ARG H H 736 8.570 8.570 7.782 0.788 19502 5241 1 14 . 1 1 737 737 SER N N 737 115.125 115.125 113.548 1.577 19502 5242 1 14 . 1 1 737 737 SER HA H 737 4.149 4.149 4.378 -0.229 19502 5243 1 14 . 1 1 737 737 SER CA C 737 61.300 61.300 60.386 0.914 19502 5244 1 14 . 1 1 737 737 SER CB C 737 63.166 63.166 63.555 -0.389 19502 5245 1 14 . 1 1 737 737 SER H H 737 8.257 8.257 8.087 0.170 19502 5246 1 14 . 1 1 738 738 HIS N N 738 117.591 117.591 116.132 1.459 19502 5247 1 14 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.551 -0.211 19502 5248 1 14 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.755 1.254 19502 5249 1 14 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.084 -0.554 19502 5250 1 14 . 1 1 738 738 HIS H H 738 7.300 7.300 7.547 -0.247 19502 5251 1 14 . 1 1 739 739 GLY N N 739 107.604 107.604 107.551 0.053 19502 5252 1 14 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.918 1.213 19502 5253 1 14 . 1 1 739 739 GLY H H 739 7.638 7.638 8.195 -0.557 19502 5254 1 14 . 1 1 740 740 PHE N N 740 118.114 118.114 120.002 -1.888 19502 5255 1 14 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.626 0.561 19502 5256 1 14 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.258 -1.855 19502 5257 1 14 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.388 2.594 19502 5258 1 14 . 1 1 740 740 PHE H H 740 8.138 8.138 7.900 0.238 19502 5259 1 14 . 1 1 741 741 ALA N N 741 122.577 122.577 120.193 2.384 19502 5260 1 14 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.624 0.031 19502 5261 1 14 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.825 0.446 19502 5262 1 14 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.572 -1.596 19502 5263 1 14 . 1 1 741 741 ALA H H 741 8.550 8.550 8.604 -0.054 19502 5264 1 14 . 1 1 742 742 ALA N N 742 124.016 124.016 125.920 -1.904 19502 5265 1 14 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.675 0.231 19502 5266 1 14 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.035 -0.006 19502 5267 1 14 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.689 0.671 19502 5268 1 14 . 1 1 742 742 ALA H H 742 8.511 8.511 8.447 0.064 19502 5269 1 14 . 1 1 743 743 GLU N N 743 120.968 120.968 123.380 -2.412 19502 5270 1 14 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.612 -0.062 19502 5271 1 14 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.716 0.050 19502 5272 1 14 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.403 0.586 19502 5273 1 14 . 1 1 743 743 GLU H H 743 8.628 8.628 8.049 0.579 19502 5274 1 14 . 1 1 744 744 PHE N N 744 120.078 120.078 121.266 -1.188 19502 5275 1 14 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.118 -0.303 19502 5276 1 14 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.207 -0.036 19502 5277 1 14 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.360 0.015 19502 5278 1 14 . 1 1 744 744 PHE H H 744 8.792 8.792 8.735 0.057 19502 5279 1 14 . 1 1 745 745 LYS N N 745 124.937 124.937 123.977 0.960 19502 5280 1 14 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.778 -0.185 19502 5281 1 14 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.305 0.765 19502 5282 1 14 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.707 -2.162 19502 5283 1 14 . 1 1 745 745 LYS H H 745 9.180 9.180 8.341 0.839 19502 5284 1 14 . 1 1 746 746 LEU N N 746 129.002 129.002 124.300 4.702 19502 5285 1 14 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.839 0.085 19502 5286 1 14 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.676 0.022 19502 5287 1 14 . 1 1 746 746 LEU CB C 746 40.579 40.579 42.124 -1.545 19502 5288 1 14 . 1 1 746 746 LEU H H 746 8.687 8.687 8.400 0.287 19502 5289 1 14 . 1 1 747 747 VAL N N 747 131.114 131.114 127.250 3.864 19502 5290 1 14 . 1 1 747 747 VAL HA H 747 3.745 3.745 4.109 -0.364 19502 5291 1 14 . 1 1 747 747 VAL CA C 747 64.134 64.134 63.508 0.626 19502 5292 1 14 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.663 0.308 19502 5293 1 14 . 1 1 747 747 VAL H H 747 9.033 9.033 9.196 -0.163 19502 5294 1 14 . 1 1 748 748 ASP N N 748 113.346 113.346 118.071 -4.725 19502 5295 1 14 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.904 -0.120 19502 5296 1 14 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.719 0.615 19502 5297 1 14 . 1 1 748 748 ASP CB C 748 46.191 46.191 44.361 1.830 19502 5298 1 14 . 1 1 748 748 ASP H H 748 7.426 7.426 7.758 -0.332 19502 5299 1 14 . 1 1 749 749 GLN N N 749 120.867 120.867 123.330 -2.463 19502 5300 1 14 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.958 0.112 19502 5301 1 14 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.930 -0.327 19502 5302 1 14 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.589 1.334 19502 5303 1 14 . 1 1 749 749 GLN H H 749 7.647 7.647 8.519 -0.872 19502 5304 1 14 . 1 1 750 750 SER N N 750 119.661 119.661 122.974 -3.313 19502 5305 1 14 . 1 1 750 750 SER HA H 750 4.791 4.791 4.773 0.018 19502 5306 1 14 . 1 1 750 750 SER CA C 750 57.575 57.575 58.326 -0.751 19502 5307 1 14 . 1 1 750 750 SER CB C 750 65.910 65.910 65.344 0.566 19502 5308 1 14 . 1 1 750 750 SER H H 750 8.891 8.891 8.270 0.621 19502 5309 1 14 . 1 1 751 751 GLY N N 751 106.531 106.531 110.778 -4.247 19502 5310 1 14 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.739 -0.525 19502 5311 1 14 . 1 1 751 751 GLY H H 751 8.183 8.183 8.092 0.091 19502 5312 1 14 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.814 0.034 19502 5313 1 14 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.082 0.456 19502 5314 1 14 . 1 1 752 752 PRO CB C 752 30.898 30.898 31.203 -0.305 19502 5315 1 14 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.348 -0.122 19502 5316 1 14 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.255 1.090 19502 5317 1 14 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.636 0.271 19502 5318 1 14 . 1 1 754 754 HIS N N 754 109.780 109.780 115.458 -5.678 19502 5319 1 14 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.622 0.136 19502 5320 1 14 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.837 -0.608 19502 5321 1 14 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.898 0.596 19502 5322 1 14 . 1 1 754 754 HIS H H 754 7.707 7.707 8.169 -0.462 19502 5323 1 14 . 1 1 755 755 GLU N N 755 122.843 122.843 120.513 2.330 19502 5324 1 14 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.593 0.019 19502 5325 1 14 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.081 1.568 19502 5326 1 14 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.965 -0.152 19502 5327 1 14 . 1 1 755 755 GLU H H 755 7.404 7.404 7.691 -0.287 19502 5328 1 14 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.259 0.358 19502 5329 1 14 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.588 0.528 19502 5330 1 14 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.386 1.865 19502 5331 1 14 . 1 1 757 757 LYS N N 757 119.032 119.032 125.239 -6.207 19502 5332 1 14 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.414 0.190 19502 5333 1 14 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.753 -0.109 19502 5334 1 14 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.054 2.142 19502 5335 1 14 . 1 1 757 757 LYS H H 757 8.195 8.195 7.860 0.335 19502 5336 1 14 . 1 1 758 758 PHE N N 758 120.288 120.288 125.557 -5.269 19502 5337 1 14 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.911 0.129 19502 5338 1 14 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.804 0.012 19502 5339 1 14 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.590 2.710 19502 5340 1 14 . 1 1 758 758 PHE H H 758 8.844 8.844 9.230 -0.386 19502 5341 1 14 . 1 1 759 759 VAL N N 759 121.385 121.385 124.581 -3.196 19502 5342 1 14 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.664 0.728 19502 5343 1 14 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.150 -1.500 19502 5344 1 14 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.711 1.527 19502 5345 1 14 . 1 1 759 759 VAL H H 759 8.609 8.609 9.262 -0.653 19502 5346 1 14 . 1 1 760 760 TYR N N 760 126.374 126.374 128.694 -2.320 19502 5347 1 14 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.328 0.469 19502 5348 1 14 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.174 -0.254 19502 5349 1 14 . 1 1 760 760 TYR CB C 760 46.853 46.853 41.687 5.166 19502 5350 1 14 . 1 1 760 760 TYR H H 760 8.903 8.903 9.053 -0.150 19502 5351 1 14 . 1 1 761 761 GLN N N 761 115.228 115.228 122.318 -7.090 19502 5352 1 14 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.706 -0.882 19502 5353 1 14 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.589 1.938 19502 5354 1 14 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.941 -0.623 19502 5355 1 14 . 1 1 761 761 GLN H H 761 9.016 9.016 8.660 0.356 19502 5356 1 14 . 1 1 762 762 ALA N N 762 128.023 128.023 129.321 -1.298 19502 5357 1 14 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.767 0.414 19502 5358 1 14 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.468 0.407 19502 5359 1 14 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.691 0.460 19502 5360 1 14 . 1 1 762 762 ALA H H 762 9.500 9.500 8.498 1.002 19502 5361 1 14 . 1 1 763 763 LYS N N 763 122.022 122.022 127.251 -5.229 19502 5362 1 14 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.412 0.452 19502 5363 1 14 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.892 0.253 19502 5364 1 14 . 1 1 763 763 LYS CB C 763 36.456 36.456 32.963 3.493 19502 5365 1 14 . 1 1 763 763 LYS H H 763 8.347 8.347 8.460 -0.113 19502 5366 1 14 . 1 1 764 764 VAL N N 764 123.980 123.980 128.094 -4.114 19502 5367 1 14 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.990 -0.363 19502 5368 1 14 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.447 0.519 19502 5369 1 14 . 1 1 764 764 VAL CB C 764 34.820 34.820 29.986 4.833 19502 5370 1 14 . 1 1 764 764 VAL H H 764 8.703 8.703 8.460 0.243 19502 5371 1 14 . 1 1 765 765 GLY N N 765 119.292 119.292 118.216 1.076 19502 5372 1 14 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.578 0.045 19502 5373 1 14 . 1 1 765 765 GLY H H 765 9.151 9.151 8.977 0.174 19502 5374 1 14 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.391 0.799 19502 5375 1 14 . 1 1 767 767 ARG N N 767 119.571 119.571 121.129 -1.558 19502 5376 1 14 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.776 -0.383 19502 5377 1 14 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.710 0.639 19502 5378 1 14 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.498 -0.179 19502 5379 1 14 . 1 1 767 767 ARG H H 767 7.595 7.595 7.636 -0.041 19502 5380 1 14 . 1 1 768 768 TRP N N 768 122.976 122.976 124.800 -1.824 19502 5381 1 14 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.126 -0.556 19502 5382 1 14 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.072 0.394 19502 5383 1 14 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.831 0.387 19502 5384 1 14 . 1 1 768 768 TRP H H 768 8.056 8.056 8.923 -0.867 19502 5385 1 14 . 1 1 769 769 PHE N N 769 116.997 116.997 122.618 -5.621 19502 5386 1 14 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.825 -0.075 19502 5387 1 14 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.525 2.204 19502 5388 1 14 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.118 -0.821 19502 5389 1 14 . 1 1 769 769 PHE H H 769 7.532 7.532 8.654 -1.122 19502 5390 1 14 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.744 -0.020 19502 5391 1 14 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.679 2.620 19502 5392 1 14 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.660 0.116 19502 5393 1 14 . 1 1 771 771 ALA N N 771 125.979 125.979 121.221 4.758 19502 5394 1 14 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.074 0.160 19502 5395 1 14 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.674 -0.032 19502 5396 1 14 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.643 0.012 19502 5397 1 14 . 1 1 771 771 ALA H H 771 9.069 9.069 8.290 0.779 19502 5398 1 14 . 1 1 772 772 VAL N N 772 113.901 113.901 118.079 -4.178 19502 5399 1 14 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.636 0.175 19502 5400 1 14 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.445 -0.296 19502 5401 1 14 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.919 0.327 19502 5402 1 14 . 1 1 772 772 VAL H H 772 9.024 9.024 9.143 -0.119 19502 5403 1 14 . 1 1 773 773 CYS N N 773 119.222 119.222 118.386 0.836 19502 5404 1 14 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.660 -0.053 19502 5405 1 14 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.063 0.695 19502 5406 1 14 . 1 1 773 773 CYS CB C 773 29.841 29.841 29.017 0.824 19502 5407 1 14 . 1 1 773 773 CYS H H 773 8.597 8.597 8.317 0.280 19502 5408 1 14 . 1 1 774 774 ALA N N 774 124.328 124.328 127.554 -3.226 19502 5409 1 14 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.634 0.169 19502 5410 1 14 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.345 0.886 19502 5411 1 14 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.288 1.837 19502 5412 1 14 . 1 1 774 774 ALA H H 774 9.238 9.238 8.748 0.490 19502 5413 1 14 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.853 0.403 19502 5414 1 14 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.440 1.089 19502 5415 1 14 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.582 0.551 19502 5416 1 14 . 1 1 776 776 SER N N 776 110.366 110.366 113.268 -2.902 19502 5417 1 14 . 1 1 776 776 SER HA H 776 4.766 4.766 4.856 -0.090 19502 5418 1 14 . 1 1 776 776 SER CA C 776 57.029 57.029 56.685 0.344 19502 5419 1 14 . 1 1 776 776 SER H H 776 7.550 7.550 7.568 -0.018 19502 5420 1 14 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.465 0.122 19502 5421 1 14 . 1 1 777 777 LYS CA C 777 60.436 60.436 60.116 0.320 19502 5422 1 14 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.192 0.012 19502 5423 1 14 . 1 1 778 778 LYS N N 778 118.469 118.469 118.146 0.323 19502 5424 1 14 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.784 -0.020 19502 5425 1 14 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.769 0.142 19502 5426 1 14 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.088 1.597 19502 5427 1 14 . 1 1 778 778 LYS H H 778 8.151 8.151 7.897 0.254 19502 5428 1 14 . 1 1 779 779 GLN N N 779 117.975 117.975 117.996 -0.021 19502 5429 1 14 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.965 0.048 19502 5430 1 14 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.650 -0.741 19502 5431 1 14 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.322 0.238 19502 5432 1 14 . 1 1 779 779 GLN H H 779 7.773 7.773 8.076 -0.303 19502 5433 1 14 . 1 1 780 780 GLY N N 780 108.214 108.214 108.102 0.112 19502 5434 1 14 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.993 1.018 19502 5435 1 14 . 1 1 780 780 GLY H H 780 8.273 8.273 8.386 -0.113 19502 5436 1 14 . 1 1 781 781 LYS N N 781 120.027 120.027 121.941 -1.914 19502 5437 1 14 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.632 -0.543 19502 5438 1 14 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.530 0.828 19502 5439 1 14 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.790 -0.104 19502 5440 1 14 . 1 1 781 781 LYS H H 781 7.307 7.307 7.721 -0.414 19502 5441 1 14 . 1 1 782 782 GLN N N 782 117.131 117.131 118.805 -1.674 19502 5442 1 14 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.815 -0.047 19502 5443 1 14 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.389 0.406 19502 5444 1 14 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.580 -0.027 19502 5445 1 14 . 1 1 782 782 GLN H H 782 7.227 7.227 8.032 -0.805 19502 5446 1 14 . 1 1 783 783 GLU N N 783 117.958 117.958 119.252 -1.294 19502 5447 1 14 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.011 0.192 19502 5448 1 14 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.208 -0.244 19502 5449 1 14 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.215 -0.256 19502 5450 1 14 . 1 1 783 783 GLU H H 783 8.896 8.896 8.689 0.207 19502 5451 1 14 . 1 1 784 784 ALA N N 784 124.176 124.176 122.449 1.727 19502 5452 1 14 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.059 0.075 19502 5453 1 14 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.383 -0.168 19502 5454 1 14 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.503 -0.906 19502 5455 1 14 . 1 1 784 784 ALA H H 784 8.532 8.532 8.122 0.410 19502 5456 1 14 . 1 1 785 785 ALA N N 785 121.847 121.847 120.680 1.167 19502 5457 1 14 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.995 0.047 19502 5458 1 14 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.294 -0.125 19502 5459 1 14 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.256 0.137 19502 5460 1 14 . 1 1 785 785 ALA H H 785 8.402 8.402 8.224 0.178 19502 5461 1 14 . 1 1 786 786 ASP N N 786 120.625 120.625 119.862 0.763 19502 5462 1 14 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.251 -0.099 19502 5463 1 14 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.896 0.275 19502 5464 1 14 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.883 1.633 19502 5465 1 14 . 1 1 786 786 ASP H H 786 8.524 8.524 8.289 0.235 19502 5466 1 14 . 1 1 787 787 ALA N N 787 118.408 118.408 121.631 -3.223 19502 5467 1 14 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.120 -0.144 19502 5468 1 14 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.881 0.235 19502 5469 1 14 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.428 -0.158 19502 5470 1 14 . 1 1 787 787 ALA H H 787 8.191 8.191 8.018 0.173 19502 5471 1 14 . 1 1 788 788 ALA N N 788 118.510 118.510 121.903 -3.393 19502 5472 1 14 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.052 -0.348 19502 5473 1 14 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.995 -0.102 19502 5474 1 14 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.999 0.574 19502 5475 1 14 . 1 1 788 788 ALA H H 788 7.533 7.533 8.024 -0.491 19502 5476 1 14 . 1 1 789 789 LEU N N 789 117.413 117.413 118.454 -1.041 19502 5477 1 14 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.738 -0.048 19502 5478 1 14 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.971 0.209 19502 5479 1 14 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.348 0.756 19502 5480 1 14 . 1 1 789 789 LEU H H 789 8.520 8.520 8.318 0.202 19502 5481 1 14 . 1 1 790 790 ARG N N 790 116.360 116.360 118.256 -1.896 19502 5482 1 14 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.927 -0.009 19502 5483 1 14 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.672 1.131 19502 5484 1 14 . 1 1 790 790 ARG CB C 790 29.761 29.761 30.010 -0.249 19502 5485 1 14 . 1 1 790 790 ARG H H 790 8.293 8.293 7.577 0.716 19502 5486 1 14 . 1 1 791 791 VAL N N 791 120.700 120.700 120.536 0.164 19502 5487 1 14 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.612 0.300 19502 5488 1 14 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.396 0.088 19502 5489 1 14 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.629 0.107 19502 5490 1 14 . 1 1 791 791 VAL H H 791 7.455 7.455 7.744 -0.289 19502 5491 1 14 . 1 1 792 792 LEU N N 792 120.706 120.706 119.843 0.863 19502 5492 1 14 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.891 0.141 19502 5493 1 14 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.023 -0.156 19502 5494 1 14 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.136 1.111 19502 5495 1 14 . 1 1 792 792 LEU H H 792 8.007 8.007 7.857 0.150 19502 5496 1 14 . 1 1 793 793 ILE N N 793 118.876 118.876 118.718 0.158 19502 5497 1 14 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.647 0.082 19502 5498 1 14 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.656 -0.655 19502 5499 1 14 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.536 1.419 19502 5500 1 14 . 1 1 793 793 ILE H H 793 8.778 8.778 8.745 0.033 19502 5501 1 14 . 1 1 794 794 GLY N N 794 107.008 107.008 106.592 0.416 19502 5502 1 14 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.001 -0.368 19502 5503 1 14 . 1 1 794 794 GLY H H 794 7.810 7.810 8.273 -0.463 19502 5504 1 14 . 1 1 795 795 GLU N N 795 119.866 119.866 122.167 -2.301 19502 5505 1 14 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.060 0.296 19502 5506 1 14 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.075 -1.371 19502 5507 1 14 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.431 0.649 19502 5508 1 14 . 1 1 795 795 GLU H H 795 7.978 7.978 8.096 -0.118 19502 5509 1 14 . 1 1 796 796 ASN N N 796 118.365 118.365 117.305 1.060 19502 5510 1 14 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.533 0.249 19502 5511 1 14 . 1 1 796 796 ASN CA C 796 54.582 54.582 56.088 -1.506 19502 5512 1 14 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.062 0.982 19502 5513 1 14 . 1 1 796 796 ASN H H 796 8.053 8.053 7.870 0.183 19502 5514 1 14 . 1 1 797 797 GLU N N 797 120.368 120.368 119.567 0.801 19502 5515 1 14 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.149 0.187 19502 5516 1 14 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.316 -0.692 19502 5517 1 14 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.403 0.939 19502 5518 1 14 . 1 1 797 797 GLU H H 797 8.225 8.225 8.190 0.035 19502 5519 1 14 . 1 1 798 798 LYS N N 798 120.614 120.614 118.770 1.844 19502 5520 1 14 . 1 1 798 798 LYS H H 798 8.088 8.088 7.766 0.322 19502 5521 1 14 . 1 1 799 799 ALA N N 799 124.642 124.642 119.555 5.087 19502 5522 1 14 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.393 0.048 19502 5523 1 14 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.915 0.777 19502 5524 1 14 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.624 -1.007 19502 5525 1 14 . 1 1 799 799 ALA H H 799 8.138 8.138 7.655 0.483 19502 5526 1 14 . 1 1 800 800 GLU N N 800 120.408 120.408 118.803 1.605 19502 5527 1 14 . 1 1 800 800 GLU HA H 800 4.395 4.395 3.913 0.482 19502 5528 1 14 . 1 1 800 800 GLU CA C 800 56.810 56.810 57.042 -0.232 19502 5529 1 14 . 1 1 800 800 GLU CB C 800 30.604 30.604 27.976 2.628 19502 5530 1 14 . 1 1 800 800 GLU H H 800 8.337 8.337 8.211 0.126 19502 5531 1 15 . 1 1 713 713 VAL N N 713 120.649 120.649 121.685 -1.036 19502 5532 1 15 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.114 0.006 19502 5533 1 15 . 1 1 713 713 VAL CA C 713 63.009 63.009 60.856 2.153 19502 5534 1 15 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.303 -0.555 19502 5535 1 15 . 1 1 713 713 VAL H H 713 8.051 8.051 7.872 0.179 19502 5536 1 15 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.480 0.001 19502 5537 1 15 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.112 1.642 19502 5538 1 15 . 1 1 715 715 LYS CB C 715 33.015 33.015 31.683 1.332 19502 5539 1 15 . 1 1 716 716 ILE N N 716 121.593 121.593 122.996 -1.403 19502 5540 1 15 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.170 -0.070 19502 5541 1 15 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.637 1.192 19502 5542 1 15 . 1 1 716 716 ILE CB C 716 38.166 38.166 38.098 0.068 19502 5543 1 15 . 1 1 716 716 ILE H H 716 8.406 8.406 7.738 0.668 19502 5544 1 15 . 1 1 717 717 GLY N N 717 108.628 108.628 108.397 0.231 19502 5545 1 15 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.185 -0.511 19502 5546 1 15 . 1 1 717 717 GLY H H 717 8.476 8.476 8.784 -0.308 19502 5547 1 15 . 1 1 718 718 GLU N N 718 119.944 119.944 121.228 -1.284 19502 5548 1 15 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.148 0.129 19502 5549 1 15 . 1 1 718 718 GLU CA C 718 58.187 58.187 59.314 -1.127 19502 5550 1 15 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.131 0.906 19502 5551 1 15 . 1 1 718 718 GLU H H 718 8.055 8.055 7.891 0.164 19502 5552 1 15 . 1 1 719 719 LEU N N 719 118.538 118.538 119.144 -0.606 19502 5553 1 15 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.364 0.014 19502 5554 1 15 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.587 0.755 19502 5555 1 15 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.660 1.380 19502 5556 1 15 . 1 1 719 719 LEU H H 719 8.098 8.098 7.764 0.334 19502 5557 1 15 . 1 1 720 720 VAL N N 720 117.613 117.613 118.391 -0.778 19502 5558 1 15 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.669 0.035 19502 5559 1 15 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.988 -1.369 19502 5560 1 15 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.226 0.698 19502 5561 1 15 . 1 1 720 720 VAL H H 720 7.838 7.838 7.744 0.094 19502 5562 1 15 . 1 1 721 721 ARG N N 721 118.905 118.905 119.862 -0.957 19502 5563 1 15 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.985 0.194 19502 5564 1 15 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.148 -0.728 19502 5565 1 15 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.321 0.266 19502 5566 1 15 . 1 1 721 721 ARG H H 721 7.614 7.614 7.566 0.048 19502 5567 1 15 . 1 1 722 722 TYR N N 722 117.574 117.574 118.244 -0.670 19502 5568 1 15 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.398 -0.049 19502 5569 1 15 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.949 -0.884 19502 5570 1 15 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.462 0.369 19502 5571 1 15 . 1 1 722 722 TYR H H 722 7.885 7.885 7.400 0.485 19502 5572 1 15 . 1 1 723 723 LEU N N 723 120.520 120.520 117.985 2.535 19502 5573 1 15 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.042 -0.047 19502 5574 1 15 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.934 0.622 19502 5575 1 15 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.987 0.051 19502 5576 1 15 . 1 1 723 723 LEU H H 723 7.794 7.794 7.714 0.080 19502 5577 1 15 . 1 1 724 724 ASN N N 724 115.161 115.161 115.016 0.145 19502 5578 1 15 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.621 -0.009 19502 5579 1 15 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.396 -0.159 19502 5580 1 15 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.356 -0.079 19502 5581 1 15 . 1 1 724 724 ASN H H 724 8.892 8.892 7.735 1.157 19502 5582 1 15 . 1 1 725 725 THR N N 725 110.273 110.273 115.247 -4.974 19502 5583 1 15 . 1 1 725 725 THR HA H 725 4.527 4.527 4.281 0.246 19502 5584 1 15 . 1 1 725 725 THR CA C 725 62.903 62.903 64.617 -1.714 19502 5585 1 15 . 1 1 725 725 THR CB C 725 70.619 70.619 69.502 1.117 19502 5586 1 15 . 1 1 725 725 THR H H 725 7.874 7.874 7.963 -0.089 19502 5587 1 15 . 1 1 726 726 ASN N N 726 117.048 117.048 118.211 -1.163 19502 5588 1 15 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.119 0.020 19502 5589 1 15 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.826 1.012 19502 5590 1 15 . 1 1 726 726 ASN CB C 726 37.907 37.907 40.214 -2.307 19502 5591 1 15 . 1 1 726 726 ASN H H 726 8.613 8.613 7.973 0.640 19502 5592 1 15 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.350 -0.286 19502 5593 1 15 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.242 0.267 19502 5594 1 15 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.491 -1.046 19502 5595 1 15 . 1 1 728 728 VAL N N 728 118.643 118.643 118.123 0.520 19502 5596 1 15 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.633 -0.233 19502 5597 1 15 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.210 1.356 19502 5598 1 15 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.004 0.422 19502 5599 1 15 . 1 1 728 728 VAL H H 728 8.182 8.182 7.515 0.667 19502 5600 1 15 . 1 1 729 729 GLY N N 729 105.307 105.307 106.676 -1.369 19502 5601 1 15 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.858 0.792 19502 5602 1 15 . 1 1 729 729 GLY H H 729 7.297 7.297 7.916 -0.619 19502 5603 1 15 . 1 1 730 730 GLY N N 730 109.038 109.038 109.760 -0.722 19502 5604 1 15 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.880 0.812 19502 5605 1 15 . 1 1 730 730 GLY H H 730 8.080 8.080 7.445 0.635 19502 5606 1 15 . 1 1 731 731 LEU N N 731 123.822 123.822 123.673 0.149 19502 5607 1 15 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.030 0.006 19502 5608 1 15 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.381 0.215 19502 5609 1 15 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.518 0.697 19502 5610 1 15 . 1 1 731 731 LEU H H 731 8.287 8.287 8.173 0.114 19502 5611 1 15 . 1 1 732 732 LEU N N 732 118.759 118.759 119.008 -0.249 19502 5612 1 15 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.877 0.209 19502 5613 1 15 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.384 0.124 19502 5614 1 15 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.386 -0.403 19502 5615 1 15 . 1 1 732 732 LEU H H 732 8.412 8.412 8.134 0.278 19502 5616 1 15 . 1 1 733 733 GLU N N 733 121.155 121.155 119.735 1.420 19502 5617 1 15 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.976 0.297 19502 5618 1 15 . 1 1 733 733 GLU CA C 733 59.073 59.073 59.132 -0.059 19502 5619 1 15 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.081 -0.101 19502 5620 1 15 . 1 1 733 733 GLU H H 733 8.003 8.003 7.943 0.060 19502 5621 1 15 . 1 1 734 734 TYR N N 734 122.518 122.518 121.411 1.107 19502 5622 1 15 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.994 0.187 19502 5623 1 15 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.512 0.447 19502 5624 1 15 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.256 -0.412 19502 5625 1 15 . 1 1 734 734 TYR H H 734 8.419 8.419 8.333 0.086 19502 5626 1 15 . 1 1 735 735 ALA N N 735 122.353 122.353 121.514 0.839 19502 5627 1 15 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.866 -0.054 19502 5628 1 15 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.127 1.045 19502 5629 1 15 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.649 0.184 19502 5630 1 15 . 1 1 735 735 ALA H H 735 8.777 8.777 8.201 0.576 19502 5631 1 15 . 1 1 736 736 ARG N N 736 118.852 118.852 117.749 1.103 19502 5632 1 15 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.061 0.112 19502 5633 1 15 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.725 0.798 19502 5634 1 15 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.819 0.337 19502 5635 1 15 . 1 1 736 736 ARG H H 736 8.570 8.570 8.512 0.058 19502 5636 1 15 . 1 1 737 737 SER N N 737 115.125 115.125 113.259 1.866 19502 5637 1 15 . 1 1 737 737 SER HA H 737 4.149 4.149 4.387 -0.238 19502 5638 1 15 . 1 1 737 737 SER CA C 737 61.300 61.300 59.951 1.349 19502 5639 1 15 . 1 1 737 737 SER CB C 737 63.166 63.166 63.343 -0.177 19502 5640 1 15 . 1 1 737 737 SER H H 737 8.257 8.257 8.015 0.242 19502 5641 1 15 . 1 1 738 738 HIS N N 738 117.591 117.591 116.527 1.064 19502 5642 1 15 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.563 -0.223 19502 5643 1 15 . 1 1 738 738 HIS CA C 738 57.008 57.008 56.089 0.919 19502 5644 1 15 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.757 -0.227 19502 5645 1 15 . 1 1 738 738 HIS H H 738 7.300 7.300 7.737 -0.437 19502 5646 1 15 . 1 1 739 739 GLY N N 739 107.604 107.604 107.710 -0.106 19502 5647 1 15 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.969 1.162 19502 5648 1 15 . 1 1 739 739 GLY H H 739 7.638 7.638 7.931 -0.293 19502 5649 1 15 . 1 1 740 740 PHE N N 740 118.114 118.114 120.602 -2.488 19502 5650 1 15 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.449 0.738 19502 5651 1 15 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.655 -2.252 19502 5652 1 15 . 1 1 740 740 PHE CB C 740 42.982 42.982 39.916 3.066 19502 5653 1 15 . 1 1 740 740 PHE H H 740 8.138 8.138 7.680 0.458 19502 5654 1 15 . 1 1 741 741 ALA N N 741 122.577 122.577 121.031 1.546 19502 5655 1 15 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.593 0.062 19502 5656 1 15 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.704 0.567 19502 5657 1 15 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.181 -0.205 19502 5658 1 15 . 1 1 741 741 ALA H H 741 8.550 8.550 8.694 -0.144 19502 5659 1 15 . 1 1 742 742 ALA N N 742 124.016 124.016 128.417 -4.401 19502 5660 1 15 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.851 0.055 19502 5661 1 15 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.303 -0.274 19502 5662 1 15 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.616 0.744 19502 5663 1 15 . 1 1 742 742 ALA H H 742 8.511 8.511 8.655 -0.144 19502 5664 1 15 . 1 1 743 743 GLU N N 743 120.968 120.968 122.524 -1.556 19502 5665 1 15 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.637 -0.087 19502 5666 1 15 . 1 1 743 743 GLU CA C 743 54.766 54.766 55.081 -0.315 19502 5667 1 15 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.889 0.100 19502 5668 1 15 . 1 1 743 743 GLU H H 743 8.628 8.628 8.231 0.397 19502 5669 1 15 . 1 1 744 744 PHE N N 744 120.078 120.078 121.837 -1.759 19502 5670 1 15 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.983 -0.168 19502 5671 1 15 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.252 -0.081 19502 5672 1 15 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.917 0.458 19502 5673 1 15 . 1 1 744 744 PHE H H 744 8.792 8.792 8.847 -0.055 19502 5674 1 15 . 1 1 745 745 LYS N N 745 124.937 124.937 123.897 1.040 19502 5675 1 15 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.853 -0.260 19502 5676 1 15 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.362 0.708 19502 5677 1 15 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.955 -2.410 19502 5678 1 15 . 1 1 745 745 LYS H H 745 9.180 9.180 8.245 0.935 19502 5679 1 15 . 1 1 746 746 LEU N N 746 129.002 129.002 126.016 2.986 19502 5680 1 15 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.722 0.202 19502 5681 1 15 . 1 1 746 746 LEU CA C 746 54.698 54.698 55.003 -0.305 19502 5682 1 15 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.694 -1.115 19502 5683 1 15 . 1 1 746 746 LEU H H 746 8.687 8.687 8.593 0.094 19502 5684 1 15 . 1 1 747 747 VAL N N 747 131.114 131.114 127.779 3.335 19502 5685 1 15 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.867 -0.122 19502 5686 1 15 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.035 0.099 19502 5687 1 15 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.461 0.510 19502 5688 1 15 . 1 1 747 747 VAL H H 747 9.033 9.033 8.671 0.362 19502 5689 1 15 . 1 1 748 748 ASP N N 748 113.346 113.346 117.132 -3.786 19502 5690 1 15 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.867 -0.083 19502 5691 1 15 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.486 0.848 19502 5692 1 15 . 1 1 748 748 ASP CB C 748 46.191 46.191 44.152 2.039 19502 5693 1 15 . 1 1 748 748 ASP H H 748 7.426 7.426 7.555 -0.129 19502 5694 1 15 . 1 1 749 749 GLN N N 749 120.867 120.867 121.056 -0.189 19502 5695 1 15 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.830 0.240 19502 5696 1 15 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.084 -0.481 19502 5697 1 15 . 1 1 749 749 GLN CB C 749 31.923 31.923 31.548 0.375 19502 5698 1 15 . 1 1 749 749 GLN H H 749 7.647 7.647 8.429 -0.782 19502 5699 1 15 . 1 1 750 750 SER N N 750 119.661 119.661 122.413 -2.752 19502 5700 1 15 . 1 1 750 750 SER HA H 750 4.791 4.791 4.621 0.170 19502 5701 1 15 . 1 1 750 750 SER CA C 750 57.575 57.575 57.391 0.184 19502 5702 1 15 . 1 1 750 750 SER CB C 750 65.910 65.910 62.481 3.429 19502 5703 1 15 . 1 1 750 750 SER H H 750 8.891 8.891 8.281 0.610 19502 5704 1 15 . 1 1 751 751 GLY N N 751 106.531 106.531 110.840 -4.309 19502 5705 1 15 . 1 1 751 751 GLY CA C 751 44.214 44.214 43.525 0.689 19502 5706 1 15 . 1 1 751 751 GLY H H 751 8.183 8.183 7.368 0.815 19502 5707 1 15 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.597 0.251 19502 5708 1 15 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.350 0.188 19502 5709 1 15 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.645 0.253 19502 5710 1 15 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.215 0.011 19502 5711 1 15 . 1 1 753 753 PRO CA C 753 65.345 65.345 65.013 0.332 19502 5712 1 15 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.443 0.464 19502 5713 1 15 . 1 1 754 754 HIS N N 754 109.780 109.780 112.651 -2.871 19502 5714 1 15 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.812 -0.054 19502 5715 1 15 . 1 1 754 754 HIS CA C 754 56.229 56.229 55.980 0.249 19502 5716 1 15 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.027 0.467 19502 5717 1 15 . 1 1 754 754 HIS H H 754 7.707 7.707 8.355 -0.648 19502 5718 1 15 . 1 1 755 755 GLU N N 755 122.843 122.843 120.758 2.085 19502 5719 1 15 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.772 -0.160 19502 5720 1 15 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.472 1.177 19502 5721 1 15 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.764 -0.951 19502 5722 1 15 . 1 1 755 755 GLU H H 755 7.404 7.404 7.461 -0.057 19502 5723 1 15 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.206 0.411 19502 5724 1 15 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.670 0.446 19502 5725 1 15 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.440 1.811 19502 5726 1 15 . 1 1 757 757 LYS N N 757 119.032 119.032 124.296 -5.264 19502 5727 1 15 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.487 0.117 19502 5728 1 15 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.318 0.326 19502 5729 1 15 . 1 1 757 757 LYS CB C 757 35.196 35.196 34.202 0.994 19502 5730 1 15 . 1 1 757 757 LYS H H 757 8.195 8.195 7.600 0.595 19502 5731 1 15 . 1 1 758 758 PHE N N 758 120.288 120.288 125.770 -5.482 19502 5732 1 15 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.664 0.376 19502 5733 1 15 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.035 -0.218 19502 5734 1 15 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.340 1.960 19502 5735 1 15 . 1 1 758 758 PHE H H 758 8.844 8.844 9.387 -0.543 19502 5736 1 15 . 1 1 759 759 VAL N N 759 121.385 121.385 124.747 -3.362 19502 5737 1 15 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.708 0.684 19502 5738 1 15 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.945 -1.295 19502 5739 1 15 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.492 1.746 19502 5740 1 15 . 1 1 759 759 VAL H H 759 8.609 8.609 9.067 -0.458 19502 5741 1 15 . 1 1 760 760 TYR N N 760 126.374 126.374 128.613 -2.239 19502 5742 1 15 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.016 0.781 19502 5743 1 15 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.479 -0.559 19502 5744 1 15 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.199 4.654 19502 5745 1 15 . 1 1 760 760 TYR H H 760 8.903 8.903 8.787 0.116 19502 5746 1 15 . 1 1 761 761 GLN N N 761 115.228 115.228 122.347 -7.119 19502 5747 1 15 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.685 -0.861 19502 5748 1 15 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.700 1.826 19502 5749 1 15 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.781 -0.462 19502 5750 1 15 . 1 1 761 761 GLN H H 761 9.016 9.016 8.353 0.663 19502 5751 1 15 . 1 1 762 762 ALA N N 762 128.023 128.023 129.516 -1.493 19502 5752 1 15 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.896 0.285 19502 5753 1 15 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.302 0.573 19502 5754 1 15 . 1 1 762 762 ALA CB C 762 20.151 20.151 20.123 0.028 19502 5755 1 15 . 1 1 762 762 ALA H H 762 9.500 9.500 8.380 1.120 19502 5756 1 15 . 1 1 763 763 LYS N N 763 122.022 122.022 126.604 -4.582 19502 5757 1 15 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.383 0.481 19502 5758 1 15 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.745 0.400 19502 5759 1 15 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.353 3.103 19502 5760 1 15 . 1 1 763 763 LYS H H 763 8.347 8.347 8.568 -0.221 19502 5761 1 15 . 1 1 764 764 VAL N N 764 123.980 123.980 127.727 -3.747 19502 5762 1 15 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.165 0.462 19502 5763 1 15 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.645 0.321 19502 5764 1 15 . 1 1 764 764 VAL CB C 764 34.820 34.820 29.928 4.892 19502 5765 1 15 . 1 1 764 764 VAL H H 764 8.703 8.703 8.365 0.338 19502 5766 1 15 . 1 1 765 765 GLY N N 765 119.292 119.292 117.232 2.060 19502 5767 1 15 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.591 0.032 19502 5768 1 15 . 1 1 765 765 GLY H H 765 9.151 9.151 8.991 0.160 19502 5769 1 15 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.708 0.482 19502 5770 1 15 . 1 1 767 767 ARG N N 767 119.571 119.571 124.253 -4.682 19502 5771 1 15 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.337 0.056 19502 5772 1 15 . 1 1 767 767 ARG CA C 767 55.349 55.349 55.084 0.265 19502 5773 1 15 . 1 1 767 767 ARG CB C 767 32.319 32.319 30.152 2.167 19502 5774 1 15 . 1 1 767 767 ARG H H 767 7.595 7.595 7.552 0.043 19502 5775 1 15 . 1 1 768 768 TRP N N 768 122.976 122.976 127.670 -4.694 19502 5776 1 15 . 1 1 768 768 TRP HA H 768 4.570 4.570 4.945 -0.375 19502 5777 1 15 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.263 0.203 19502 5778 1 15 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.086 1.132 19502 5779 1 15 . 1 1 768 768 TRP H H 768 8.056 8.056 8.601 -0.545 19502 5780 1 15 . 1 1 769 769 PHE N N 769 116.997 116.997 123.550 -6.553 19502 5781 1 15 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.800 -0.050 19502 5782 1 15 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.503 2.226 19502 5783 1 15 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.221 -0.924 19502 5784 1 15 . 1 1 769 769 PHE H H 769 7.532 7.532 8.819 -1.287 19502 5785 1 15 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.749 -0.025 19502 5786 1 15 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.647 2.652 19502 5787 1 15 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.721 0.054 19502 5788 1 15 . 1 1 771 771 ALA N N 771 125.979 125.979 121.282 4.697 19502 5789 1 15 . 1 1 771 771 ALA HA H 771 5.234 5.234 4.983 0.251 19502 5790 1 15 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.688 -0.046 19502 5791 1 15 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.449 0.206 19502 5792 1 15 . 1 1 771 771 ALA H H 771 9.069 9.069 8.286 0.783 19502 5793 1 15 . 1 1 772 772 VAL N N 772 113.901 113.901 118.197 -4.296 19502 5794 1 15 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.668 0.143 19502 5795 1 15 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.327 -0.178 19502 5796 1 15 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.133 0.113 19502 5797 1 15 . 1 1 772 772 VAL H H 772 9.024 9.024 9.062 -0.038 19502 5798 1 15 . 1 1 773 773 CYS N N 773 119.222 119.222 117.923 1.299 19502 5799 1 15 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.689 -0.082 19502 5800 1 15 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.260 0.498 19502 5801 1 15 . 1 1 773 773 CYS CB C 773 29.841 29.841 29.946 -0.105 19502 5802 1 15 . 1 1 773 773 CYS H H 773 8.597 8.597 8.272 0.325 19502 5803 1 15 . 1 1 774 774 ALA N N 774 124.328 124.328 127.267 -2.939 19502 5804 1 15 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.777 0.026 19502 5805 1 15 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.622 0.609 19502 5806 1 15 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.857 2.268 19502 5807 1 15 . 1 1 774 774 ALA H H 774 9.238 9.238 8.829 0.409 19502 5808 1 15 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.591 0.665 19502 5809 1 15 . 1 1 775 775 HIS CA C 775 56.529 56.529 56.479 0.050 19502 5810 1 15 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.207 -0.074 19502 5811 1 15 . 1 1 776 776 SER N N 776 110.366 110.366 114.101 -3.735 19502 5812 1 15 . 1 1 776 776 SER HA H 776 4.766 4.766 4.717 0.049 19502 5813 1 15 . 1 1 776 776 SER CA C 776 57.029 57.029 56.959 0.070 19502 5814 1 15 . 1 1 776 776 SER H H 776 7.550 7.550 7.443 0.107 19502 5815 1 15 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.741 -0.154 19502 5816 1 15 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.877 0.559 19502 5817 1 15 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.122 0.082 19502 5818 1 15 . 1 1 778 778 LYS N N 778 118.469 118.469 118.912 -0.443 19502 5819 1 15 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.880 -0.116 19502 5820 1 15 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.983 0.929 19502 5821 1 15 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.961 1.724 19502 5822 1 15 . 1 1 778 778 LYS H H 778 8.151 8.151 8.195 -0.044 19502 5823 1 15 . 1 1 779 779 GLN N N 779 117.975 117.975 116.994 0.981 19502 5824 1 15 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.984 0.029 19502 5825 1 15 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.658 -0.749 19502 5826 1 15 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.252 0.308 19502 5827 1 15 . 1 1 779 779 GLN H H 779 7.773 7.773 8.440 -0.667 19502 5828 1 15 . 1 1 780 780 GLY N N 780 108.214 108.214 108.175 0.039 19502 5829 1 15 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.036 0.975 19502 5830 1 15 . 1 1 780 780 GLY H H 780 8.273 8.273 8.267 0.006 19502 5831 1 15 . 1 1 781 781 LYS N N 781 120.027 120.027 121.704 -1.677 19502 5832 1 15 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.659 -0.570 19502 5833 1 15 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.544 0.814 19502 5834 1 15 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.753 -0.067 19502 5835 1 15 . 1 1 781 781 LYS H H 781 7.307 7.307 7.149 0.158 19502 5836 1 15 . 1 1 782 782 GLN N N 782 117.131 117.131 118.618 -1.487 19502 5837 1 15 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.848 -0.080 19502 5838 1 15 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.274 0.521 19502 5839 1 15 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.621 -0.068 19502 5840 1 15 . 1 1 782 782 GLN H H 782 7.227 7.227 7.599 -0.372 19502 5841 1 15 . 1 1 783 783 GLU N N 783 117.958 117.958 119.401 -1.443 19502 5842 1 15 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.028 0.175 19502 5843 1 15 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.221 -0.257 19502 5844 1 15 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.196 -0.237 19502 5845 1 15 . 1 1 783 783 GLU H H 783 8.896 8.896 8.750 0.146 19502 5846 1 15 . 1 1 784 784 ALA N N 784 124.176 124.176 122.535 1.641 19502 5847 1 15 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.056 0.078 19502 5848 1 15 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.389 -0.174 19502 5849 1 15 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.475 -0.878 19502 5850 1 15 . 1 1 784 784 ALA H H 784 8.532 8.532 8.053 0.479 19502 5851 1 15 . 1 1 785 785 ALA N N 785 121.847 121.847 120.535 1.312 19502 5852 1 15 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.001 0.041 19502 5853 1 15 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.189 -0.020 19502 5854 1 15 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.477 -0.085 19502 5855 1 15 . 1 1 785 785 ALA H H 785 8.402 8.402 8.103 0.299 19502 5856 1 15 . 1 1 786 786 ASP N N 786 120.625 120.625 120.166 0.459 19502 5857 1 15 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.216 -0.064 19502 5858 1 15 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.914 0.257 19502 5859 1 15 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.747 1.769 19502 5860 1 15 . 1 1 786 786 ASP H H 786 8.524 8.524 8.543 -0.019 19502 5861 1 15 . 1 1 787 787 ALA N N 787 118.408 118.408 121.046 -2.638 19502 5862 1 15 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.108 -0.132 19502 5863 1 15 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.963 0.153 19502 5864 1 15 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.298 -0.028 19502 5865 1 15 . 1 1 787 787 ALA H H 787 8.191 8.191 8.144 0.047 19502 5866 1 15 . 1 1 788 788 ALA N N 788 118.510 118.510 121.851 -3.341 19502 5867 1 15 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.041 -0.337 19502 5868 1 15 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.948 -0.055 19502 5869 1 15 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.922 0.651 19502 5870 1 15 . 1 1 788 788 ALA H H 788 7.533 7.533 7.886 -0.353 19502 5871 1 15 . 1 1 789 789 LEU N N 789 117.413 117.413 118.283 -0.870 19502 5872 1 15 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.802 -0.112 19502 5873 1 15 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.663 0.517 19502 5874 1 15 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.263 0.841 19502 5875 1 15 . 1 1 789 789 LEU H H 789 8.520 8.520 8.219 0.301 19502 5876 1 15 . 1 1 790 790 ARG N N 790 116.360 116.360 119.111 -2.751 19502 5877 1 15 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.046 -0.128 19502 5878 1 15 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.469 2.334 19502 5879 1 15 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.160 0.601 19502 5880 1 15 . 1 1 790 790 ARG H H 790 8.293 8.293 7.947 0.346 19502 5881 1 15 . 1 1 791 791 VAL N N 791 120.700 120.700 120.244 0.456 19502 5882 1 15 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.713 0.199 19502 5883 1 15 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.209 0.275 19502 5884 1 15 . 1 1 791 791 VAL CB C 791 31.736 31.736 30.974 0.763 19502 5885 1 15 . 1 1 791 791 VAL H H 791 7.455 7.455 8.009 -0.554 19502 5886 1 15 . 1 1 792 792 LEU N N 792 120.706 120.706 120.002 0.704 19502 5887 1 15 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.880 0.152 19502 5888 1 15 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.103 -0.236 19502 5889 1 15 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.192 1.055 19502 5890 1 15 . 1 1 792 792 LEU H H 792 8.007 8.007 7.663 0.344 19502 5891 1 15 . 1 1 793 793 ILE N N 793 118.876 118.876 118.596 0.280 19502 5892 1 15 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.646 0.083 19502 5893 1 15 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.380 -0.380 19502 5894 1 15 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.397 1.558 19502 5895 1 15 . 1 1 793 793 ILE H H 793 8.778 8.778 8.719 0.059 19502 5896 1 15 . 1 1 794 794 GLY N N 794 107.008 107.008 107.758 -0.750 19502 5897 1 15 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.117 -0.484 19502 5898 1 15 . 1 1 794 794 GLY H H 794 7.810 7.810 8.248 -0.438 19502 5899 1 15 . 1 1 795 795 GLU N N 795 119.866 119.866 121.968 -2.102 19502 5900 1 15 . 1 1 795 795 GLU HA H 795 4.356 4.356 3.863 0.493 19502 5901 1 15 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.654 -1.950 19502 5902 1 15 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.535 0.545 19502 5903 1 15 . 1 1 795 795 GLU H H 795 7.978 7.978 8.445 -0.467 19502 5904 1 15 . 1 1 796 796 ASN N N 796 118.365 118.365 117.457 0.908 19502 5905 1 15 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.468 0.314 19502 5906 1 15 . 1 1 796 796 ASN CA C 796 54.582 54.582 56.012 -1.430 19502 5907 1 15 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.739 1.306 19502 5908 1 15 . 1 1 796 796 ASN H H 796 8.053 8.053 8.036 0.017 19502 5909 1 15 . 1 1 797 797 GLU N N 797 120.368 120.368 120.609 -0.241 19502 5910 1 15 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.081 0.255 19502 5911 1 15 . 1 1 797 797 GLU CA C 797 57.624 57.624 59.003 -1.379 19502 5912 1 15 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.530 0.812 19502 5913 1 15 . 1 1 797 797 GLU H H 797 8.225 8.225 7.992 0.233 19502 5914 1 15 . 1 1 798 798 LYS N N 798 120.614 120.614 118.706 1.908 19502 5915 1 15 . 1 1 798 798 LYS H H 798 8.088 8.088 8.315 -0.227 19502 5916 1 15 . 1 1 799 799 ALA N N 799 124.642 124.642 121.821 2.821 19502 5917 1 15 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.189 0.252 19502 5918 1 15 . 1 1 799 799 ALA CA C 799 52.692 52.692 54.191 -1.499 19502 5919 1 15 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.078 0.539 19502 5920 1 15 . 1 1 799 799 ALA H H 799 8.138 8.138 7.743 0.395 19502 5921 1 15 . 1 1 800 800 GLU N N 800 120.408 120.408 115.210 5.198 19502 5922 1 15 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.400 -0.005 19502 5923 1 15 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.088 0.722 19502 5924 1 15 . 1 1 800 800 GLU CB C 800 30.604 30.604 30.846 -0.242 19502 5925 1 15 . 1 1 800 800 GLU H H 800 8.337 8.337 8.147 0.190 19502 5926 1 16 . 1 1 713 713 VAL N N 713 120.649 120.649 119.902 0.747 19502 5927 1 16 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.361 -0.241 19502 5928 1 16 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.284 1.725 19502 5929 1 16 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.468 -0.721 19502 5930 1 16 . 1 1 713 713 VAL H H 713 8.051 8.051 8.008 0.043 19502 5931 1 16 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.304 0.177 19502 5932 1 16 . 1 1 715 715 LYS CA C 715 56.754 56.754 56.848 -0.094 19502 5933 1 16 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.124 0.891 19502 5934 1 16 . 1 1 716 716 ILE N N 716 121.593 121.593 127.762 -6.169 19502 5935 1 16 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.056 0.043 19502 5936 1 16 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.517 1.312 19502 5937 1 16 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.006 1.160 19502 5938 1 16 . 1 1 716 716 ILE H H 716 8.406 8.406 8.616 -0.210 19502 5939 1 16 . 1 1 717 717 GLY N N 717 108.628 108.628 107.975 0.653 19502 5940 1 16 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.056 -0.382 19502 5941 1 16 . 1 1 717 717 GLY H H 717 8.476 8.476 8.731 -0.255 19502 5942 1 16 . 1 1 718 718 GLU N N 718 119.944 119.944 121.139 -1.195 19502 5943 1 16 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.179 0.098 19502 5944 1 16 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.489 -0.302 19502 5945 1 16 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.100 0.937 19502 5946 1 16 . 1 1 718 718 GLU H H 718 8.055 8.055 7.723 0.332 19502 5947 1 16 . 1 1 719 719 LEU N N 719 118.538 118.538 119.583 -1.045 19502 5948 1 16 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.365 0.013 19502 5949 1 16 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.532 0.810 19502 5950 1 16 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.715 1.325 19502 5951 1 16 . 1 1 719 719 LEU H H 719 8.098 8.098 7.719 0.379 19502 5952 1 16 . 1 1 720 720 VAL N N 720 117.613 117.613 119.139 -1.526 19502 5953 1 16 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.628 0.076 19502 5954 1 16 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.830 -1.211 19502 5955 1 16 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.270 0.654 19502 5956 1 16 . 1 1 720 720 VAL H H 720 7.838 7.838 7.878 -0.040 19502 5957 1 16 . 1 1 721 721 ARG N N 721 118.905 118.905 119.083 -0.178 19502 5958 1 16 . 1 1 721 721 ARG HA H 721 4.179 4.179 4.181 -0.002 19502 5959 1 16 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.105 -0.685 19502 5960 1 16 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.638 -0.051 19502 5961 1 16 . 1 1 721 721 ARG H H 721 7.614 7.614 7.517 0.097 19502 5962 1 16 . 1 1 722 722 TYR N N 722 117.574 117.574 117.117 0.457 19502 5963 1 16 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.336 0.013 19502 5964 1 16 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.098 -0.033 19502 5965 1 16 . 1 1 722 722 TYR CB C 722 38.831 38.831 37.954 0.877 19502 5966 1 16 . 1 1 722 722 TYR H H 722 7.885 7.885 7.222 0.663 19502 5967 1 16 . 1 1 723 723 LEU N N 723 120.520 120.520 117.654 2.866 19502 5968 1 16 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.080 -0.085 19502 5969 1 16 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.489 1.065 19502 5970 1 16 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.597 0.441 19502 5971 1 16 . 1 1 723 723 LEU H H 723 7.794 7.794 7.550 0.244 19502 5972 1 16 . 1 1 724 724 ASN N N 724 115.161 115.161 117.005 -1.844 19502 5973 1 16 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.666 -0.054 19502 5974 1 16 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.602 -0.365 19502 5975 1 16 . 1 1 724 724 ASN CB C 724 39.277 39.277 38.857 0.420 19502 5976 1 16 . 1 1 724 724 ASN H H 724 8.892 8.892 7.812 1.080 19502 5977 1 16 . 1 1 725 725 THR N N 725 110.273 110.273 114.857 -4.584 19502 5978 1 16 . 1 1 725 725 THR HA H 725 4.527 4.527 4.300 0.227 19502 5979 1 16 . 1 1 725 725 THR CA C 725 62.903 62.903 65.140 -2.237 19502 5980 1 16 . 1 1 725 725 THR CB C 725 70.619 70.619 69.585 1.034 19502 5981 1 16 . 1 1 725 725 THR H H 725 7.874 7.874 8.296 -0.422 19502 5982 1 16 . 1 1 726 726 ASN N N 726 117.048 117.048 117.647 -0.599 19502 5983 1 16 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.224 -0.085 19502 5984 1 16 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.222 1.616 19502 5985 1 16 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.869 -1.962 19502 5986 1 16 . 1 1 726 726 ASN H H 726 8.613 8.613 8.038 0.575 19502 5987 1 16 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.381 -0.317 19502 5988 1 16 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.246 0.263 19502 5989 1 16 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.612 -1.167 19502 5990 1 16 . 1 1 728 728 VAL N N 728 118.643 118.643 118.220 0.423 19502 5991 1 16 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.673 -0.273 19502 5992 1 16 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.329 1.237 19502 5993 1 16 . 1 1 728 728 VAL CB C 728 31.426 31.426 31.010 0.416 19502 5994 1 16 . 1 1 728 728 VAL H H 728 8.182 8.182 7.624 0.558 19502 5995 1 16 . 1 1 729 729 GLY N N 729 105.307 105.307 106.929 -1.622 19502 5996 1 16 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.839 0.811 19502 5997 1 16 . 1 1 729 729 GLY H H 729 7.297 7.297 7.948 -0.651 19502 5998 1 16 . 1 1 730 730 GLY N N 730 109.038 109.038 109.353 -0.315 19502 5999 1 16 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.041 0.651 19502 6000 1 16 . 1 1 730 730 GLY H H 730 8.080 8.080 7.308 0.772 19502 6001 1 16 . 1 1 731 731 LEU N N 731 123.822 123.822 123.410 0.412 19502 6002 1 16 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.035 0.001 19502 6003 1 16 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.412 0.184 19502 6004 1 16 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.494 0.721 19502 6005 1 16 . 1 1 731 731 LEU H H 731 8.287 8.287 7.953 0.334 19502 6006 1 16 . 1 1 732 732 LEU N N 732 118.759 118.759 117.678 1.081 19502 6007 1 16 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.855 0.231 19502 6008 1 16 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.157 0.351 19502 6009 1 16 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.569 -0.586 19502 6010 1 16 . 1 1 732 732 LEU H H 732 8.412 8.412 7.929 0.483 19502 6011 1 16 . 1 1 733 733 GLU N N 733 121.155 121.155 118.938 2.217 19502 6012 1 16 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.998 0.275 19502 6013 1 16 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.678 0.395 19502 6014 1 16 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.194 -0.214 19502 6015 1 16 . 1 1 733 733 GLU H H 733 8.003 8.003 8.151 -0.148 19502 6016 1 16 . 1 1 734 734 TYR N N 734 122.518 122.518 122.972 -0.454 19502 6017 1 16 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.949 0.232 19502 6018 1 16 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.550 0.409 19502 6019 1 16 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.277 -0.433 19502 6020 1 16 . 1 1 734 734 TYR H H 734 8.419 8.419 8.371 0.048 19502 6021 1 16 . 1 1 735 735 ALA N N 735 122.353 122.353 121.197 1.156 19502 6022 1 16 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.771 0.041 19502 6023 1 16 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.838 1.334 19502 6024 1 16 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.558 0.275 19502 6025 1 16 . 1 1 735 735 ALA H H 735 8.777 8.777 7.672 1.105 19502 6026 1 16 . 1 1 736 736 ARG N N 736 118.852 118.852 117.957 0.895 19502 6027 1 16 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.016 0.157 19502 6028 1 16 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.689 0.834 19502 6029 1 16 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.748 0.408 19502 6030 1 16 . 1 1 736 736 ARG H H 736 8.570 8.570 8.083 0.487 19502 6031 1 16 . 1 1 737 737 SER N N 737 115.125 115.125 113.273 1.852 19502 6032 1 16 . 1 1 737 737 SER HA H 737 4.149 4.149 4.379 -0.230 19502 6033 1 16 . 1 1 737 737 SER CA C 737 61.300 61.300 60.401 0.899 19502 6034 1 16 . 1 1 737 737 SER CB C 737 63.166 63.166 63.906 -0.740 19502 6035 1 16 . 1 1 737 737 SER H H 737 8.257 8.257 7.991 0.266 19502 6036 1 16 . 1 1 738 738 HIS N N 738 117.591 117.591 116.858 0.733 19502 6037 1 16 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.571 -0.231 19502 6038 1 16 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.770 1.238 19502 6039 1 16 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.724 -0.194 19502 6040 1 16 . 1 1 738 738 HIS H H 738 7.300 7.300 7.645 -0.345 19502 6041 1 16 . 1 1 739 739 GLY N N 739 107.604 107.604 108.242 -0.638 19502 6042 1 16 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.151 0.980 19502 6043 1 16 . 1 1 739 739 GLY H H 739 7.638 7.638 8.003 -0.365 19502 6044 1 16 . 1 1 740 740 PHE N N 740 118.114 118.114 120.119 -2.005 19502 6045 1 16 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.530 0.657 19502 6046 1 16 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.270 -1.867 19502 6047 1 16 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.131 2.851 19502 6048 1 16 . 1 1 740 740 PHE H H 740 8.138 8.138 7.658 0.480 19502 6049 1 16 . 1 1 741 741 ALA N N 741 122.577 122.577 120.672 1.905 19502 6050 1 16 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.551 0.104 19502 6051 1 16 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.864 0.407 19502 6052 1 16 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.023 -1.047 19502 6053 1 16 . 1 1 741 741 ALA H H 741 8.550 8.550 8.584 -0.034 19502 6054 1 16 . 1 1 742 742 ALA N N 742 124.016 124.016 125.391 -1.375 19502 6055 1 16 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.892 0.014 19502 6056 1 16 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.979 0.050 19502 6057 1 16 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.278 0.082 19502 6058 1 16 . 1 1 742 742 ALA H H 742 8.511 8.511 8.419 0.092 19502 6059 1 16 . 1 1 743 743 GLU N N 743 120.968 120.968 122.700 -1.732 19502 6060 1 16 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.596 -0.046 19502 6061 1 16 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.429 0.337 19502 6062 1 16 . 1 1 743 743 GLU CB C 743 33.989 33.989 34.010 -0.021 19502 6063 1 16 . 1 1 743 743 GLU H H 743 8.628 8.628 8.270 0.358 19502 6064 1 16 . 1 1 744 744 PHE N N 744 120.078 120.078 120.191 -0.113 19502 6065 1 16 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.206 -0.391 19502 6066 1 16 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.028 0.143 19502 6067 1 16 . 1 1 744 744 PHE CB C 744 40.375 40.375 41.152 -0.777 19502 6068 1 16 . 1 1 744 744 PHE H H 744 8.792 8.792 8.761 0.031 19502 6069 1 16 . 1 1 745 745 LYS N N 745 124.937 124.937 123.721 1.216 19502 6070 1 16 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.817 -0.224 19502 6071 1 16 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.250 0.820 19502 6072 1 16 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.422 -1.877 19502 6073 1 16 . 1 1 745 745 LYS H H 745 9.180 9.180 9.053 0.127 19502 6074 1 16 . 1 1 746 746 LEU N N 746 129.002 129.002 125.488 3.514 19502 6075 1 16 . 1 1 746 746 LEU HA H 746 3.924 3.924 4.030 -0.106 19502 6076 1 16 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.261 0.437 19502 6077 1 16 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.524 -0.945 19502 6078 1 16 . 1 1 746 746 LEU H H 746 8.687 8.687 8.440 0.247 19502 6079 1 16 . 1 1 747 747 VAL N N 747 131.114 131.114 127.249 3.865 19502 6080 1 16 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.866 -0.121 19502 6081 1 16 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.673 -0.539 19502 6082 1 16 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.443 0.528 19502 6083 1 16 . 1 1 747 747 VAL H H 747 9.033 9.033 8.765 0.268 19502 6084 1 16 . 1 1 748 748 ASP N N 748 113.346 113.346 114.817 -1.471 19502 6085 1 16 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.866 -0.082 19502 6086 1 16 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.741 0.593 19502 6087 1 16 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.231 2.960 19502 6088 1 16 . 1 1 748 748 ASP H H 748 7.426 7.426 7.633 -0.207 19502 6089 1 16 . 1 1 749 749 GLN N N 749 120.867 120.867 120.096 0.771 19502 6090 1 16 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.092 -0.022 19502 6091 1 16 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.941 -0.338 19502 6092 1 16 . 1 1 749 749 GLN CB C 749 31.923 31.923 32.203 -0.280 19502 6093 1 16 . 1 1 749 749 GLN H H 749 7.647 7.647 8.425 -0.778 19502 6094 1 16 . 1 1 750 750 SER N N 750 119.661 119.661 120.996 -1.335 19502 6095 1 16 . 1 1 750 750 SER HA H 750 4.791 4.791 4.731 0.060 19502 6096 1 16 . 1 1 750 750 SER CA C 750 57.575 57.575 57.555 0.020 19502 6097 1 16 . 1 1 750 750 SER CB C 750 65.910 65.910 63.845 2.065 19502 6098 1 16 . 1 1 750 750 SER H H 750 8.891 8.891 9.072 -0.181 19502 6099 1 16 . 1 1 751 751 GLY N N 751 106.531 106.531 111.539 -5.008 19502 6100 1 16 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.143 0.071 19502 6101 1 16 . 1 1 751 751 GLY H H 751 8.183 8.183 7.872 0.311 19502 6102 1 16 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.598 0.250 19502 6103 1 16 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.386 0.152 19502 6104 1 16 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.643 0.255 19502 6105 1 16 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.226 -0.000 19502 6106 1 16 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.948 0.397 19502 6107 1 16 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.428 0.479 19502 6108 1 16 . 1 1 754 754 HIS N N 754 109.780 109.780 112.754 -2.974 19502 6109 1 16 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.746 0.012 19502 6110 1 16 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.363 -0.134 19502 6111 1 16 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.185 0.309 19502 6112 1 16 . 1 1 754 754 HIS H H 754 7.707 7.707 8.131 -0.424 19502 6113 1 16 . 1 1 755 755 GLU N N 755 122.843 122.843 120.373 2.470 19502 6114 1 16 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.765 -0.153 19502 6115 1 16 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.636 1.013 19502 6116 1 16 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.920 -1.107 19502 6117 1 16 . 1 1 755 755 GLU H H 755 7.404 7.404 7.388 0.016 19502 6118 1 16 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.163 0.454 19502 6119 1 16 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.097 1.019 19502 6120 1 16 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.360 1.891 19502 6121 1 16 . 1 1 757 757 LYS N N 757 119.032 119.032 125.586 -6.554 19502 6122 1 16 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.589 0.015 19502 6123 1 16 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.266 0.378 19502 6124 1 16 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.130 2.066 19502 6125 1 16 . 1 1 757 757 LYS H H 757 8.195 8.195 7.976 0.219 19502 6126 1 16 . 1 1 758 758 PHE N N 758 120.288 120.288 124.688 -4.400 19502 6127 1 16 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.677 0.363 19502 6128 1 16 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.036 -0.220 19502 6129 1 16 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.465 2.835 19502 6130 1 16 . 1 1 758 758 PHE H H 758 8.844 8.844 9.327 -0.483 19502 6131 1 16 . 1 1 759 759 VAL N N 759 121.385 121.385 123.610 -2.225 19502 6132 1 16 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.753 0.639 19502 6133 1 16 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.663 -1.014 19502 6134 1 16 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.012 2.226 19502 6135 1 16 . 1 1 759 759 VAL H H 759 8.609 8.609 9.150 -0.541 19502 6136 1 16 . 1 1 760 760 TYR N N 760 126.374 126.374 128.630 -2.256 19502 6137 1 16 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.247 0.550 19502 6138 1 16 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.291 -0.371 19502 6139 1 16 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.120 4.733 19502 6140 1 16 . 1 1 760 760 TYR H H 760 8.903 8.903 9.662 -0.759 19502 6141 1 16 . 1 1 761 761 GLN N N 761 115.228 115.228 122.513 -7.285 19502 6142 1 16 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.900 -1.076 19502 6143 1 16 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.490 2.035 19502 6144 1 16 . 1 1 761 761 GLN CB C 761 33.318 33.318 34.016 -0.698 19502 6145 1 16 . 1 1 761 761 GLN H H 761 9.016 9.016 9.214 -0.198 19502 6146 1 16 . 1 1 762 762 ALA N N 762 128.023 128.023 129.227 -1.204 19502 6147 1 16 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.820 0.361 19502 6148 1 16 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.355 0.520 19502 6149 1 16 . 1 1 762 762 ALA CB C 762 20.151 20.151 20.252 -0.101 19502 6150 1 16 . 1 1 762 762 ALA H H 762 9.500 9.500 8.561 0.939 19502 6151 1 16 . 1 1 763 763 LYS N N 763 122.022 122.022 126.184 -4.162 19502 6152 1 16 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.424 0.440 19502 6153 1 16 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.769 0.376 19502 6154 1 16 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.406 3.050 19502 6155 1 16 . 1 1 763 763 LYS H H 763 8.347 8.347 8.737 -0.390 19502 6156 1 16 . 1 1 764 764 VAL N N 764 123.980 123.980 128.064 -4.084 19502 6157 1 16 . 1 1 764 764 VAL HA H 764 4.627 4.627 5.137 -0.510 19502 6158 1 16 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.093 0.874 19502 6159 1 16 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.796 4.024 19502 6160 1 16 . 1 1 764 764 VAL H H 764 8.703 8.703 8.418 0.285 19502 6161 1 16 . 1 1 765 765 GLY N N 765 119.292 119.292 119.445 -0.153 19502 6162 1 16 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.202 0.421 19502 6163 1 16 . 1 1 765 765 GLY H H 765 9.151 9.151 8.813 0.338 19502 6164 1 16 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.621 0.569 19502 6165 1 16 . 1 1 767 767 ARG N N 767 119.571 119.571 120.578 -1.007 19502 6166 1 16 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.759 -0.366 19502 6167 1 16 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.680 0.669 19502 6168 1 16 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.803 -0.485 19502 6169 1 16 . 1 1 767 767 ARG H H 767 7.595 7.595 7.583 0.012 19502 6170 1 16 . 1 1 768 768 TRP N N 768 122.976 122.976 123.006 -0.030 19502 6171 1 16 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.274 -0.704 19502 6172 1 16 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.048 0.418 19502 6173 1 16 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.335 -0.117 19502 6174 1 16 . 1 1 768 768 TRP H H 768 8.056 8.056 8.806 -0.750 19502 6175 1 16 . 1 1 769 769 PHE N N 769 116.997 116.997 122.559 -5.562 19502 6176 1 16 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.841 -0.091 19502 6177 1 16 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.631 2.098 19502 6178 1 16 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.194 -0.897 19502 6179 1 16 . 1 1 769 769 PHE H H 769 7.532 7.532 8.699 -1.167 19502 6180 1 16 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.755 -0.031 19502 6181 1 16 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.785 2.514 19502 6182 1 16 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.856 -0.081 19502 6183 1 16 . 1 1 771 771 ALA N N 771 125.979 125.979 122.621 3.358 19502 6184 1 16 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.337 -0.103 19502 6185 1 16 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.712 -0.070 19502 6186 1 16 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.894 -0.239 19502 6187 1 16 . 1 1 771 771 ALA H H 771 9.069 9.069 8.180 0.889 19502 6188 1 16 . 1 1 772 772 VAL N N 772 113.901 113.901 119.345 -5.444 19502 6189 1 16 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.776 0.035 19502 6190 1 16 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.987 -0.838 19502 6191 1 16 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.308 -0.062 19502 6192 1 16 . 1 1 772 772 VAL H H 772 9.024 9.024 9.247 -0.223 19502 6193 1 16 . 1 1 773 773 CYS N N 773 119.222 119.222 121.932 -2.710 19502 6194 1 16 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.644 -0.037 19502 6195 1 16 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.381 1.377 19502 6196 1 16 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.446 1.395 19502 6197 1 16 . 1 1 773 773 CYS H H 773 8.597 8.597 8.469 0.128 19502 6198 1 16 . 1 1 774 774 ALA N N 774 124.328 124.328 127.533 -3.205 19502 6199 1 16 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.750 0.053 19502 6200 1 16 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.476 0.755 19502 6201 1 16 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.141 2.984 19502 6202 1 16 . 1 1 774 774 ALA H H 774 9.238 9.238 9.041 0.197 19502 6203 1 16 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.955 0.301 19502 6204 1 16 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.796 0.733 19502 6205 1 16 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.807 0.326 19502 6206 1 16 . 1 1 776 776 SER N N 776 110.366 110.366 113.016 -2.650 19502 6207 1 16 . 1 1 776 776 SER HA H 776 4.766 4.766 4.881 -0.116 19502 6208 1 16 . 1 1 776 776 SER CA C 776 57.029 57.029 57.075 -0.046 19502 6209 1 16 . 1 1 776 776 SER H H 776 7.550 7.550 7.504 0.046 19502 6210 1 16 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.866 -0.279 19502 6211 1 16 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.766 0.670 19502 6212 1 16 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.332 -0.128 19502 6213 1 16 . 1 1 778 778 LYS N N 778 118.469 118.469 118.425 0.044 19502 6214 1 16 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.872 -0.108 19502 6215 1 16 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.401 0.510 19502 6216 1 16 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.251 2.434 19502 6217 1 16 . 1 1 778 778 LYS H H 778 8.151 8.151 8.247 -0.096 19502 6218 1 16 . 1 1 779 779 GLN N N 779 117.975 117.975 118.751 -0.776 19502 6219 1 16 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.044 -0.031 19502 6220 1 16 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.702 -0.793 19502 6221 1 16 . 1 1 779 779 GLN CB C 779 28.560 28.560 27.889 0.671 19502 6222 1 16 . 1 1 779 779 GLN H H 779 7.773 7.773 8.313 -0.540 19502 6223 1 16 . 1 1 780 780 GLY N N 780 108.214 108.214 108.279 -0.065 19502 6224 1 16 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.056 0.955 19502 6225 1 16 . 1 1 780 780 GLY H H 780 8.273 8.273 8.456 -0.183 19502 6226 1 16 . 1 1 781 781 LYS N N 781 120.027 120.027 121.738 -1.711 19502 6227 1 16 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.553 -0.464 19502 6228 1 16 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.478 0.880 19502 6229 1 16 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.750 -0.064 19502 6230 1 16 . 1 1 781 781 LYS H H 781 7.307 7.307 7.181 0.126 19502 6231 1 16 . 1 1 782 782 GLN N N 782 117.131 117.131 118.672 -1.541 19502 6232 1 16 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.818 -0.050 19502 6233 1 16 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.391 0.404 19502 6234 1 16 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.598 -0.045 19502 6235 1 16 . 1 1 782 782 GLN H H 782 7.227 7.227 7.986 -0.759 19502 6236 1 16 . 1 1 783 783 GLU N N 783 117.958 117.958 119.264 -1.306 19502 6237 1 16 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.014 0.189 19502 6238 1 16 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.096 -0.132 19502 6239 1 16 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.122 -0.163 19502 6240 1 16 . 1 1 783 783 GLU H H 783 8.896 8.896 8.609 0.287 19502 6241 1 16 . 1 1 784 784 ALA N N 784 124.176 124.176 122.640 1.536 19502 6242 1 16 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.052 0.082 19502 6243 1 16 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.388 -0.173 19502 6244 1 16 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.429 -0.832 19502 6245 1 16 . 1 1 784 784 ALA H H 784 8.532 8.532 8.086 0.446 19502 6246 1 16 . 1 1 785 785 ALA N N 785 121.847 121.847 120.871 0.976 19502 6247 1 16 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.026 0.016 19502 6248 1 16 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.315 -0.146 19502 6249 1 16 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.235 0.158 19502 6250 1 16 . 1 1 785 785 ALA H H 785 8.402 8.402 8.326 0.076 19502 6251 1 16 . 1 1 786 786 ASP N N 786 120.625 120.625 119.995 0.630 19502 6252 1 16 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.247 -0.095 19502 6253 1 16 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.917 0.254 19502 6254 1 16 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.875 1.641 19502 6255 1 16 . 1 1 786 786 ASP H H 786 8.524 8.524 8.385 0.139 19502 6256 1 16 . 1 1 787 787 ALA N N 787 118.408 118.408 121.834 -3.426 19502 6257 1 16 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.093 -0.117 19502 6258 1 16 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.944 0.173 19502 6259 1 16 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.389 -0.118 19502 6260 1 16 . 1 1 787 787 ALA H H 787 8.191 8.191 8.261 -0.070 19502 6261 1 16 . 1 1 788 788 ALA N N 788 118.510 118.510 121.935 -3.425 19502 6262 1 16 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.093 -0.389 19502 6263 1 16 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.043 -0.150 19502 6264 1 16 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.063 0.510 19502 6265 1 16 . 1 1 788 788 ALA H H 788 7.533 7.533 8.198 -0.665 19502 6266 1 16 . 1 1 789 789 LEU N N 789 117.413 117.413 118.594 -1.181 19502 6267 1 16 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.756 -0.066 19502 6268 1 16 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.967 0.213 19502 6269 1 16 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.429 0.675 19502 6270 1 16 . 1 1 789 789 LEU H H 789 8.520 8.520 8.487 0.033 19502 6271 1 16 . 1 1 790 790 ARG N N 790 116.360 116.360 118.970 -2.610 19502 6272 1 16 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.036 -0.118 19502 6273 1 16 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.378 1.425 19502 6274 1 16 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.950 -0.189 19502 6275 1 16 . 1 1 790 790 ARG H H 790 8.293 8.293 8.095 0.198 19502 6276 1 16 . 1 1 791 791 VAL N N 791 120.700 120.700 120.922 -0.222 19502 6277 1 16 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.718 0.194 19502 6278 1 16 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.173 0.311 19502 6279 1 16 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.262 0.474 19502 6280 1 16 . 1 1 791 791 VAL H H 791 7.455 7.455 8.034 -0.579 19502 6281 1 16 . 1 1 792 792 LEU N N 792 120.706 120.706 120.282 0.424 19502 6282 1 16 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.837 0.195 19502 6283 1 16 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.247 -0.380 19502 6284 1 16 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.080 1.167 19502 6285 1 16 . 1 1 792 792 LEU H H 792 8.007 8.007 7.852 0.155 19502 6286 1 16 . 1 1 793 793 ILE N N 793 118.876 118.876 116.711 2.165 19502 6287 1 16 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.653 0.076 19502 6288 1 16 . 1 1 793 793 ILE CA C 793 65.001 65.001 64.957 0.045 19502 6289 1 16 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.712 1.242 19502 6290 1 16 . 1 1 793 793 ILE H H 793 8.778 8.778 8.627 0.151 19502 6291 1 16 . 1 1 794 794 GLY N N 794 107.008 107.008 105.104 1.904 19502 6292 1 16 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.225 0.408 19502 6293 1 16 . 1 1 794 794 GLY H H 794 7.810 7.810 7.741 0.069 19502 6294 1 16 . 1 1 795 795 GLU N N 795 119.866 119.866 121.448 -1.582 19502 6295 1 16 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.171 0.185 19502 6296 1 16 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.498 -0.794 19502 6297 1 16 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.746 0.334 19502 6298 1 16 . 1 1 795 795 GLU H H 795 7.978 7.978 8.074 -0.096 19502 6299 1 16 . 1 1 796 796 ASN N N 796 118.365 118.365 115.703 2.662 19502 6300 1 16 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.762 0.020 19502 6301 1 16 . 1 1 796 796 ASN CA C 796 54.582 54.582 52.821 1.761 19502 6302 1 16 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.060 0.985 19502 6303 1 16 . 1 1 796 796 ASN H H 796 8.053 8.053 7.926 0.127 19502 6304 1 16 . 1 1 797 797 GLU N N 797 120.368 120.368 121.555 -1.187 19502 6305 1 16 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.255 0.081 19502 6306 1 16 . 1 1 797 797 GLU CA C 797 57.624 57.624 57.404 0.221 19502 6307 1 16 . 1 1 797 797 GLU CB C 797 30.342 30.342 28.497 1.845 19502 6308 1 16 . 1 1 797 797 GLU H H 797 8.225 8.225 7.271 0.954 19502 6309 1 16 . 1 1 798 798 LYS N N 798 120.614 120.614 120.203 0.411 19502 6310 1 16 . 1 1 798 798 LYS H H 798 8.088 8.088 8.424 -0.336 19502 6311 1 16 . 1 1 799 799 ALA N N 799 124.642 124.642 121.400 3.242 19502 6312 1 16 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.605 -0.164 19502 6313 1 16 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.100 1.592 19502 6314 1 16 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.282 -0.665 19502 6315 1 16 . 1 1 799 799 ALA H H 799 8.138 8.138 7.604 0.534 19502 6316 1 16 . 1 1 800 800 GLU N N 800 120.408 120.408 124.427 -4.019 19502 6317 1 16 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.303 0.092 19502 6318 1 16 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.066 0.744 19502 6319 1 16 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.580 1.024 19502 6320 1 16 . 1 1 800 800 GLU H H 800 8.337 8.337 8.717 -0.380 19502 6321 1 17 . 1 1 713 713 VAL N N 713 120.649 120.649 121.147 -0.498 19502 6322 1 17 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.133 -0.013 19502 6323 1 17 . 1 1 713 713 VAL CA C 713 63.009 63.009 62.239 0.770 19502 6324 1 17 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.641 0.106 19502 6325 1 17 . 1 1 713 713 VAL H H 713 8.051 8.051 8.308 -0.257 19502 6326 1 17 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.280 0.201 19502 6327 1 17 . 1 1 715 715 LYS CA C 715 56.754 56.754 57.182 -0.428 19502 6328 1 17 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.280 0.735 19502 6329 1 17 . 1 1 716 716 ILE N N 716 121.593 121.593 123.059 -1.466 19502 6330 1 17 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.319 -0.220 19502 6331 1 17 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.430 1.399 19502 6332 1 17 . 1 1 716 716 ILE CB C 716 38.166 38.166 39.397 -1.231 19502 6333 1 17 . 1 1 716 716 ILE H H 716 8.406 8.406 8.239 0.167 19502 6334 1 17 . 1 1 717 717 GLY N N 717 108.628 108.628 109.783 -1.155 19502 6335 1 17 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.577 -0.903 19502 6336 1 17 . 1 1 717 717 GLY H H 717 8.476 8.476 8.810 -0.334 19502 6337 1 17 . 1 1 718 718 GLU N N 718 119.944 119.944 121.677 -1.733 19502 6338 1 17 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.137 0.140 19502 6339 1 17 . 1 1 718 718 GLU CA C 718 58.187 58.187 59.270 -1.083 19502 6340 1 17 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.106 0.931 19502 6341 1 17 . 1 1 718 718 GLU H H 718 8.055 8.055 8.700 -0.645 19502 6342 1 17 . 1 1 719 719 LEU N N 719 118.538 118.538 119.174 -0.636 19502 6343 1 17 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.362 0.016 19502 6344 1 17 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.150 0.192 19502 6345 1 17 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.754 1.286 19502 6346 1 17 . 1 1 719 719 LEU H H 719 8.098 8.098 7.724 0.374 19502 6347 1 17 . 1 1 720 720 VAL N N 720 117.613 117.613 119.362 -1.749 19502 6348 1 17 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.661 0.043 19502 6349 1 17 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.215 -0.596 19502 6350 1 17 . 1 1 720 720 VAL CB C 720 31.924 31.924 30.896 1.028 19502 6351 1 17 . 1 1 720 720 VAL H H 720 7.838 7.838 7.531 0.307 19502 6352 1 17 . 1 1 721 721 ARG N N 721 118.905 118.905 119.278 -0.373 19502 6353 1 17 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.947 0.232 19502 6354 1 17 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.324 -0.904 19502 6355 1 17 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.320 0.267 19502 6356 1 17 . 1 1 721 721 ARG H H 721 7.614 7.614 7.655 -0.041 19502 6357 1 17 . 1 1 722 722 TYR N N 722 117.574 117.574 118.538 -0.964 19502 6358 1 17 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.347 0.002 19502 6359 1 17 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.870 -0.805 19502 6360 1 17 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.218 0.614 19502 6361 1 17 . 1 1 722 722 TYR H H 722 7.885 7.885 7.395 0.490 19502 6362 1 17 . 1 1 723 723 LEU N N 723 120.520 120.520 117.079 3.441 19502 6363 1 17 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.100 -0.105 19502 6364 1 17 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.878 0.677 19502 6365 1 17 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.874 0.164 19502 6366 1 17 . 1 1 723 723 LEU H H 723 7.794 7.794 7.618 0.176 19502 6367 1 17 . 1 1 724 724 ASN N N 724 115.161 115.161 116.074 -0.913 19502 6368 1 17 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.683 -0.071 19502 6369 1 17 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.115 0.121 19502 6370 1 17 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.581 -0.304 19502 6371 1 17 . 1 1 724 724 ASN H H 724 8.892 8.892 7.678 1.214 19502 6372 1 17 . 1 1 725 725 THR N N 725 110.273 110.273 114.507 -4.234 19502 6373 1 17 . 1 1 725 725 THR HA H 725 4.527 4.527 4.242 0.285 19502 6374 1 17 . 1 1 725 725 THR CA C 725 62.903 62.903 65.059 -2.156 19502 6375 1 17 . 1 1 725 725 THR CB C 725 70.619 70.619 69.780 0.839 19502 6376 1 17 . 1 1 725 725 THR H H 725 7.874 7.874 8.059 -0.185 19502 6377 1 17 . 1 1 726 726 ASN N N 726 117.048 117.048 118.322 -1.274 19502 6378 1 17 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.184 -0.045 19502 6379 1 17 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.411 1.427 19502 6380 1 17 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.773 -1.865 19502 6381 1 17 . 1 1 726 726 ASN H H 726 8.613 8.613 8.155 0.458 19502 6382 1 17 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.400 -0.336 19502 6383 1 17 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.372 0.137 19502 6384 1 17 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.568 -1.123 19502 6385 1 17 . 1 1 728 728 VAL N N 728 118.643 118.643 118.603 0.040 19502 6386 1 17 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.764 -0.364 19502 6387 1 17 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.975 0.591 19502 6388 1 17 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.997 0.429 19502 6389 1 17 . 1 1 728 728 VAL H H 728 8.182 8.182 8.258 -0.076 19502 6390 1 17 . 1 1 729 729 GLY N N 729 105.307 105.307 106.726 -1.419 19502 6391 1 17 . 1 1 729 729 GLY CA C 729 47.650 47.650 47.247 0.403 19502 6392 1 17 . 1 1 729 729 GLY H H 729 7.297 7.297 8.128 -0.831 19502 6393 1 17 . 1 1 730 730 GLY N N 730 109.038 109.038 109.220 -0.182 19502 6394 1 17 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.793 0.899 19502 6395 1 17 . 1 1 730 730 GLY H H 730 8.080 8.080 7.223 0.857 19502 6396 1 17 . 1 1 731 731 LEU N N 731 123.822 123.822 123.675 0.147 19502 6397 1 17 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.022 0.014 19502 6398 1 17 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.399 0.197 19502 6399 1 17 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.483 0.732 19502 6400 1 17 . 1 1 731 731 LEU H H 731 8.287 8.287 8.105 0.182 19502 6401 1 17 . 1 1 732 732 LEU N N 732 118.759 118.759 118.045 0.714 19502 6402 1 17 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.878 0.208 19502 6403 1 17 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.323 0.185 19502 6404 1 17 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.645 -0.662 19502 6405 1 17 . 1 1 732 732 LEU H H 732 8.412 8.412 8.252 0.160 19502 6406 1 17 . 1 1 733 733 GLU N N 733 121.155 121.155 119.158 1.997 19502 6407 1 17 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.975 0.298 19502 6408 1 17 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.903 0.171 19502 6409 1 17 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.112 -0.132 19502 6410 1 17 . 1 1 733 733 GLU H H 733 8.003 8.003 7.793 0.210 19502 6411 1 17 . 1 1 734 734 TYR N N 734 122.518 122.518 123.072 -0.554 19502 6412 1 17 . 1 1 734 734 TYR HA H 734 4.181 4.181 4.039 0.142 19502 6413 1 17 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.426 0.533 19502 6414 1 17 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.314 -0.470 19502 6415 1 17 . 1 1 734 734 TYR H H 734 8.419 8.419 8.481 -0.062 19502 6416 1 17 . 1 1 735 735 ALA N N 735 122.353 122.353 121.487 0.866 19502 6417 1 17 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.749 0.063 19502 6418 1 17 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.111 1.061 19502 6419 1 17 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.538 0.295 19502 6420 1 17 . 1 1 735 735 ALA H H 735 8.777 8.777 7.905 0.872 19502 6421 1 17 . 1 1 736 736 ARG N N 736 118.852 118.852 117.984 0.868 19502 6422 1 17 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.049 0.124 19502 6423 1 17 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.695 0.828 19502 6424 1 17 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.817 0.339 19502 6425 1 17 . 1 1 736 736 ARG H H 736 8.570 8.570 8.145 0.425 19502 6426 1 17 . 1 1 737 737 SER N N 737 115.125 115.125 113.421 1.704 19502 6427 1 17 . 1 1 737 737 SER HA H 737 4.149 4.149 4.361 -0.212 19502 6428 1 17 . 1 1 737 737 SER CA C 737 61.300 61.300 60.379 0.921 19502 6429 1 17 . 1 1 737 737 SER CB C 737 63.166 63.166 63.726 -0.560 19502 6430 1 17 . 1 1 737 737 SER H H 737 8.257 8.257 8.178 0.079 19502 6431 1 17 . 1 1 738 738 HIS N N 738 117.591 117.591 116.730 0.861 19502 6432 1 17 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.542 -0.202 19502 6433 1 17 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.983 1.025 19502 6434 1 17 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.527 0.003 19502 6435 1 17 . 1 1 738 738 HIS H H 738 7.300 7.300 7.820 -0.520 19502 6436 1 17 . 1 1 739 739 GLY N N 739 107.604 107.604 107.544 0.060 19502 6437 1 17 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.022 1.109 19502 6438 1 17 . 1 1 739 739 GLY H H 739 7.638 7.638 7.962 -0.324 19502 6439 1 17 . 1 1 740 740 PHE N N 740 118.114 118.114 120.182 -2.068 19502 6440 1 17 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.549 0.638 19502 6441 1 17 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.392 -1.989 19502 6442 1 17 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.432 2.550 19502 6443 1 17 . 1 1 740 740 PHE H H 740 8.138 8.138 7.839 0.299 19502 6444 1 17 . 1 1 741 741 ALA N N 741 122.577 122.577 120.313 2.264 19502 6445 1 17 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.601 0.054 19502 6446 1 17 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.852 0.419 19502 6447 1 17 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.160 -1.184 19502 6448 1 17 . 1 1 741 741 ALA H H 741 8.550 8.550 8.676 -0.126 19502 6449 1 17 . 1 1 742 742 ALA N N 742 124.016 124.016 128.097 -4.081 19502 6450 1 17 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.675 0.231 19502 6451 1 17 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.204 -0.175 19502 6452 1 17 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.319 1.041 19502 6453 1 17 . 1 1 742 742 ALA H H 742 8.511 8.511 8.586 -0.075 19502 6454 1 17 . 1 1 743 743 GLU N N 743 120.968 120.968 124.396 -3.428 19502 6455 1 17 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.651 -0.101 19502 6456 1 17 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.877 -0.111 19502 6457 1 17 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.983 1.006 19502 6458 1 17 . 1 1 743 743 GLU H H 743 8.628 8.628 8.562 0.066 19502 6459 1 17 . 1 1 744 744 PHE N N 744 120.078 120.078 123.707 -3.629 19502 6460 1 17 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.931 -0.117 19502 6461 1 17 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.544 -0.373 19502 6462 1 17 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.220 0.155 19502 6463 1 17 . 1 1 744 744 PHE H H 744 8.792 8.792 8.907 -0.115 19502 6464 1 17 . 1 1 745 745 LYS N N 745 124.937 124.937 124.540 0.397 19502 6465 1 17 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.828 -0.235 19502 6466 1 17 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.322 0.748 19502 6467 1 17 . 1 1 745 745 LYS CB C 745 33.545 33.545 36.124 -2.579 19502 6468 1 17 . 1 1 745 745 LYS H H 745 9.180 9.180 8.354 0.826 19502 6469 1 17 . 1 1 746 746 LEU N N 746 129.002 129.002 125.671 3.331 19502 6470 1 17 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.891 0.033 19502 6471 1 17 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.544 0.154 19502 6472 1 17 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.766 -1.187 19502 6473 1 17 . 1 1 746 746 LEU H H 746 8.687 8.687 8.652 0.035 19502 6474 1 17 . 1 1 747 747 VAL N N 747 131.114 131.114 127.236 3.878 19502 6475 1 17 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.984 -0.239 19502 6476 1 17 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.145 -0.011 19502 6477 1 17 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.483 0.488 19502 6478 1 17 . 1 1 747 747 VAL H H 747 9.033 9.033 8.874 0.159 19502 6479 1 17 . 1 1 748 748 ASP N N 748 113.346 113.346 117.020 -3.674 19502 6480 1 17 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.877 -0.093 19502 6481 1 17 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.820 0.514 19502 6482 1 17 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.859 2.332 19502 6483 1 17 . 1 1 748 748 ASP H H 748 7.426 7.426 7.583 -0.157 19502 6484 1 17 . 1 1 749 749 GLN N N 749 120.867 120.867 121.234 -0.367 19502 6485 1 17 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.435 -0.365 19502 6486 1 17 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.235 0.368 19502 6487 1 17 . 1 1 749 749 GLN CB C 749 31.923 31.923 32.443 -0.520 19502 6488 1 17 . 1 1 749 749 GLN H H 749 7.647 7.647 8.463 -0.816 19502 6489 1 17 . 1 1 750 750 SER N N 750 119.661 119.661 116.376 3.285 19502 6490 1 17 . 1 1 750 750 SER HA H 750 4.791 4.791 4.734 0.057 19502 6491 1 17 . 1 1 750 750 SER CA C 750 57.575 57.575 58.611 -1.036 19502 6492 1 17 . 1 1 750 750 SER CB C 750 65.910 65.910 64.024 1.886 19502 6493 1 17 . 1 1 750 750 SER H H 750 8.891 8.891 8.673 0.218 19502 6494 1 17 . 1 1 751 751 GLY N N 751 106.531 106.531 108.175 -1.644 19502 6495 1 17 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.253 -0.039 19502 6496 1 17 . 1 1 751 751 GLY H H 751 8.183 8.183 8.012 0.171 19502 6497 1 17 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.702 0.146 19502 6498 1 17 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.104 0.434 19502 6499 1 17 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.923 -0.025 19502 6500 1 17 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.264 -0.038 19502 6501 1 17 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.773 0.572 19502 6502 1 17 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.596 0.311 19502 6503 1 17 . 1 1 754 754 HIS N N 754 109.780 109.780 113.761 -3.981 19502 6504 1 17 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.683 0.075 19502 6505 1 17 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.641 -0.412 19502 6506 1 17 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.143 0.351 19502 6507 1 17 . 1 1 754 754 HIS H H 754 7.707 7.707 8.076 -0.369 19502 6508 1 17 . 1 1 755 755 GLU N N 755 122.843 122.843 120.831 2.012 19502 6509 1 17 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.808 -0.196 19502 6510 1 17 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.555 1.094 19502 6511 1 17 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.782 0.031 19502 6512 1 17 . 1 1 755 755 GLU H H 755 7.404 7.404 7.001 0.403 19502 6513 1 17 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.130 0.487 19502 6514 1 17 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.715 0.401 19502 6515 1 17 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.905 1.346 19502 6516 1 17 . 1 1 757 757 LYS N N 757 119.032 119.032 125.569 -6.537 19502 6517 1 17 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.685 -0.081 19502 6518 1 17 . 1 1 757 757 LYS CA C 757 55.644 55.644 54.582 1.062 19502 6519 1 17 . 1 1 757 757 LYS CB C 757 35.196 35.196 34.451 0.745 19502 6520 1 17 . 1 1 757 757 LYS H H 757 8.195 8.195 8.328 -0.133 19502 6521 1 17 . 1 1 758 758 PHE N N 758 120.288 120.288 125.672 -5.384 19502 6522 1 17 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.780 0.260 19502 6523 1 17 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.240 0.576 19502 6524 1 17 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.250 2.050 19502 6525 1 17 . 1 1 758 758 PHE H H 758 8.844 8.844 9.190 -0.346 19502 6526 1 17 . 1 1 759 759 VAL N N 759 121.385 121.385 124.550 -3.165 19502 6527 1 17 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.700 0.692 19502 6528 1 17 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.138 -1.488 19502 6529 1 17 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.323 1.915 19502 6530 1 17 . 1 1 759 759 VAL H H 759 8.609 8.609 9.287 -0.678 19502 6531 1 17 . 1 1 760 760 TYR N N 760 126.374 126.374 128.770 -2.396 19502 6532 1 17 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.250 0.547 19502 6533 1 17 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.246 -0.327 19502 6534 1 17 . 1 1 760 760 TYR CB C 760 46.853 46.853 41.202 5.651 19502 6535 1 17 . 1 1 760 760 TYR H H 760 8.903 8.903 9.395 -0.492 19502 6536 1 17 . 1 1 761 761 GLN N N 761 115.228 115.228 122.460 -7.232 19502 6537 1 17 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.775 -0.951 19502 6538 1 17 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.505 2.021 19502 6539 1 17 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.886 -0.569 19502 6540 1 17 . 1 1 761 761 GLN H H 761 9.016 9.016 8.700 0.316 19502 6541 1 17 . 1 1 762 762 ALA N N 762 128.023 128.023 129.276 -1.253 19502 6542 1 17 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.601 0.580 19502 6543 1 17 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.572 0.303 19502 6544 1 17 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.611 0.539 19502 6545 1 17 . 1 1 762 762 ALA H H 762 9.500 9.500 8.717 0.783 19502 6546 1 17 . 1 1 763 763 LYS N N 763 122.022 122.022 127.428 -5.406 19502 6547 1 17 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.573 0.291 19502 6548 1 17 . 1 1 763 763 LYS CA C 763 55.145 55.145 55.036 0.109 19502 6549 1 17 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.027 3.429 19502 6550 1 17 . 1 1 763 763 LYS H H 763 8.347 8.347 8.863 -0.516 19502 6551 1 17 . 1 1 764 764 VAL N N 764 123.980 123.980 128.151 -4.171 19502 6552 1 17 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.693 -0.066 19502 6553 1 17 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.513 0.453 19502 6554 1 17 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.194 4.626 19502 6555 1 17 . 1 1 764 764 VAL H H 764 8.703 8.703 7.985 0.718 19502 6556 1 17 . 1 1 765 765 GLY N N 765 119.292 119.292 118.043 1.249 19502 6557 1 17 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.352 0.271 19502 6558 1 17 . 1 1 765 765 GLY H H 765 9.151 9.151 9.178 -0.027 19502 6559 1 17 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.349 0.841 19502 6560 1 17 . 1 1 767 767 ARG N N 767 119.571 119.571 119.937 -0.366 19502 6561 1 17 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.673 -0.280 19502 6562 1 17 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.586 0.763 19502 6563 1 17 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.721 -0.402 19502 6564 1 17 . 1 1 767 767 ARG H H 767 7.595 7.595 7.539 0.056 19502 6565 1 17 . 1 1 768 768 TRP N N 768 122.976 122.976 121.263 1.713 19502 6566 1 17 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.043 -0.473 19502 6567 1 17 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.135 0.331 19502 6568 1 17 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.448 -0.230 19502 6569 1 17 . 1 1 768 768 TRP H H 768 8.056 8.056 8.653 -0.597 19502 6570 1 17 . 1 1 769 769 PHE N N 769 116.997 116.997 122.758 -5.761 19502 6571 1 17 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.810 -0.060 19502 6572 1 17 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.777 1.952 19502 6573 1 17 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.181 -0.884 19502 6574 1 17 . 1 1 769 769 PHE H H 769 7.532 7.532 8.836 -1.304 19502 6575 1 17 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.749 -0.025 19502 6576 1 17 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.734 2.565 19502 6577 1 17 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.848 -0.073 19502 6578 1 17 . 1 1 771 771 ALA N N 771 125.979 125.979 122.184 3.795 19502 6579 1 17 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.319 -0.085 19502 6580 1 17 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.422 0.220 19502 6581 1 17 . 1 1 771 771 ALA CB C 771 19.655 19.655 20.235 -0.580 19502 6582 1 17 . 1 1 771 771 ALA H H 771 9.069 9.069 8.114 0.955 19502 6583 1 17 . 1 1 772 772 VAL N N 772 113.901 113.901 118.172 -4.271 19502 6584 1 17 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.841 -0.030 19502 6585 1 17 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.893 -0.744 19502 6586 1 17 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.938 0.307 19502 6587 1 17 . 1 1 772 772 VAL H H 772 9.024 9.024 9.350 -0.326 19502 6588 1 17 . 1 1 773 773 CYS N N 773 119.222 119.222 123.038 -3.816 19502 6589 1 17 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.128 0.479 19502 6590 1 17 . 1 1 773 773 CYS CA C 773 56.758 56.758 55.911 0.847 19502 6591 1 17 . 1 1 773 773 CYS CB C 773 29.841 29.841 25.847 3.994 19502 6592 1 17 . 1 1 773 773 CYS H H 773 8.597 8.597 8.785 -0.188 19502 6593 1 17 . 1 1 774 774 ALA N N 774 124.328 124.328 127.771 -3.443 19502 6594 1 17 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.959 -0.156 19502 6595 1 17 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.906 0.325 19502 6596 1 17 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.961 2.164 19502 6597 1 17 . 1 1 774 774 ALA H H 774 9.238 9.238 9.087 0.151 19502 6598 1 17 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.514 -0.258 19502 6599 1 17 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.356 1.173 19502 6600 1 17 . 1 1 775 775 HIS CB C 775 30.133 30.133 31.754 -1.621 19502 6601 1 17 . 1 1 776 776 SER N N 776 110.366 110.366 113.517 -3.151 19502 6602 1 17 . 1 1 776 776 SER HA H 776 4.766 4.766 4.644 0.122 19502 6603 1 17 . 1 1 776 776 SER CA C 776 57.029 57.029 57.276 -0.247 19502 6604 1 17 . 1 1 776 776 SER H H 776 7.550 7.550 7.760 -0.210 19502 6605 1 17 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.614 -0.027 19502 6606 1 17 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.305 1.131 19502 6607 1 17 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.175 0.028 19502 6608 1 17 . 1 1 778 778 LYS N N 778 118.469 118.469 119.273 -0.804 19502 6609 1 17 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.900 -0.136 19502 6610 1 17 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.038 0.873 19502 6611 1 17 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.729 1.956 19502 6612 1 17 . 1 1 778 778 LYS H H 778 8.151 8.151 7.667 0.484 19502 6613 1 17 . 1 1 779 779 GLN N N 779 117.975 117.975 116.634 1.341 19502 6614 1 17 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.024 -0.011 19502 6615 1 17 . 1 1 779 779 GLN CA C 779 57.909 57.909 59.072 -1.163 19502 6616 1 17 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.500 0.060 19502 6617 1 17 . 1 1 779 779 GLN H H 779 7.773 7.773 8.286 -0.513 19502 6618 1 17 . 1 1 780 780 GLY N N 780 108.214 108.214 108.128 0.086 19502 6619 1 17 . 1 1 780 780 GLY CA C 780 48.011 48.011 46.945 1.066 19502 6620 1 17 . 1 1 780 780 GLY H H 780 8.273 8.273 8.273 0.000 19502 6621 1 17 . 1 1 781 781 LYS N N 781 120.027 120.027 121.609 -1.582 19502 6622 1 17 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.750 -0.661 19502 6623 1 17 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.676 0.682 19502 6624 1 17 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.894 -0.208 19502 6625 1 17 . 1 1 781 781 LYS H H 781 7.307 7.307 7.671 -0.364 19502 6626 1 17 . 1 1 782 782 GLN N N 782 117.131 117.131 118.852 -1.721 19502 6627 1 17 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.920 -0.152 19502 6628 1 17 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.361 0.434 19502 6629 1 17 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.686 -0.133 19502 6630 1 17 . 1 1 782 782 GLN H H 782 7.227 7.227 7.532 -0.305 19502 6631 1 17 . 1 1 783 783 GLU N N 783 117.958 117.958 119.261 -1.303 19502 6632 1 17 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.059 0.144 19502 6633 1 17 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.971 -0.007 19502 6634 1 17 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.047 -0.088 19502 6635 1 17 . 1 1 783 783 GLU H H 783 8.896 8.896 8.598 0.298 19502 6636 1 17 . 1 1 784 784 ALA N N 784 124.176 124.176 122.735 1.441 19502 6637 1 17 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.054 0.080 19502 6638 1 17 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.424 -0.209 19502 6639 1 17 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.440 -0.843 19502 6640 1 17 . 1 1 784 784 ALA H H 784 8.532 8.532 8.163 0.369 19502 6641 1 17 . 1 1 785 785 ALA N N 785 121.847 121.847 120.757 1.090 19502 6642 1 17 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.954 0.088 19502 6643 1 17 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.125 0.044 19502 6644 1 17 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.514 -0.121 19502 6645 1 17 . 1 1 785 785 ALA H H 785 8.402 8.402 8.211 0.191 19502 6646 1 17 . 1 1 786 786 ASP N N 786 120.625 120.625 120.263 0.362 19502 6647 1 17 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.226 -0.074 19502 6648 1 17 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.885 0.286 19502 6649 1 17 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.738 1.778 19502 6650 1 17 . 1 1 786 786 ASP H H 786 8.524 8.524 8.534 -0.010 19502 6651 1 17 . 1 1 787 787 ALA N N 787 118.408 118.408 121.188 -2.780 19502 6652 1 17 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.104 -0.128 19502 6653 1 17 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.971 0.145 19502 6654 1 17 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.321 -0.051 19502 6655 1 17 . 1 1 787 787 ALA H H 787 8.191 8.191 8.175 0.016 19502 6656 1 17 . 1 1 788 788 ALA N N 788 118.510 118.510 122.025 -3.515 19502 6657 1 17 . 1 1 788 788 ALA HA H 788 3.704 3.704 3.978 -0.274 19502 6658 1 17 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.033 -0.140 19502 6659 1 17 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.959 0.614 19502 6660 1 17 . 1 1 788 788 ALA H H 788 7.533 7.533 8.040 -0.507 19502 6661 1 17 . 1 1 789 789 LEU N N 789 117.413 117.413 118.222 -0.809 19502 6662 1 17 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.715 -0.025 19502 6663 1 17 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.828 0.352 19502 6664 1 17 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.350 0.754 19502 6665 1 17 . 1 1 789 789 LEU H H 789 8.520 8.520 8.327 0.193 19502 6666 1 17 . 1 1 790 790 ARG N N 790 116.360 116.360 118.597 -2.237 19502 6667 1 17 . 1 1 790 790 ARG HA H 790 3.918 3.918 3.963 -0.045 19502 6668 1 17 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.729 1.074 19502 6669 1 17 . 1 1 790 790 ARG CB C 790 29.761 29.761 30.064 -0.303 19502 6670 1 17 . 1 1 790 790 ARG H H 790 8.293 8.293 7.767 0.526 19502 6671 1 17 . 1 1 791 791 VAL N N 791 120.700 120.700 120.805 -0.105 19502 6672 1 17 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.623 0.289 19502 6673 1 17 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.698 -0.214 19502 6674 1 17 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.735 0.001 19502 6675 1 17 . 1 1 791 791 VAL H H 791 7.455 7.455 8.183 -0.728 19502 6676 1 17 . 1 1 792 792 LEU N N 792 120.706 120.706 120.346 0.360 19502 6677 1 17 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.870 0.162 19502 6678 1 17 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.124 -0.257 19502 6679 1 17 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.116 1.131 19502 6680 1 17 . 1 1 792 792 LEU H H 792 8.007 8.007 7.729 0.278 19502 6681 1 17 . 1 1 793 793 ILE N N 793 118.876 118.876 118.159 0.717 19502 6682 1 17 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.628 0.101 19502 6683 1 17 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.364 -0.363 19502 6684 1 17 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.374 1.581 19502 6685 1 17 . 1 1 793 793 ILE H H 793 8.778 8.778 8.679 0.099 19502 6686 1 17 . 1 1 794 794 GLY N N 794 107.008 107.008 107.731 -0.723 19502 6687 1 17 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.201 -0.568 19502 6688 1 17 . 1 1 794 794 GLY H H 794 7.810 7.810 8.280 -0.470 19502 6689 1 17 . 1 1 795 795 GLU N N 795 119.866 119.866 120.729 -0.863 19502 6690 1 17 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.028 0.328 19502 6691 1 17 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.840 -1.137 19502 6692 1 17 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.082 0.998 19502 6693 1 17 . 1 1 795 795 GLU H H 795 7.978 7.978 8.383 -0.405 19502 6694 1 17 . 1 1 796 796 ASN N N 796 118.365 118.365 117.405 0.960 19502 6695 1 17 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.557 0.225 19502 6696 1 17 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.727 -1.145 19502 6697 1 17 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.005 1.040 19502 6698 1 17 . 1 1 796 796 ASN H H 796 8.053 8.053 7.888 0.165 19502 6699 1 17 . 1 1 797 797 GLU N N 797 120.368 120.368 118.766 1.602 19502 6700 1 17 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.176 0.160 19502 6701 1 17 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.454 -0.830 19502 6702 1 17 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.905 0.437 19502 6703 1 17 . 1 1 797 797 GLU H H 797 8.225 8.225 7.862 0.363 19502 6704 1 17 . 1 1 798 798 LYS N N 798 120.614 120.614 115.318 5.296 19502 6705 1 17 . 1 1 798 798 LYS H H 798 8.088 8.088 7.719 0.369 19502 6706 1 17 . 1 1 799 799 ALA N N 799 124.642 124.642 123.848 0.794 19502 6707 1 17 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.541 -0.100 19502 6708 1 17 . 1 1 799 799 ALA CA C 799 52.692 52.692 50.895 1.797 19502 6709 1 17 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.616 -0.999 19502 6710 1 17 . 1 1 799 799 ALA H H 799 8.138 8.138 7.395 0.743 19502 6711 1 17 . 1 1 800 800 GLU N N 800 120.408 120.408 120.887 -0.479 19502 6712 1 17 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.340 0.055 19502 6713 1 17 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.352 0.458 19502 6714 1 17 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.300 1.304 19502 6715 1 17 . 1 1 800 800 GLU H H 800 8.337 8.337 8.708 -0.371 19502 6716 1 18 . 1 1 713 713 VAL N N 713 120.649 120.649 120.882 -0.233 19502 6717 1 18 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.193 -0.073 19502 6718 1 18 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.251 1.758 19502 6719 1 18 . 1 1 713 713 VAL CB C 713 32.747 32.747 34.518 -1.771 19502 6720 1 18 . 1 1 713 713 VAL H H 713 8.051 8.051 8.096 -0.045 19502 6721 1 18 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.447 0.034 19502 6722 1 18 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.630 1.124 19502 6723 1 18 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.962 0.053 19502 6724 1 18 . 1 1 716 716 ILE N N 716 121.593 121.593 127.119 -5.526 19502 6725 1 18 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.059 0.040 19502 6726 1 18 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.737 1.092 19502 6727 1 18 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.613 0.553 19502 6728 1 18 . 1 1 716 716 ILE H H 716 8.406 8.406 8.605 -0.199 19502 6729 1 18 . 1 1 717 717 GLY N N 717 108.628 108.628 107.931 0.697 19502 6730 1 18 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.039 -0.365 19502 6731 1 18 . 1 1 717 717 GLY H H 717 8.476 8.476 8.662 -0.186 19502 6732 1 18 . 1 1 718 718 GLU N N 718 119.944 119.944 121.349 -1.405 19502 6733 1 18 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.101 0.176 19502 6734 1 18 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.579 -0.392 19502 6735 1 18 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.149 0.888 19502 6736 1 18 . 1 1 718 718 GLU H H 718 8.055 8.055 7.714 0.341 19502 6737 1 18 . 1 1 719 719 LEU N N 719 118.538 118.538 119.655 -1.117 19502 6738 1 18 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.355 0.023 19502 6739 1 18 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.112 0.230 19502 6740 1 18 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.757 1.284 19502 6741 1 18 . 1 1 719 719 LEU H H 719 8.098 8.098 7.709 0.389 19502 6742 1 18 . 1 1 720 720 VAL N N 720 117.613 117.613 118.062 -0.449 19502 6743 1 18 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.613 0.091 19502 6744 1 18 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.098 -0.479 19502 6745 1 18 . 1 1 720 720 VAL CB C 720 31.924 31.924 30.904 1.020 19502 6746 1 18 . 1 1 720 720 VAL H H 720 7.838 7.838 7.813 0.025 19502 6747 1 18 . 1 1 721 721 ARG N N 721 118.905 118.905 119.996 -1.091 19502 6748 1 18 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.913 0.266 19502 6749 1 18 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.419 -0.999 19502 6750 1 18 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.595 -0.008 19502 6751 1 18 . 1 1 721 721 ARG H H 721 7.614 7.614 7.643 -0.029 19502 6752 1 18 . 1 1 722 722 TYR N N 722 117.574 117.574 117.924 -0.350 19502 6753 1 18 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.349 0.000 19502 6754 1 18 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.734 -0.669 19502 6755 1 18 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.227 0.604 19502 6756 1 18 . 1 1 722 722 TYR H H 722 7.885 7.885 7.408 0.477 19502 6757 1 18 . 1 1 723 723 LEU N N 723 120.520 120.520 116.741 3.779 19502 6758 1 18 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.070 -0.075 19502 6759 1 18 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.609 0.946 19502 6760 1 18 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.892 0.146 19502 6761 1 18 . 1 1 723 723 LEU H H 723 7.794 7.794 7.616 0.178 19502 6762 1 18 . 1 1 724 724 ASN N N 724 115.161 115.161 115.727 -0.566 19502 6763 1 18 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.693 -0.081 19502 6764 1 18 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.427 -0.190 19502 6765 1 18 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.393 -0.116 19502 6766 1 18 . 1 1 724 724 ASN H H 724 8.892 8.892 7.616 1.276 19502 6767 1 18 . 1 1 725 725 THR N N 725 110.273 110.273 116.186 -5.913 19502 6768 1 18 . 1 1 725 725 THR HA H 725 4.527 4.527 4.239 0.288 19502 6769 1 18 . 1 1 725 725 THR CA C 725 62.903 62.903 65.171 -2.268 19502 6770 1 18 . 1 1 725 725 THR CB C 725 70.619 70.619 69.516 1.103 19502 6771 1 18 . 1 1 725 725 THR H H 725 7.874 7.874 8.260 -0.386 19502 6772 1 18 . 1 1 726 726 ASN N N 726 117.048 117.048 116.961 0.087 19502 6773 1 18 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.043 0.096 19502 6774 1 18 . 1 1 726 726 ASN CA C 726 51.838 51.838 51.300 0.538 19502 6775 1 18 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.359 -1.452 19502 6776 1 18 . 1 1 726 726 ASN H H 726 8.613 8.613 7.506 1.107 19502 6777 1 18 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.421 -0.357 19502 6778 1 18 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.468 0.041 19502 6779 1 18 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.454 -1.009 19502 6780 1 18 . 1 1 728 728 VAL N N 728 118.643 118.643 118.423 0.220 19502 6781 1 18 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.697 -0.297 19502 6782 1 18 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.746 0.820 19502 6783 1 18 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.856 0.570 19502 6784 1 18 . 1 1 728 728 VAL H H 728 8.182 8.182 7.649 0.533 19502 6785 1 18 . 1 1 729 729 GLY N N 729 105.307 105.307 107.017 -1.710 19502 6786 1 18 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.947 0.703 19502 6787 1 18 . 1 1 729 729 GLY H H 729 7.297 7.297 7.780 -0.483 19502 6788 1 18 . 1 1 730 730 GLY N N 730 109.038 109.038 109.402 -0.364 19502 6789 1 18 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.150 0.542 19502 6790 1 18 . 1 1 730 730 GLY H H 730 8.080 8.080 7.275 0.805 19502 6791 1 18 . 1 1 731 731 LEU N N 731 123.822 123.822 123.219 0.603 19502 6792 1 18 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.022 0.014 19502 6793 1 18 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.464 0.132 19502 6794 1 18 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.477 0.738 19502 6795 1 18 . 1 1 731 731 LEU H H 731 8.287 8.287 8.007 0.280 19502 6796 1 18 . 1 1 732 732 LEU N N 732 118.759 118.759 118.140 0.619 19502 6797 1 18 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.889 0.197 19502 6798 1 18 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.155 0.353 19502 6799 1 18 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.636 -0.653 19502 6800 1 18 . 1 1 732 732 LEU H H 732 8.412 8.412 7.685 0.727 19502 6801 1 18 . 1 1 733 733 GLU N N 733 121.155 121.155 119.030 2.125 19502 6802 1 18 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.982 0.291 19502 6803 1 18 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.884 0.189 19502 6804 1 18 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.170 -0.190 19502 6805 1 18 . 1 1 733 733 GLU H H 733 8.003 8.003 8.227 -0.224 19502 6806 1 18 . 1 1 734 734 TYR N N 734 122.518 122.518 123.370 -0.852 19502 6807 1 18 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.931 0.250 19502 6808 1 18 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.481 0.478 19502 6809 1 18 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.299 -0.455 19502 6810 1 18 . 1 1 734 734 TYR H H 734 8.419 8.419 8.463 -0.044 19502 6811 1 18 . 1 1 735 735 ALA N N 735 122.353 122.353 120.428 1.925 19502 6812 1 18 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.818 -0.006 19502 6813 1 18 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.902 1.270 19502 6814 1 18 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.413 0.420 19502 6815 1 18 . 1 1 735 735 ALA H H 735 8.777 8.777 7.628 1.149 19502 6816 1 18 . 1 1 736 736 ARG N N 736 118.852 118.852 119.144 -0.292 19502 6817 1 18 . 1 1 736 736 ARG HA H 736 4.173 4.173 3.993 0.180 19502 6818 1 18 . 1 1 736 736 ARG CA C 736 59.523 59.523 59.126 0.397 19502 6819 1 18 . 1 1 736 736 ARG CB C 736 30.156 30.156 30.042 0.114 19502 6820 1 18 . 1 1 736 736 ARG H H 736 8.570 8.570 8.215 0.355 19502 6821 1 18 . 1 1 737 737 SER N N 737 115.125 115.125 111.650 3.475 19502 6822 1 18 . 1 1 737 737 SER HA H 737 4.149 4.149 4.430 -0.281 19502 6823 1 18 . 1 1 737 737 SER CA C 737 61.300 61.300 59.659 1.641 19502 6824 1 18 . 1 1 737 737 SER CB C 737 63.166 63.166 63.384 -0.218 19502 6825 1 18 . 1 1 737 737 SER H H 737 8.257 8.257 8.204 0.053 19502 6826 1 18 . 1 1 738 738 HIS N N 738 117.591 117.591 117.145 0.446 19502 6827 1 18 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.596 -0.256 19502 6828 1 18 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.487 1.521 19502 6829 1 18 . 1 1 738 738 HIS CB C 738 30.530 30.530 31.111 -0.581 19502 6830 1 18 . 1 1 738 738 HIS H H 738 7.300 7.300 7.489 -0.189 19502 6831 1 18 . 1 1 739 739 GLY N N 739 107.604 107.604 108.148 -0.544 19502 6832 1 18 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.224 0.907 19502 6833 1 18 . 1 1 739 739 GLY H H 739 7.638 7.638 8.126 -0.488 19502 6834 1 18 . 1 1 740 740 PHE N N 740 118.114 118.114 120.049 -1.935 19502 6835 1 18 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.537 0.650 19502 6836 1 18 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.220 -1.817 19502 6837 1 18 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.486 2.496 19502 6838 1 18 . 1 1 740 740 PHE H H 740 8.138 8.138 7.747 0.391 19502 6839 1 18 . 1 1 741 741 ALA N N 741 122.577 122.577 122.546 0.031 19502 6840 1 18 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.568 0.087 19502 6841 1 18 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.718 0.553 19502 6842 1 18 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.010 -0.034 19502 6843 1 18 . 1 1 741 741 ALA H H 741 8.550 8.550 8.731 -0.181 19502 6844 1 18 . 1 1 742 742 ALA N N 742 124.016 124.016 128.158 -4.142 19502 6845 1 18 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.239 -0.334 19502 6846 1 18 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.929 0.099 19502 6847 1 18 . 1 1 742 742 ALA CB C 742 20.360 20.360 20.504 -0.144 19502 6848 1 18 . 1 1 742 742 ALA H H 742 8.511 8.511 8.668 -0.157 19502 6849 1 18 . 1 1 743 743 GLU N N 743 120.968 120.968 121.440 -0.472 19502 6850 1 18 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.664 -0.114 19502 6851 1 18 . 1 1 743 743 GLU CA C 743 54.766 54.766 55.025 -0.259 19502 6852 1 18 . 1 1 743 743 GLU CB C 743 33.989 33.989 34.390 -0.401 19502 6853 1 18 . 1 1 743 743 GLU H H 743 8.628 8.628 8.527 0.101 19502 6854 1 18 . 1 1 744 744 PHE N N 744 120.078 120.078 119.293 0.785 19502 6855 1 18 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.144 -0.329 19502 6856 1 18 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.075 0.096 19502 6857 1 18 . 1 1 744 744 PHE CB C 744 40.375 40.375 42.194 -1.819 19502 6858 1 18 . 1 1 744 744 PHE H H 744 8.792 8.792 8.767 0.025 19502 6859 1 18 . 1 1 745 745 LYS N N 745 124.937 124.937 122.898 2.039 19502 6860 1 18 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.859 -0.266 19502 6861 1 18 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.783 0.287 19502 6862 1 18 . 1 1 745 745 LYS CB C 745 33.545 33.545 36.031 -2.486 19502 6863 1 18 . 1 1 745 745 LYS H H 745 9.180 9.180 9.043 0.137 19502 6864 1 18 . 1 1 746 746 LEU N N 746 129.002 129.002 126.536 2.466 19502 6865 1 18 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.599 0.325 19502 6866 1 18 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.550 0.148 19502 6867 1 18 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.477 -0.899 19502 6868 1 18 . 1 1 746 746 LEU H H 746 8.687 8.687 8.546 0.141 19502 6869 1 18 . 1 1 747 747 VAL N N 747 131.114 131.114 127.828 3.286 19502 6870 1 18 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.784 -0.039 19502 6871 1 18 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.954 -0.820 19502 6872 1 18 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.485 0.486 19502 6873 1 18 . 1 1 747 747 VAL H H 747 9.033 9.033 8.681 0.352 19502 6874 1 18 . 1 1 748 748 ASP N N 748 113.346 113.346 114.368 -1.022 19502 6875 1 18 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.856 -0.072 19502 6876 1 18 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.723 0.611 19502 6877 1 18 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.196 2.995 19502 6878 1 18 . 1 1 748 748 ASP H H 748 7.426 7.426 7.621 -0.195 19502 6879 1 18 . 1 1 749 749 GLN N N 749 120.867 120.867 120.686 0.181 19502 6880 1 18 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.270 -0.200 19502 6881 1 18 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.114 0.489 19502 6882 1 18 . 1 1 749 749 GLN CB C 749 31.923 31.923 31.736 0.187 19502 6883 1 18 . 1 1 749 749 GLN H H 749 7.647 7.647 8.302 -0.655 19502 6884 1 18 . 1 1 750 750 SER N N 750 119.661 119.661 120.026 -0.365 19502 6885 1 18 . 1 1 750 750 SER HA H 750 4.791 4.791 4.730 0.061 19502 6886 1 18 . 1 1 750 750 SER CA C 750 57.575 57.575 58.150 -0.575 19502 6887 1 18 . 1 1 750 750 SER CB C 750 65.910 65.910 66.199 -0.289 19502 6888 1 18 . 1 1 750 750 SER H H 750 8.891 8.891 8.651 0.240 19502 6889 1 18 . 1 1 751 751 GLY N N 751 106.531 106.531 109.141 -2.610 19502 6890 1 18 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.260 -0.046 19502 6891 1 18 . 1 1 751 751 GLY H H 751 8.183 8.183 8.007 0.176 19502 6892 1 18 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.770 0.078 19502 6893 1 18 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.267 0.272 19502 6894 1 18 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.703 0.195 19502 6895 1 18 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.269 -0.043 19502 6896 1 18 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.879 0.466 19502 6897 1 18 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.556 0.351 19502 6898 1 18 . 1 1 754 754 HIS N N 754 109.780 109.780 112.780 -3.000 19502 6899 1 18 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.764 -0.006 19502 6900 1 18 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.200 0.029 19502 6901 1 18 . 1 1 754 754 HIS CB C 754 30.494 30.494 29.811 0.683 19502 6902 1 18 . 1 1 754 754 HIS H H 754 7.707 7.707 8.324 -0.617 19502 6903 1 18 . 1 1 755 755 GLU N N 755 122.843 122.843 121.232 1.611 19502 6904 1 18 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.890 -0.278 19502 6905 1 18 . 1 1 755 755 GLU CA C 755 54.649 54.649 52.975 1.674 19502 6906 1 18 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.456 -0.643 19502 6907 1 18 . 1 1 755 755 GLU H H 755 7.404 7.404 7.374 0.030 19502 6908 1 18 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.444 0.173 19502 6909 1 18 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.436 0.680 19502 6910 1 18 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.383 1.868 19502 6911 1 18 . 1 1 757 757 LYS N N 757 119.032 119.032 125.856 -6.824 19502 6912 1 18 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.908 -0.304 19502 6913 1 18 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.127 0.517 19502 6914 1 18 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.785 1.411 19502 6915 1 18 . 1 1 757 757 LYS H H 757 8.195 8.195 7.530 0.665 19502 6916 1 18 . 1 1 758 758 PHE N N 758 120.288 120.288 126.285 -5.997 19502 6917 1 18 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.703 0.337 19502 6918 1 18 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.073 -0.257 19502 6919 1 18 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.435 2.865 19502 6920 1 18 . 1 1 758 758 PHE H H 758 8.844 8.844 9.163 -0.319 19502 6921 1 18 . 1 1 759 759 VAL N N 759 121.385 121.385 124.704 -3.319 19502 6922 1 18 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.514 0.878 19502 6923 1 18 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.228 -1.578 19502 6924 1 18 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.255 1.983 19502 6925 1 18 . 1 1 759 759 VAL H H 759 8.609 8.609 9.238 -0.629 19502 6926 1 18 . 1 1 760 760 TYR N N 760 126.374 126.374 128.903 -2.529 19502 6927 1 18 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.217 0.580 19502 6928 1 18 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.991 -0.071 19502 6929 1 18 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.771 4.082 19502 6930 1 18 . 1 1 760 760 TYR H H 760 8.903 8.903 9.608 -0.705 19502 6931 1 18 . 1 1 761 761 GLN N N 761 115.228 115.228 122.987 -7.759 19502 6932 1 18 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.886 -1.062 19502 6933 1 18 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.452 2.074 19502 6934 1 18 . 1 1 761 761 GLN CB C 761 33.318 33.318 34.001 -0.683 19502 6935 1 18 . 1 1 761 761 GLN H H 761 9.016 9.016 8.786 0.230 19502 6936 1 18 . 1 1 762 762 ALA N N 762 128.023 128.023 128.285 -0.262 19502 6937 1 18 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.902 0.279 19502 6938 1 18 . 1 1 762 762 ALA CA C 762 50.875 50.875 49.997 0.878 19502 6939 1 18 . 1 1 762 762 ALA CB C 762 20.151 20.151 21.261 -1.110 19502 6940 1 18 . 1 1 762 762 ALA H H 762 9.500 9.500 8.389 1.111 19502 6941 1 18 . 1 1 763 763 LYS N N 763 122.022 122.022 122.608 -0.586 19502 6942 1 18 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.900 -0.036 19502 6943 1 18 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.308 0.837 19502 6944 1 18 . 1 1 763 763 LYS CB C 763 36.456 36.456 35.515 0.941 19502 6945 1 18 . 1 1 763 763 LYS H H 763 8.347 8.347 8.589 -0.242 19502 6946 1 18 . 1 1 764 764 VAL N N 764 123.980 123.980 127.115 -3.135 19502 6947 1 18 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.499 0.128 19502 6948 1 18 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.840 0.126 19502 6949 1 18 . 1 1 764 764 VAL CB C 764 34.820 34.820 32.214 2.606 19502 6950 1 18 . 1 1 764 764 VAL H H 764 8.703 8.703 8.442 0.261 19502 6951 1 18 . 1 1 765 765 GLY N N 765 119.292 119.292 118.551 0.741 19502 6952 1 18 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.621 0.002 19502 6953 1 18 . 1 1 765 765 GLY H H 765 9.151 9.151 9.058 0.093 19502 6954 1 18 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.498 0.692 19502 6955 1 18 . 1 1 767 767 ARG N N 767 119.571 119.571 120.564 -0.993 19502 6956 1 18 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.720 -0.327 19502 6957 1 18 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.828 1.522 19502 6958 1 18 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.248 0.071 19502 6959 1 18 . 1 1 767 767 ARG H H 767 7.595 7.595 7.598 -0.003 19502 6960 1 18 . 1 1 768 768 TRP N N 768 122.976 122.976 122.603 0.373 19502 6961 1 18 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.226 -0.656 19502 6962 1 18 . 1 1 768 768 TRP CA C 768 56.466 56.466 55.906 0.560 19502 6963 1 18 . 1 1 768 768 TRP CB C 768 30.218 30.218 30.319 -0.101 19502 6964 1 18 . 1 1 768 768 TRP H H 768 8.056 8.056 8.704 -0.648 19502 6965 1 18 . 1 1 769 769 PHE N N 769 116.997 116.997 122.395 -5.398 19502 6966 1 18 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.824 -0.074 19502 6967 1 18 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.667 2.062 19502 6968 1 18 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.186 -0.889 19502 6969 1 18 . 1 1 769 769 PHE H H 769 7.532 7.532 8.565 -1.033 19502 6970 1 18 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.753 -0.029 19502 6971 1 18 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.740 2.559 19502 6972 1 18 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.931 -0.155 19502 6973 1 18 . 1 1 771 771 ALA N N 771 125.979 125.979 122.773 3.206 19502 6974 1 18 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.121 0.113 19502 6975 1 18 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.601 0.041 19502 6976 1 18 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.161 0.494 19502 6977 1 18 . 1 1 771 771 ALA H H 771 9.069 9.069 8.226 0.843 19502 6978 1 18 . 1 1 772 772 VAL N N 772 113.901 113.901 118.467 -4.566 19502 6979 1 18 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.793 0.018 19502 6980 1 18 . 1 1 772 772 VAL CA C 772 59.149 59.149 60.080 -0.931 19502 6981 1 18 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.501 0.745 19502 6982 1 18 . 1 1 772 772 VAL H H 772 9.024 9.024 9.154 -0.130 19502 6983 1 18 . 1 1 773 773 CYS N N 773 119.222 119.222 123.990 -4.768 19502 6984 1 18 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.561 0.046 19502 6985 1 18 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.664 0.094 19502 6986 1 18 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.055 1.786 19502 6987 1 18 . 1 1 773 773 CYS H H 773 8.597 8.597 8.671 -0.074 19502 6988 1 18 . 1 1 774 774 ALA N N 774 124.328 124.328 126.874 -2.546 19502 6989 1 18 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.418 0.385 19502 6990 1 18 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.462 0.768 19502 6991 1 18 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.516 2.609 19502 6992 1 18 . 1 1 774 774 ALA H H 774 9.238 9.238 8.740 0.498 19502 6993 1 18 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.054 0.202 19502 6994 1 18 . 1 1 775 775 HIS CA C 775 56.529 56.529 56.982 -0.453 19502 6995 1 18 . 1 1 775 775 HIS CB C 775 30.133 30.133 31.127 -0.994 19502 6996 1 18 . 1 1 776 776 SER N N 776 110.366 110.366 112.194 -1.828 19502 6997 1 18 . 1 1 776 776 SER HA H 776 4.766 4.766 4.788 -0.022 19502 6998 1 18 . 1 1 776 776 SER CA C 776 57.029 57.029 57.451 -0.422 19502 6999 1 18 . 1 1 776 776 SER H H 776 7.550 7.550 7.573 -0.023 19502 7000 1 18 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.724 -0.137 19502 7001 1 18 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.085 1.351 19502 7002 1 18 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.015 0.189 19502 7003 1 18 . 1 1 778 778 LYS N N 778 118.469 118.469 119.683 -1.214 19502 7004 1 18 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.900 -0.136 19502 7005 1 18 . 1 1 778 778 LYS CA C 778 59.911 59.911 58.861 1.050 19502 7006 1 18 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.567 2.118 19502 7007 1 18 . 1 1 778 778 LYS H H 778 8.151 8.151 8.123 0.028 19502 7008 1 18 . 1 1 779 779 GLN N N 779 117.975 117.975 116.524 1.451 19502 7009 1 18 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.921 0.092 19502 7010 1 18 . 1 1 779 779 GLN CA C 779 57.909 57.909 59.267 -1.358 19502 7011 1 18 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.222 0.338 19502 7012 1 18 . 1 1 779 779 GLN H H 779 7.773 7.773 8.463 -0.690 19502 7013 1 18 . 1 1 780 780 GLY N N 780 108.214 108.214 107.355 0.859 19502 7014 1 18 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.006 1.005 19502 7015 1 18 . 1 1 780 780 GLY H H 780 8.273 8.273 8.257 0.016 19502 7016 1 18 . 1 1 781 781 LYS N N 781 120.027 120.027 121.764 -1.737 19502 7017 1 18 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.616 -0.527 19502 7018 1 18 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.592 0.766 19502 7019 1 18 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.828 -0.142 19502 7020 1 18 . 1 1 781 781 LYS H H 781 7.307 7.307 7.288 0.019 19502 7021 1 18 . 1 1 782 782 GLN N N 782 117.131 117.131 118.196 -1.065 19502 7022 1 18 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.931 -0.163 19502 7023 1 18 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.256 0.539 19502 7024 1 18 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.686 -0.133 19502 7025 1 18 . 1 1 782 782 GLN H H 782 7.227 7.227 7.893 -0.666 19502 7026 1 18 . 1 1 783 783 GLU N N 783 117.958 117.958 119.705 -1.747 19502 7027 1 18 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.135 0.068 19502 7028 1 18 . 1 1 783 783 GLU CA C 783 58.964 58.964 58.752 0.212 19502 7029 1 18 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.241 -0.282 19502 7030 1 18 . 1 1 783 783 GLU H H 783 8.896 8.896 8.716 0.180 19502 7031 1 18 . 1 1 784 784 ALA N N 784 124.176 124.176 123.027 1.149 19502 7032 1 18 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.068 0.066 19502 7033 1 18 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.462 -0.246 19502 7034 1 18 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.445 -0.848 19502 7035 1 18 . 1 1 784 784 ALA H H 784 8.532 8.532 8.361 0.171 19502 7036 1 18 . 1 1 785 785 ALA N N 785 121.847 121.847 120.513 1.334 19502 7037 1 18 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.970 0.072 19502 7038 1 18 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.244 -0.075 19502 7039 1 18 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.396 -0.003 19502 7040 1 18 . 1 1 785 785 ALA H H 785 8.402 8.402 8.124 0.278 19502 7041 1 18 . 1 1 786 786 ASP N N 786 120.625 120.625 120.193 0.432 19502 7042 1 18 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.271 -0.119 19502 7043 1 18 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.879 0.292 19502 7044 1 18 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.864 1.652 19502 7045 1 18 . 1 1 786 786 ASP H H 786 8.524 8.524 8.233 0.291 19502 7046 1 18 . 1 1 787 787 ALA N N 787 118.408 118.408 121.472 -3.064 19502 7047 1 18 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.145 -0.169 19502 7048 1 18 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.815 0.301 19502 7049 1 18 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.436 -0.166 19502 7050 1 18 . 1 1 787 787 ALA H H 787 8.191 8.191 8.359 -0.168 19502 7051 1 18 . 1 1 788 788 ALA N N 788 118.510 118.510 122.252 -3.742 19502 7052 1 18 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.179 -0.475 19502 7053 1 18 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.067 -0.174 19502 7054 1 18 . 1 1 788 788 ALA CB C 788 18.573 18.573 18.030 0.543 19502 7055 1 18 . 1 1 788 788 ALA H H 788 7.533 7.533 8.033 -0.500 19502 7056 1 18 . 1 1 789 789 LEU N N 789 117.413 117.413 118.481 -1.068 19502 7057 1 18 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.777 -0.087 19502 7058 1 18 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.758 0.422 19502 7059 1 18 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.269 0.835 19502 7060 1 18 . 1 1 789 789 LEU H H 789 8.520 8.520 8.402 0.118 19502 7061 1 18 . 1 1 790 790 ARG N N 790 116.360 116.360 118.999 -2.639 19502 7062 1 18 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.033 -0.115 19502 7063 1 18 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.447 2.356 19502 7064 1 18 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.079 0.681 19502 7065 1 18 . 1 1 790 790 ARG H H 790 8.293 8.293 7.853 0.440 19502 7066 1 18 . 1 1 791 791 VAL N N 791 120.700 120.700 120.845 -0.145 19502 7067 1 18 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.645 0.267 19502 7068 1 18 . 1 1 791 791 VAL CA C 791 66.484 66.484 67.019 -0.535 19502 7069 1 18 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.307 0.429 19502 7070 1 18 . 1 1 791 791 VAL H H 791 7.455 7.455 8.097 -0.642 19502 7071 1 18 . 1 1 792 792 LEU N N 792 120.706 120.706 119.436 1.270 19502 7072 1 18 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.779 0.253 19502 7073 1 18 . 1 1 792 792 LEU CA C 792 57.867 57.867 57.970 -0.103 19502 7074 1 18 . 1 1 792 792 LEU CB C 792 42.247 42.247 40.926 1.321 19502 7075 1 18 . 1 1 792 792 LEU H H 792 8.007 8.007 7.800 0.207 19502 7076 1 18 . 1 1 793 793 ILE N N 793 118.876 118.876 118.611 0.265 19502 7077 1 18 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.640 0.089 19502 7078 1 18 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.303 -0.302 19502 7079 1 18 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.535 1.420 19502 7080 1 18 . 1 1 793 793 ILE H H 793 8.778 8.778 8.634 0.144 19502 7081 1 18 . 1 1 794 794 GLY N N 794 107.008 107.008 107.413 -0.405 19502 7082 1 18 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.029 -0.397 19502 7083 1 18 . 1 1 794 794 GLY H H 794 7.810 7.810 8.496 -0.686 19502 7084 1 18 . 1 1 795 795 GLU N N 795 119.866 119.866 120.424 -0.558 19502 7085 1 18 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.089 0.267 19502 7086 1 18 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.666 -0.962 19502 7087 1 18 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.166 0.914 19502 7088 1 18 . 1 1 795 795 GLU H H 795 7.978 7.978 8.545 -0.567 19502 7089 1 18 . 1 1 796 796 ASN N N 796 118.365 118.365 117.310 1.055 19502 7090 1 18 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.728 0.054 19502 7091 1 18 . 1 1 796 796 ASN CA C 796 54.582 54.582 54.578 0.004 19502 7092 1 18 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.318 0.727 19502 7093 1 18 . 1 1 796 796 ASN H H 796 8.053 8.053 7.753 0.300 19502 7094 1 18 . 1 1 797 797 GLU N N 797 120.368 120.368 121.211 -0.843 19502 7095 1 18 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.131 0.205 19502 7096 1 18 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.910 -1.286 19502 7097 1 18 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.672 0.670 19502 7098 1 18 . 1 1 797 797 GLU H H 797 8.225 8.225 8.227 -0.002 19502 7099 1 18 . 1 1 798 798 LYS N N 798 120.614 120.614 115.214 5.400 19502 7100 1 18 . 1 1 798 798 LYS H H 798 8.088 8.088 7.732 0.356 19502 7101 1 18 . 1 1 799 799 ALA N N 799 124.642 124.642 123.079 1.563 19502 7102 1 18 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.500 -0.059 19502 7103 1 18 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.656 1.036 19502 7104 1 18 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.684 -1.067 19502 7105 1 18 . 1 1 799 799 ALA H H 799 8.138 8.138 7.572 0.566 19502 7106 1 18 . 1 1 800 800 GLU N N 800 120.408 120.408 120.295 0.113 19502 7107 1 18 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.585 -0.190 19502 7108 1 18 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.176 1.634 19502 7109 1 18 . 1 1 800 800 GLU CB C 800 30.604 30.604 30.793 -0.189 19502 7110 1 18 . 1 1 800 800 GLU H H 800 8.337 8.337 8.542 -0.205 19502 7111 1 19 . 1 1 713 713 VAL N N 713 120.649 120.649 119.211 1.438 19502 7112 1 19 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.296 -0.176 19502 7113 1 19 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.334 1.675 19502 7114 1 19 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.400 0.347 19502 7115 1 19 . 1 1 713 713 VAL H H 713 8.051 8.051 8.283 -0.232 19502 7116 1 19 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.655 -0.174 19502 7117 1 19 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.358 1.395 19502 7118 1 19 . 1 1 715 715 LYS CB C 715 33.015 33.015 35.066 -2.051 19502 7119 1 19 . 1 1 716 716 ILE N N 716 121.593 121.593 119.273 2.320 19502 7120 1 19 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.293 -0.194 19502 7121 1 19 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.585 0.244 19502 7122 1 19 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.619 0.547 19502 7123 1 19 . 1 1 716 716 ILE H H 716 8.406 8.406 8.453 -0.047 19502 7124 1 19 . 1 1 717 717 GLY N N 717 108.628 108.628 108.119 0.509 19502 7125 1 19 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.082 -0.408 19502 7126 1 19 . 1 1 717 717 GLY H H 717 8.476 8.476 8.620 -0.144 19502 7127 1 19 . 1 1 718 718 GLU N N 718 119.944 119.944 121.054 -1.110 19502 7128 1 19 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.137 0.140 19502 7129 1 19 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.892 -0.705 19502 7130 1 19 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.415 0.622 19502 7131 1 19 . 1 1 718 718 GLU H H 718 8.055 8.055 7.806 0.249 19502 7132 1 19 . 1 1 719 719 LEU N N 719 118.538 118.538 119.350 -0.812 19502 7133 1 19 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.341 0.037 19502 7134 1 19 . 1 1 719 719 LEU CA C 719 57.342 57.342 57.163 0.179 19502 7135 1 19 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.734 1.306 19502 7136 1 19 . 1 1 719 719 LEU H H 719 8.098 8.098 7.893 0.205 19502 7137 1 19 . 1 1 720 720 VAL N N 720 117.613 117.613 118.304 -0.691 19502 7138 1 19 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.676 0.028 19502 7139 1 19 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.981 -1.362 19502 7140 1 19 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.126 0.798 19502 7141 1 19 . 1 1 720 720 VAL H H 720 7.838 7.838 7.556 0.282 19502 7142 1 19 . 1 1 721 721 ARG N N 721 118.905 118.905 119.453 -0.548 19502 7143 1 19 . 1 1 721 721 ARG HA H 721 4.179 4.179 4.004 0.175 19502 7144 1 19 . 1 1 721 721 ARG CA C 721 58.420 58.420 58.987 -0.567 19502 7145 1 19 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.437 0.150 19502 7146 1 19 . 1 1 721 721 ARG H H 721 7.614 7.614 7.306 0.308 19502 7147 1 19 . 1 1 722 722 TYR N N 722 117.574 117.574 118.600 -1.026 19502 7148 1 19 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.313 0.036 19502 7149 1 19 . 1 1 722 722 TYR CA C 722 60.065 60.065 61.102 -1.037 19502 7150 1 19 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.341 0.490 19502 7151 1 19 . 1 1 722 722 TYR H H 722 7.885 7.885 7.520 0.365 19502 7152 1 19 . 1 1 723 723 LEU N N 723 120.520 120.520 117.472 3.048 19502 7153 1 19 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.058 -0.063 19502 7154 1 19 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.727 0.828 19502 7155 1 19 . 1 1 723 723 LEU CB C 723 42.038 42.038 42.005 0.033 19502 7156 1 19 . 1 1 723 723 LEU H H 723 7.794 7.794 7.798 -0.004 19502 7157 1 19 . 1 1 724 724 ASN N N 724 115.161 115.161 115.472 -0.311 19502 7158 1 19 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.597 0.015 19502 7159 1 19 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.463 -0.226 19502 7160 1 19 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.185 0.092 19502 7161 1 19 . 1 1 724 724 ASN H H 724 8.892 8.892 7.721 1.171 19502 7162 1 19 . 1 1 725 725 THR N N 725 110.273 110.273 114.646 -4.373 19502 7163 1 19 . 1 1 725 725 THR HA H 725 4.527 4.527 4.344 0.183 19502 7164 1 19 . 1 1 725 725 THR CA C 725 62.903 62.903 64.297 -1.394 19502 7165 1 19 . 1 1 725 725 THR CB C 725 70.619 70.619 69.739 0.880 19502 7166 1 19 . 1 1 725 725 THR H H 725 7.874 7.874 7.708 0.166 19502 7167 1 19 . 1 1 726 726 ASN N N 726 117.048 117.048 118.621 -1.573 19502 7168 1 19 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.109 0.030 19502 7169 1 19 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.257 1.581 19502 7170 1 19 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.868 -1.961 19502 7171 1 19 . 1 1 726 726 ASN H H 726 8.613 8.613 8.035 0.578 19502 7172 1 19 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.370 -0.306 19502 7173 1 19 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.154 0.355 19502 7174 1 19 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.377 -0.932 19502 7175 1 19 . 1 1 728 728 VAL N N 728 118.643 118.643 119.013 -0.370 19502 7176 1 19 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.660 -0.260 19502 7177 1 19 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.520 1.046 19502 7178 1 19 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.570 0.856 19502 7179 1 19 . 1 1 728 728 VAL H H 728 8.182 8.182 7.853 0.329 19502 7180 1 19 . 1 1 729 729 GLY N N 729 105.307 105.307 107.399 -2.092 19502 7181 1 19 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.886 0.764 19502 7182 1 19 . 1 1 729 729 GLY H H 729 7.297 7.297 8.524 -1.227 19502 7183 1 19 . 1 1 730 730 GLY N N 730 109.038 109.038 109.612 -0.574 19502 7184 1 19 . 1 1 730 730 GLY CA C 730 46.692 46.692 46.004 0.688 19502 7185 1 19 . 1 1 730 730 GLY H H 730 8.080 8.080 7.394 0.686 19502 7186 1 19 . 1 1 731 731 LEU N N 731 123.822 123.822 123.542 0.280 19502 7187 1 19 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.034 0.002 19502 7188 1 19 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.446 0.150 19502 7189 1 19 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.575 0.640 19502 7190 1 19 . 1 1 731 731 LEU H H 731 8.287 8.287 8.314 -0.027 19502 7191 1 19 . 1 1 732 732 LEU N N 732 118.759 118.759 117.382 1.377 19502 7192 1 19 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.973 0.113 19502 7193 1 19 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.041 0.467 19502 7194 1 19 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.679 -0.696 19502 7195 1 19 . 1 1 732 732 LEU H H 732 8.412 8.412 8.279 0.133 19502 7196 1 19 . 1 1 733 733 GLU N N 733 121.155 121.155 119.793 1.362 19502 7197 1 19 . 1 1 733 733 GLU HA H 733 4.273 4.273 4.081 0.192 19502 7198 1 19 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.392 0.681 19502 7199 1 19 . 1 1 733 733 GLU CB C 733 28.980 28.980 28.622 0.358 19502 7200 1 19 . 1 1 733 733 GLU H H 733 8.003 8.003 7.861 0.142 19502 7201 1 19 . 1 1 734 734 TYR N N 734 122.518 122.518 123.022 -0.504 19502 7202 1 19 . 1 1 734 734 TYR HA H 734 4.181 4.181 4.057 0.124 19502 7203 1 19 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.701 0.258 19502 7204 1 19 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.334 -0.490 19502 7205 1 19 . 1 1 734 734 TYR H H 734 8.419 8.419 8.501 -0.082 19502 7206 1 19 . 1 1 735 735 ALA N N 735 122.353 122.353 121.104 1.249 19502 7207 1 19 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.720 0.092 19502 7208 1 19 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.102 1.071 19502 7209 1 19 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.466 0.367 19502 7210 1 19 . 1 1 735 735 ALA H H 735 8.777 8.777 7.794 0.983 19502 7211 1 19 . 1 1 736 736 ARG N N 736 118.852 118.852 118.234 0.618 19502 7212 1 19 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.021 0.152 19502 7213 1 19 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.706 0.817 19502 7214 1 19 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.697 0.459 19502 7215 1 19 . 1 1 736 736 ARG H H 736 8.570 8.570 7.751 0.819 19502 7216 1 19 . 1 1 737 737 SER N N 737 115.125 115.125 113.830 1.295 19502 7217 1 19 . 1 1 737 737 SER HA H 737 4.149 4.149 4.315 -0.166 19502 7218 1 19 . 1 1 737 737 SER CA C 737 61.300 61.300 60.504 0.796 19502 7219 1 19 . 1 1 737 737 SER CB C 737 63.166 63.166 63.413 -0.247 19502 7220 1 19 . 1 1 737 737 SER H H 737 8.257 8.257 8.284 -0.027 19502 7221 1 19 . 1 1 738 738 HIS N N 738 117.591 117.591 116.259 1.332 19502 7222 1 19 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.545 -0.205 19502 7223 1 19 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.904 1.104 19502 7224 1 19 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.931 -0.401 19502 7225 1 19 . 1 1 738 738 HIS H H 738 7.300 7.300 7.702 -0.402 19502 7226 1 19 . 1 1 739 739 GLY N N 739 107.604 107.604 107.733 -0.129 19502 7227 1 19 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.939 1.192 19502 7228 1 19 . 1 1 739 739 GLY H H 739 7.638 7.638 8.000 -0.362 19502 7229 1 19 . 1 1 740 740 PHE N N 740 118.114 118.114 120.012 -1.898 19502 7230 1 19 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.583 0.604 19502 7231 1 19 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.171 -1.768 19502 7232 1 19 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.372 2.610 19502 7233 1 19 . 1 1 740 740 PHE H H 740 8.138 8.138 7.875 0.263 19502 7234 1 19 . 1 1 741 741 ALA N N 741 122.577 122.577 120.803 1.774 19502 7235 1 19 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.630 0.025 19502 7236 1 19 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.785 0.486 19502 7237 1 19 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.026 -1.050 19502 7238 1 19 . 1 1 741 741 ALA H H 741 8.550 8.550 8.584 -0.034 19502 7239 1 19 . 1 1 742 742 ALA N N 742 124.016 124.016 127.380 -3.364 19502 7240 1 19 . 1 1 742 742 ALA HA H 742 4.906 4.906 5.014 -0.108 19502 7241 1 19 . 1 1 742 742 ALA CA C 742 51.029 51.029 50.877 0.152 19502 7242 1 19 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.771 0.589 19502 7243 1 19 . 1 1 742 742 ALA H H 742 8.511 8.511 8.557 -0.046 19502 7244 1 19 . 1 1 743 743 GLU N N 743 120.968 120.968 123.730 -2.762 19502 7245 1 19 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.685 -0.135 19502 7246 1 19 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.820 -0.054 19502 7247 1 19 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.154 0.835 19502 7248 1 19 . 1 1 743 743 GLU H H 743 8.628 8.628 8.722 -0.094 19502 7249 1 19 . 1 1 744 744 PHE N N 744 120.078 120.078 123.279 -3.201 19502 7250 1 19 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.947 -0.132 19502 7251 1 19 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.254 -0.083 19502 7252 1 19 . 1 1 744 744 PHE CB C 744 40.375 40.375 39.567 0.808 19502 7253 1 19 . 1 1 744 744 PHE H H 744 8.792 8.792 8.985 -0.193 19502 7254 1 19 . 1 1 745 745 LYS N N 745 124.937 124.937 123.978 0.959 19502 7255 1 19 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.847 -0.254 19502 7256 1 19 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.678 0.392 19502 7257 1 19 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.381 -1.836 19502 7258 1 19 . 1 1 745 745 LYS H H 745 9.180 9.180 8.233 0.947 19502 7259 1 19 . 1 1 746 746 LEU N N 746 129.002 129.002 125.825 3.177 19502 7260 1 19 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.685 0.239 19502 7261 1 19 . 1 1 746 746 LEU CA C 746 54.698 54.698 55.154 -0.456 19502 7262 1 19 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.482 -0.903 19502 7263 1 19 . 1 1 746 746 LEU H H 746 8.687 8.687 8.544 0.143 19502 7264 1 19 . 1 1 747 747 VAL N N 747 131.114 131.114 128.168 2.946 19502 7265 1 19 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.884 -0.139 19502 7266 1 19 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.664 -0.530 19502 7267 1 19 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.467 0.504 19502 7268 1 19 . 1 1 747 747 VAL H H 747 9.033 9.033 9.073 -0.040 19502 7269 1 19 . 1 1 748 748 ASP N N 748 113.346 113.346 114.525 -1.179 19502 7270 1 19 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.802 -0.018 19502 7271 1 19 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.796 0.538 19502 7272 1 19 . 1 1 748 748 ASP CB C 748 46.191 46.191 42.813 3.378 19502 7273 1 19 . 1 1 748 748 ASP H H 748 7.426 7.426 7.671 -0.245 19502 7274 1 19 . 1 1 749 749 GLN N N 749 120.867 120.867 119.065 1.802 19502 7275 1 19 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.832 0.238 19502 7276 1 19 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.084 -0.480 19502 7277 1 19 . 1 1 749 749 GLN CB C 749 31.923 31.923 31.759 0.165 19502 7278 1 19 . 1 1 749 749 GLN H H 749 7.647 7.647 8.388 -0.741 19502 7279 1 19 . 1 1 750 750 SER N N 750 119.661 119.661 123.300 -3.639 19502 7280 1 19 . 1 1 750 750 SER HA H 750 4.791 4.791 4.676 0.115 19502 7281 1 19 . 1 1 750 750 SER CA C 750 57.575 57.575 57.735 -0.160 19502 7282 1 19 . 1 1 750 750 SER CB C 750 65.910 65.910 63.486 2.424 19502 7283 1 19 . 1 1 750 750 SER H H 750 8.891 8.891 8.985 -0.094 19502 7284 1 19 . 1 1 751 751 GLY N N 751 106.531 106.531 112.242 -5.711 19502 7285 1 19 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.462 -0.248 19502 7286 1 19 . 1 1 751 751 GLY H H 751 8.183 8.183 7.686 0.497 19502 7287 1 19 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.678 0.170 19502 7288 1 19 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.151 0.387 19502 7289 1 19 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.676 0.222 19502 7290 1 19 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.208 0.018 19502 7291 1 19 . 1 1 753 753 PRO CA C 753 65.345 65.345 65.036 0.309 19502 7292 1 19 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.440 0.467 19502 7293 1 19 . 1 1 754 754 HIS N N 754 109.780 109.780 111.710 -1.930 19502 7294 1 19 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.774 -0.016 19502 7295 1 19 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.274 -0.045 19502 7296 1 19 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.058 0.436 19502 7297 1 19 . 1 1 754 754 HIS H H 754 7.707 7.707 7.889 -0.182 19502 7298 1 19 . 1 1 755 755 GLU N N 755 122.843 122.843 120.036 2.807 19502 7299 1 19 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.900 -0.288 19502 7300 1 19 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.946 0.703 19502 7301 1 19 . 1 1 755 755 GLU CB C 755 30.813 30.813 31.108 -0.294 19502 7302 1 19 . 1 1 755 755 GLU H H 755 7.404 7.404 7.607 -0.203 19502 7303 1 19 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.294 0.323 19502 7304 1 19 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.592 0.524 19502 7305 1 19 . 1 1 756 756 PRO CB C 756 33.251 33.251 30.907 2.344 19502 7306 1 19 . 1 1 757 757 LYS N N 757 119.032 119.032 126.250 -7.218 19502 7307 1 19 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.520 0.084 19502 7308 1 19 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.545 0.099 19502 7309 1 19 . 1 1 757 757 LYS CB C 757 35.196 35.196 32.831 2.365 19502 7310 1 19 . 1 1 757 757 LYS H H 757 8.195 8.195 7.827 0.368 19502 7311 1 19 . 1 1 758 758 PHE N N 758 120.288 120.288 126.245 -5.957 19502 7312 1 19 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.635 0.405 19502 7313 1 19 . 1 1 758 758 PHE CA C 758 56.816 56.816 57.685 -0.869 19502 7314 1 19 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.291 3.009 19502 7315 1 19 . 1 1 758 758 PHE H H 758 8.844 8.844 9.477 -0.633 19502 7316 1 19 . 1 1 759 759 VAL N N 759 121.385 121.385 124.440 -3.055 19502 7317 1 19 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.686 0.706 19502 7318 1 19 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.980 -1.330 19502 7319 1 19 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.438 1.800 19502 7320 1 19 . 1 1 759 759 VAL H H 759 8.609 8.609 9.123 -0.514 19502 7321 1 19 . 1 1 760 760 TYR N N 760 126.374 126.374 128.803 -2.429 19502 7322 1 19 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.148 0.649 19502 7323 1 19 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.243 -0.323 19502 7324 1 19 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.306 4.547 19502 7325 1 19 . 1 1 760 760 TYR H H 760 8.903 8.903 9.179 -0.276 19502 7326 1 19 . 1 1 761 761 GLN N N 761 115.228 115.228 123.367 -8.139 19502 7327 1 19 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.726 -0.902 19502 7328 1 19 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.603 1.923 19502 7329 1 19 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.710 -0.392 19502 7330 1 19 . 1 1 761 761 GLN H H 761 9.016 9.016 8.554 0.462 19502 7331 1 19 . 1 1 762 762 ALA N N 762 128.023 128.023 129.700 -1.677 19502 7332 1 19 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.778 0.403 19502 7333 1 19 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.538 0.338 19502 7334 1 19 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.914 0.237 19502 7335 1 19 . 1 1 762 762 ALA H H 762 9.500 9.500 8.727 0.773 19502 7336 1 19 . 1 1 763 763 LYS N N 763 122.022 122.022 126.541 -4.519 19502 7337 1 19 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.724 0.140 19502 7338 1 19 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.598 0.547 19502 7339 1 19 . 1 1 763 763 LYS CB C 763 36.456 36.456 34.227 2.229 19502 7340 1 19 . 1 1 763 763 LYS H H 763 8.347 8.347 8.884 -0.537 19502 7341 1 19 . 1 1 764 764 VAL N N 764 123.980 123.980 128.025 -4.045 19502 7342 1 19 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.826 -0.199 19502 7343 1 19 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.311 0.655 19502 7344 1 19 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.747 4.073 19502 7345 1 19 . 1 1 764 764 VAL H H 764 8.703 8.703 8.720 -0.017 19502 7346 1 19 . 1 1 765 765 GLY N N 765 119.292 119.292 118.682 0.610 19502 7347 1 19 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.608 0.015 19502 7348 1 19 . 1 1 765 765 GLY H H 765 9.151 9.151 8.879 0.272 19502 7349 1 19 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.507 0.683 19502 7350 1 19 . 1 1 767 767 ARG N N 767 119.571 119.571 122.321 -2.750 19502 7351 1 19 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.721 -0.328 19502 7352 1 19 . 1 1 767 767 ARG CA C 767 55.349 55.349 53.658 1.690 19502 7353 1 19 . 1 1 767 767 ARG CB C 767 32.319 32.319 31.466 0.853 19502 7354 1 19 . 1 1 767 767 ARG H H 767 7.595 7.595 7.545 0.050 19502 7355 1 19 . 1 1 768 768 TRP N N 768 122.976 122.976 128.121 -5.145 19502 7356 1 19 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.062 -0.492 19502 7357 1 19 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.488 -0.022 19502 7358 1 19 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.331 0.887 19502 7359 1 19 . 1 1 768 768 TRP H H 768 8.056 8.056 8.861 -0.805 19502 7360 1 19 . 1 1 769 769 PHE N N 769 116.997 116.997 123.600 -6.603 19502 7361 1 19 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.771 -0.021 19502 7362 1 19 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.546 2.183 19502 7363 1 19 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.157 -0.860 19502 7364 1 19 . 1 1 769 769 PHE H H 769 7.532 7.532 8.872 -1.340 19502 7365 1 19 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.714 0.010 19502 7366 1 19 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.741 2.558 19502 7367 1 19 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.776 -0.001 19502 7368 1 19 . 1 1 771 771 ALA N N 771 125.979 125.979 122.239 3.740 19502 7369 1 19 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.192 0.042 19502 7370 1 19 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.711 -0.069 19502 7371 1 19 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.358 0.297 19502 7372 1 19 . 1 1 771 771 ALA H H 771 9.069 9.069 8.163 0.906 19502 7373 1 19 . 1 1 772 772 VAL N N 772 113.901 113.901 117.096 -3.195 19502 7374 1 19 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.747 0.064 19502 7375 1 19 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.638 -0.489 19502 7376 1 19 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.649 0.597 19502 7377 1 19 . 1 1 772 772 VAL H H 772 9.024 9.024 9.114 -0.090 19502 7378 1 19 . 1 1 773 773 CYS N N 773 119.222 119.222 119.154 0.068 19502 7379 1 19 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.749 -0.142 19502 7380 1 19 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.974 -0.216 19502 7381 1 19 . 1 1 773 773 CYS CB C 773 29.841 29.841 30.028 -0.187 19502 7382 1 19 . 1 1 773 773 CYS H H 773 8.597 8.597 8.301 0.296 19502 7383 1 19 . 1 1 774 774 ALA N N 774 124.328 124.328 127.627 -3.299 19502 7384 1 19 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.867 -0.064 19502 7385 1 19 . 1 1 774 774 ALA CA C 774 51.231 51.231 51.166 0.065 19502 7386 1 19 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.494 1.631 19502 7387 1 19 . 1 1 774 774 ALA H H 774 9.238 9.238 8.918 0.320 19502 7388 1 19 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.876 0.380 19502 7389 1 19 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.474 1.055 19502 7390 1 19 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.385 0.748 19502 7391 1 19 . 1 1 776 776 SER N N 776 110.366 110.366 113.318 -2.952 19502 7392 1 19 . 1 1 776 776 SER HA H 776 4.766 4.766 4.692 0.074 19502 7393 1 19 . 1 1 776 776 SER CA C 776 57.029 57.029 56.732 0.297 19502 7394 1 19 . 1 1 776 776 SER H H 776 7.550 7.550 7.629 -0.079 19502 7395 1 19 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.697 -0.110 19502 7396 1 19 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.198 1.238 19502 7397 1 19 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.084 0.120 19502 7398 1 19 . 1 1 778 778 LYS N N 778 118.469 118.469 117.386 1.083 19502 7399 1 19 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.861 -0.097 19502 7400 1 19 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.006 0.905 19502 7401 1 19 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.595 2.091 19502 7402 1 19 . 1 1 778 778 LYS H H 778 8.151 8.151 7.889 0.262 19502 7403 1 19 . 1 1 779 779 GLN N N 779 117.975 117.975 118.896 -0.921 19502 7404 1 19 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.125 -0.112 19502 7405 1 19 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.123 -0.214 19502 7406 1 19 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.189 0.371 19502 7407 1 19 . 1 1 779 779 GLN H H 779 7.773 7.773 7.724 0.049 19502 7408 1 19 . 1 1 780 780 GLY N N 780 108.214 108.214 108.687 -0.473 19502 7409 1 19 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.225 0.786 19502 7410 1 19 . 1 1 780 780 GLY H H 780 8.273 8.273 8.478 -0.205 19502 7411 1 19 . 1 1 781 781 LYS N N 781 120.027 120.027 121.562 -1.535 19502 7412 1 19 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.669 -0.580 19502 7413 1 19 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.428 0.930 19502 7414 1 19 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.795 -0.109 19502 7415 1 19 . 1 1 781 781 LYS H H 781 7.307 7.307 7.121 0.186 19502 7416 1 19 . 1 1 782 782 GLN N N 782 117.131 117.131 118.835 -1.704 19502 7417 1 19 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.822 -0.054 19502 7418 1 19 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.365 0.430 19502 7419 1 19 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.543 0.010 19502 7420 1 19 . 1 1 782 782 GLN H H 782 7.227 7.227 7.551 -0.324 19502 7421 1 19 . 1 1 783 783 GLU N N 783 117.958 117.958 119.350 -1.392 19502 7422 1 19 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.034 0.169 19502 7423 1 19 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.121 -0.157 19502 7424 1 19 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.162 -0.203 19502 7425 1 19 . 1 1 783 783 GLU H H 783 8.896 8.896 8.647 0.249 19502 7426 1 19 . 1 1 784 784 ALA N N 784 124.176 124.176 122.283 1.893 19502 7427 1 19 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.034 0.100 19502 7428 1 19 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.312 -0.097 19502 7429 1 19 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.443 -0.846 19502 7430 1 19 . 1 1 784 784 ALA H H 784 8.532 8.532 8.029 0.503 19502 7431 1 19 . 1 1 785 785 ALA N N 785 121.847 121.847 120.816 1.031 19502 7432 1 19 . 1 1 785 785 ALA HA H 785 4.042 4.042 4.029 0.013 19502 7433 1 19 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.276 -0.107 19502 7434 1 19 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.287 0.106 19502 7435 1 19 . 1 1 785 785 ALA H H 785 8.402 8.402 8.245 0.157 19502 7436 1 19 . 1 1 786 786 ASP N N 786 120.625 120.625 119.849 0.776 19502 7437 1 19 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.249 -0.097 19502 7438 1 19 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.816 0.354 19502 7439 1 19 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.948 1.568 19502 7440 1 19 . 1 1 786 786 ASP H H 786 8.524 8.524 8.301 0.223 19502 7441 1 19 . 1 1 787 787 ALA N N 787 118.408 118.408 121.697 -3.289 19502 7442 1 19 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.048 -0.072 19502 7443 1 19 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.985 0.131 19502 7444 1 19 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.303 -0.033 19502 7445 1 19 . 1 1 787 787 ALA H H 787 8.191 8.191 8.221 -0.030 19502 7446 1 19 . 1 1 788 788 ALA N N 788 118.510 118.510 121.646 -3.136 19502 7447 1 19 . 1 1 788 788 ALA HA H 788 3.704 3.704 3.926 -0.222 19502 7448 1 19 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.902 -0.009 19502 7449 1 19 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.912 0.661 19502 7450 1 19 . 1 1 788 788 ALA H H 788 7.533 7.533 7.909 -0.376 19502 7451 1 19 . 1 1 789 789 LEU N N 789 117.413 117.413 118.061 -0.648 19502 7452 1 19 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.779 -0.089 19502 7453 1 19 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.565 0.615 19502 7454 1 19 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.189 0.915 19502 7455 1 19 . 1 1 789 789 LEU H H 789 8.520 8.520 7.900 0.620 19502 7456 1 19 . 1 1 790 790 ARG N N 790 116.360 116.360 119.142 -2.782 19502 7457 1 19 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.052 -0.134 19502 7458 1 19 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.326 2.477 19502 7459 1 19 . 1 1 790 790 ARG CB C 790 29.761 29.761 28.977 0.784 19502 7460 1 19 . 1 1 790 790 ARG H H 790 8.293 8.293 8.120 0.173 19502 7461 1 19 . 1 1 791 791 VAL N N 791 120.700 120.700 120.191 0.509 19502 7462 1 19 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.748 0.164 19502 7463 1 19 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.021 0.463 19502 7464 1 19 . 1 1 791 791 VAL CB C 791 31.736 31.736 30.988 0.749 19502 7465 1 19 . 1 1 791 791 VAL H H 791 7.455 7.455 7.816 -0.361 19502 7466 1 19 . 1 1 792 792 LEU N N 792 120.706 120.706 120.154 0.552 19502 7467 1 19 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.820 0.212 19502 7468 1 19 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.251 -0.384 19502 7469 1 19 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.022 1.226 19502 7470 1 19 . 1 1 792 792 LEU H H 792 8.007 8.007 7.938 0.069 19502 7471 1 19 . 1 1 793 793 ILE N N 793 118.876 118.876 118.662 0.214 19502 7472 1 19 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.633 0.096 19502 7473 1 19 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.477 -0.476 19502 7474 1 19 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.501 1.454 19502 7475 1 19 . 1 1 793 793 ILE H H 793 8.778 8.778 8.598 0.180 19502 7476 1 19 . 1 1 794 794 GLY N N 794 107.008 107.008 107.258 -0.250 19502 7477 1 19 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.080 -0.447 19502 7478 1 19 . 1 1 794 794 GLY H H 794 7.810 7.810 8.278 -0.468 19502 7479 1 19 . 1 1 795 795 GLU N N 795 119.866 119.866 121.685 -1.819 19502 7480 1 19 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.057 0.299 19502 7481 1 19 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.895 -1.191 19502 7482 1 19 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.640 0.440 19502 7483 1 19 . 1 1 795 795 GLU H H 795 7.978 7.978 8.563 -0.585 19502 7484 1 19 . 1 1 796 796 ASN N N 796 118.365 118.365 117.193 1.172 19502 7485 1 19 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.493 0.289 19502 7486 1 19 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.847 -1.265 19502 7487 1 19 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.848 1.197 19502 7488 1 19 . 1 1 796 796 ASN H H 796 8.053 8.053 8.113 -0.060 19502 7489 1 19 . 1 1 797 797 GLU N N 797 120.368 120.368 118.641 1.727 19502 7490 1 19 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.148 0.188 19502 7491 1 19 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.150 -0.526 19502 7492 1 19 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.469 0.873 19502 7493 1 19 . 1 1 797 797 GLU H H 797 8.225 8.225 7.817 0.408 19502 7494 1 19 . 1 1 798 798 LYS N N 798 120.614 120.614 116.342 4.272 19502 7495 1 19 . 1 1 798 798 LYS H H 798 8.088 8.088 7.616 0.472 19502 7496 1 19 . 1 1 799 799 ALA N N 799 124.642 124.642 122.447 2.195 19502 7497 1 19 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.501 -0.060 19502 7498 1 19 . 1 1 799 799 ALA CA C 799 52.692 52.692 50.853 1.839 19502 7499 1 19 . 1 1 799 799 ALA CB C 799 19.617 19.617 20.227 -0.610 19502 7500 1 19 . 1 1 799 799 ALA H H 799 8.138 8.138 7.245 0.893 19502 7501 1 19 . 1 1 800 800 GLU N N 800 120.408 120.408 119.785 0.623 19502 7502 1 19 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.415 -0.020 19502 7503 1 19 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.802 1.008 19502 7504 1 19 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.235 1.369 19502 7505 1 19 . 1 1 800 800 GLU H H 800 8.337 8.337 8.564 -0.227 19502 7506 1 20 . 1 1 713 713 VAL N N 713 120.649 120.649 120.599 0.050 19502 7507 1 20 . 1 1 713 713 VAL HA H 713 4.120 4.120 3.919 0.201 19502 7508 1 20 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.976 1.033 19502 7509 1 20 . 1 1 713 713 VAL CB C 713 32.747 32.747 32.153 0.594 19502 7510 1 20 . 1 1 713 713 VAL H H 713 8.051 8.051 7.723 0.328 19502 7511 1 20 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.533 -0.052 19502 7512 1 20 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.500 1.254 19502 7513 1 20 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.425 0.591 19502 7514 1 20 . 1 1 716 716 ILE N N 716 121.593 121.593 118.932 2.661 19502 7515 1 20 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.098 0.001 19502 7516 1 20 . 1 1 716 716 ILE CA C 716 62.829 62.829 61.997 0.832 19502 7517 1 20 . 1 1 716 716 ILE CB C 716 38.166 38.166 36.734 1.432 19502 7518 1 20 . 1 1 716 716 ILE H H 716 8.406 8.406 8.209 0.197 19502 7519 1 20 . 1 1 717 717 GLY N N 717 108.628 108.628 107.951 0.677 19502 7520 1 20 . 1 1 717 717 GLY CA C 717 46.674 46.674 46.807 -0.133 19502 7521 1 20 . 1 1 717 717 GLY H H 717 8.476 8.476 8.606 -0.130 19502 7522 1 20 . 1 1 718 718 GLU N N 718 119.944 119.944 121.543 -1.599 19502 7523 1 20 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.096 0.181 19502 7524 1 20 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.581 -0.395 19502 7525 1 20 . 1 1 718 718 GLU CB C 718 30.037 30.037 28.981 1.056 19502 7526 1 20 . 1 1 718 718 GLU H H 718 8.055 8.055 7.848 0.207 19502 7527 1 20 . 1 1 719 719 LEU N N 719 118.538 118.538 119.114 -0.576 19502 7528 1 20 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.393 -0.015 19502 7529 1 20 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.578 0.764 19502 7530 1 20 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.755 1.286 19502 7531 1 20 . 1 1 719 719 LEU H H 719 8.098 8.098 7.683 0.415 19502 7532 1 20 . 1 1 720 720 VAL N N 720 117.613 117.613 119.116 -1.503 19502 7533 1 20 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.646 0.058 19502 7534 1 20 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.750 -1.131 19502 7535 1 20 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.273 0.651 19502 7536 1 20 . 1 1 720 720 VAL H H 720 7.838 7.838 7.540 0.298 19502 7537 1 20 . 1 1 721 721 ARG N N 721 118.905 118.905 119.532 -0.627 19502 7538 1 20 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.930 0.249 19502 7539 1 20 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.620 -1.200 19502 7540 1 20 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.676 -0.089 19502 7541 1 20 . 1 1 721 721 ARG H H 721 7.614 7.614 7.682 -0.068 19502 7542 1 20 . 1 1 722 722 TYR N N 722 117.574 117.574 117.487 0.087 19502 7543 1 20 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.364 -0.015 19502 7544 1 20 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.192 -0.127 19502 7545 1 20 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.144 0.687 19502 7546 1 20 . 1 1 722 722 TYR H H 722 7.885 7.885 7.188 0.697 19502 7547 1 20 . 1 1 723 723 LEU N N 723 120.520 120.520 116.933 3.587 19502 7548 1 20 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.089 -0.094 19502 7549 1 20 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.529 1.026 19502 7550 1 20 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.959 0.078 19502 7551 1 20 . 1 1 723 723 LEU H H 723 7.794 7.794 7.671 0.123 19502 7552 1 20 . 1 1 724 724 ASN N N 724 115.161 115.161 115.340 -0.179 19502 7553 1 20 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.748 -0.136 19502 7554 1 20 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.323 -0.086 19502 7555 1 20 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.486 -0.209 19502 7556 1 20 . 1 1 724 724 ASN H H 724 8.892 8.892 7.701 1.191 19502 7557 1 20 . 1 1 725 725 THR N N 725 110.273 110.273 115.433 -5.160 19502 7558 1 20 . 1 1 725 725 THR HA H 725 4.527 4.527 4.347 0.180 19502 7559 1 20 . 1 1 725 725 THR CA C 725 62.903 62.903 64.752 -1.849 19502 7560 1 20 . 1 1 725 725 THR CB C 725 70.619 70.619 69.644 0.975 19502 7561 1 20 . 1 1 725 725 THR H H 725 7.874 7.874 8.032 -0.158 19502 7562 1 20 . 1 1 726 726 ASN N N 726 117.048 117.048 117.601 -0.553 19502 7563 1 20 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.103 0.036 19502 7564 1 20 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.674 1.164 19502 7565 1 20 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.662 -1.755 19502 7566 1 20 . 1 1 726 726 ASN H H 726 8.613 8.613 7.951 0.662 19502 7567 1 20 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.371 -0.307 19502 7568 1 20 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.197 0.312 19502 7569 1 20 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.571 -1.126 19502 7570 1 20 . 1 1 728 728 VAL N N 728 118.643 118.643 118.463 0.180 19502 7571 1 20 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.608 -0.208 19502 7572 1 20 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.458 1.108 19502 7573 1 20 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.954 0.472 19502 7574 1 20 . 1 1 728 728 VAL H H 728 8.182 8.182 7.613 0.569 19502 7575 1 20 . 1 1 729 729 GLY N N 729 105.307 105.307 106.621 -1.314 19502 7576 1 20 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.898 0.752 19502 7577 1 20 . 1 1 729 729 GLY H H 729 7.297 7.297 7.938 -0.641 19502 7578 1 20 . 1 1 730 730 GLY N N 730 109.038 109.038 109.401 -0.363 19502 7579 1 20 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.936 0.756 19502 7580 1 20 . 1 1 730 730 GLY H H 730 8.080 8.080 7.151 0.929 19502 7581 1 20 . 1 1 731 731 LEU N N 731 123.822 123.822 123.559 0.263 19502 7582 1 20 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.056 -0.020 19502 7583 1 20 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.383 0.214 19502 7584 1 20 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.515 0.700 19502 7585 1 20 . 1 1 731 731 LEU H H 731 8.287 8.287 8.381 -0.094 19502 7586 1 20 . 1 1 732 732 LEU N N 732 118.759 118.759 118.101 0.658 19502 7587 1 20 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.905 0.181 19502 7588 1 20 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.335 0.173 19502 7589 1 20 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.695 -0.712 19502 7590 1 20 . 1 1 732 732 LEU H H 732 8.412 8.412 8.191 0.221 19502 7591 1 20 . 1 1 733 733 GLU N N 733 121.155 121.155 119.205 1.950 19502 7592 1 20 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.997 0.276 19502 7593 1 20 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.807 0.266 19502 7594 1 20 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.157 -0.177 19502 7595 1 20 . 1 1 733 733 GLU H H 733 8.003 8.003 7.890 0.113 19502 7596 1 20 . 1 1 734 734 TYR N N 734 122.518 122.518 122.998 -0.480 19502 7597 1 20 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.981 0.200 19502 7598 1 20 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.556 0.403 19502 7599 1 20 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.350 -0.506 19502 7600 1 20 . 1 1 734 734 TYR H H 734 8.419 8.419 8.424 -0.005 19502 7601 1 20 . 1 1 735 735 ALA N N 735 122.353 122.353 121.331 1.022 19502 7602 1 20 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.790 0.022 19502 7603 1 20 . 1 1 735 735 ALA CA C 735 56.172 56.172 54.970 1.202 19502 7604 1 20 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.610 0.223 19502 7605 1 20 . 1 1 735 735 ALA H H 735 8.777 8.777 7.766 1.011 19502 7606 1 20 . 1 1 736 736 ARG N N 736 118.852 118.852 117.972 0.880 19502 7607 1 20 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.025 0.148 19502 7608 1 20 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.736 0.787 19502 7609 1 20 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.730 0.426 19502 7610 1 20 . 1 1 736 736 ARG H H 736 8.570 8.570 8.113 0.458 19502 7611 1 20 . 1 1 737 737 SER N N 737 115.125 115.125 113.649 1.476 19502 7612 1 20 . 1 1 737 737 SER HA H 737 4.149 4.149 4.359 -0.210 19502 7613 1 20 . 1 1 737 737 SER CA C 737 61.300 61.300 60.412 0.888 19502 7614 1 20 . 1 1 737 737 SER CB C 737 63.166 63.166 63.479 -0.313 19502 7615 1 20 . 1 1 737 737 SER H H 737 8.257 8.257 8.040 0.217 19502 7616 1 20 . 1 1 738 738 HIS N N 738 117.591 117.591 116.469 1.122 19502 7617 1 20 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.488 -0.148 19502 7618 1 20 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.939 1.069 19502 7619 1 20 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.675 -0.145 19502 7620 1 20 . 1 1 738 738 HIS H H 738 7.300 7.300 7.688 -0.388 19502 7621 1 20 . 1 1 739 739 GLY N N 739 107.604 107.604 107.583 0.021 19502 7622 1 20 . 1 1 739 739 GLY CA C 739 46.131 46.131 44.809 1.321 19502 7623 1 20 . 1 1 739 739 GLY H H 739 7.638 7.638 8.055 -0.417 19502 7624 1 20 . 1 1 740 740 PHE N N 740 118.114 118.114 119.820 -1.706 19502 7625 1 20 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.598 0.589 19502 7626 1 20 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.356 -1.953 19502 7627 1 20 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.258 2.724 19502 7628 1 20 . 1 1 740 740 PHE H H 740 8.138 8.138 7.655 0.483 19502 7629 1 20 . 1 1 741 741 ALA N N 741 122.577 122.577 121.645 0.932 19502 7630 1 20 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.568 0.087 19502 7631 1 20 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.751 0.520 19502 7632 1 20 . 1 1 741 741 ALA CB C 741 19.976 19.976 21.047 -1.071 19502 7633 1 20 . 1 1 741 741 ALA H H 741 8.550 8.550 8.578 -0.028 19502 7634 1 20 . 1 1 742 742 ALA N N 742 124.016 124.016 127.730 -3.714 19502 7635 1 20 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.677 0.229 19502 7636 1 20 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.020 0.009 19502 7637 1 20 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.294 1.066 19502 7638 1 20 . 1 1 742 742 ALA H H 742 8.511 8.511 8.610 -0.099 19502 7639 1 20 . 1 1 743 743 GLU N N 743 120.968 120.968 124.421 -3.453 19502 7640 1 20 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.655 -0.105 19502 7641 1 20 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.739 0.028 19502 7642 1 20 . 1 1 743 743 GLU CB C 743 33.989 33.989 32.720 1.269 19502 7643 1 20 . 1 1 743 743 GLU H H 743 8.628 8.628 8.553 0.075 19502 7644 1 20 . 1 1 744 744 PHE N N 744 120.078 120.078 123.529 -3.451 19502 7645 1 20 . 1 1 744 744 PHE HA H 744 4.815 4.815 4.936 -0.121 19502 7646 1 20 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.173 -0.002 19502 7647 1 20 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.073 0.302 19502 7648 1 20 . 1 1 744 744 PHE H H 744 8.792 8.792 8.995 -0.203 19502 7649 1 20 . 1 1 745 745 LYS N N 745 124.937 124.937 123.659 1.278 19502 7650 1 20 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.816 -0.223 19502 7651 1 20 . 1 1 745 745 LYS CA C 745 55.070 55.070 53.909 1.161 19502 7652 1 20 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.765 -2.220 19502 7653 1 20 . 1 1 745 745 LYS H H 745 9.180 9.180 8.187 0.993 19502 7654 1 20 . 1 1 746 746 LEU N N 746 129.002 129.002 125.106 3.896 19502 7655 1 20 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.751 0.173 19502 7656 1 20 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.865 -0.167 19502 7657 1 20 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.804 -1.225 19502 7658 1 20 . 1 1 746 746 LEU H H 746 8.687 8.687 8.499 0.188 19502 7659 1 20 . 1 1 747 747 VAL N N 747 131.114 131.114 127.744 3.370 19502 7660 1 20 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.947 -0.202 19502 7661 1 20 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.766 -0.632 19502 7662 1 20 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.671 0.300 19502 7663 1 20 . 1 1 747 747 VAL H H 747 9.033 9.033 8.927 0.106 19502 7664 1 20 . 1 1 748 748 ASP N N 748 113.346 113.346 116.354 -3.008 19502 7665 1 20 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.868 -0.084 19502 7666 1 20 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.595 0.739 19502 7667 1 20 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.559 2.632 19502 7668 1 20 . 1 1 748 748 ASP H H 748 7.426 7.426 7.574 -0.148 19502 7669 1 20 . 1 1 749 749 GLN N N 749 120.867 120.867 122.710 -1.843 19502 7670 1 20 . 1 1 749 749 GLN HA H 749 5.070 5.070 4.919 0.151 19502 7671 1 20 . 1 1 749 749 GLN CA C 749 54.603 54.603 55.069 -0.466 19502 7672 1 20 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.469 1.454 19502 7673 1 20 . 1 1 749 749 GLN H H 749 7.647 7.647 8.539 -0.892 19502 7674 1 20 . 1 1 750 750 SER N N 750 119.661 119.661 122.544 -2.883 19502 7675 1 20 . 1 1 750 750 SER HA H 750 4.791 4.791 4.611 0.180 19502 7676 1 20 . 1 1 750 750 SER CA C 750 57.575 57.575 57.092 0.483 19502 7677 1 20 . 1 1 750 750 SER CB C 750 65.910 65.910 62.700 3.210 19502 7678 1 20 . 1 1 750 750 SER H H 750 8.891 8.891 8.135 0.756 19502 7679 1 20 . 1 1 751 751 GLY N N 751 106.531 106.531 110.671 -4.140 19502 7680 1 20 . 1 1 751 751 GLY CA C 751 44.214 44.214 42.934 1.280 19502 7681 1 20 . 1 1 751 751 GLY H H 751 8.183 8.183 7.458 0.725 19502 7682 1 20 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.585 0.263 19502 7683 1 20 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.536 0.002 19502 7684 1 20 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.879 0.019 19502 7685 1 20 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.246 -0.020 19502 7686 1 20 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.995 0.350 19502 7687 1 20 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.517 0.390 19502 7688 1 20 . 1 1 754 754 HIS N N 754 109.780 109.780 113.671 -3.891 19502 7689 1 20 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.662 0.096 19502 7690 1 20 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.771 -0.542 19502 7691 1 20 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.215 0.279 19502 7692 1 20 . 1 1 754 754 HIS H H 754 7.707 7.707 8.203 -0.496 19502 7693 1 20 . 1 1 755 755 GLU N N 755 122.843 122.843 120.446 2.397 19502 7694 1 20 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.625 -0.013 19502 7695 1 20 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.337 1.312 19502 7696 1 20 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.587 0.226 19502 7697 1 20 . 1 1 755 755 GLU H H 755 7.404 7.404 6.957 0.447 19502 7698 1 20 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.047 0.570 19502 7699 1 20 . 1 1 756 756 PRO CA C 756 63.116 63.116 63.213 -0.097 19502 7700 1 20 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.020 2.231 19502 7701 1 20 . 1 1 757 757 LYS N N 757 119.032 119.032 122.784 -3.752 19502 7702 1 20 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.611 -0.007 19502 7703 1 20 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.131 0.513 19502 7704 1 20 . 1 1 757 757 LYS CB C 757 35.196 35.196 34.448 0.748 19502 7705 1 20 . 1 1 757 757 LYS H H 757 8.195 8.195 7.437 0.758 19502 7706 1 20 . 1 1 758 758 PHE N N 758 120.288 120.288 124.330 -4.042 19502 7707 1 20 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.735 0.305 19502 7708 1 20 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.739 0.077 19502 7709 1 20 . 1 1 758 758 PHE CB C 758 43.300 43.300 41.990 1.310 19502 7710 1 20 . 1 1 758 758 PHE H H 758 8.844 8.844 9.248 -0.404 19502 7711 1 20 . 1 1 759 759 VAL N N 759 121.385 121.385 123.189 -1.804 19502 7712 1 20 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.802 0.590 19502 7713 1 20 . 1 1 759 759 VAL CA C 759 60.650 60.650 62.068 -1.418 19502 7714 1 20 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.672 1.566 19502 7715 1 20 . 1 1 759 759 VAL H H 759 8.609 8.609 9.312 -0.703 19502 7716 1 20 . 1 1 760 760 TYR N N 760 126.374 126.374 128.569 -2.195 19502 7717 1 20 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.392 0.405 19502 7718 1 20 . 1 1 760 760 TYR CA C 760 56.920 56.920 56.618 0.302 19502 7719 1 20 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.599 4.254 19502 7720 1 20 . 1 1 760 760 TYR H H 760 8.903 8.903 9.478 -0.575 19502 7721 1 20 . 1 1 761 761 GLN N N 761 115.228 115.228 122.081 -6.853 19502 7722 1 20 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.749 -0.925 19502 7723 1 20 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.606 1.920 19502 7724 1 20 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.814 -0.496 19502 7725 1 20 . 1 1 761 761 GLN H H 761 9.016 9.016 8.426 0.590 19502 7726 1 20 . 1 1 762 762 ALA N N 762 128.023 128.023 129.745 -1.722 19502 7727 1 20 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.701 0.480 19502 7728 1 20 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.490 0.385 19502 7729 1 20 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.539 0.612 19502 7730 1 20 . 1 1 762 762 ALA H H 762 9.500 9.500 8.553 0.947 19502 7731 1 20 . 1 1 763 763 LYS N N 763 122.022 122.022 127.380 -5.358 19502 7732 1 20 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.500 0.364 19502 7733 1 20 . 1 1 763 763 LYS CA C 763 55.145 55.145 55.000 0.145 19502 7734 1 20 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.081 3.374 19502 7735 1 20 . 1 1 763 763 LYS H H 763 8.347 8.347 8.759 -0.412 19502 7736 1 20 . 1 1 764 764 VAL N N 764 123.980 123.980 127.932 -3.952 19502 7737 1 20 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.873 -0.246 19502 7738 1 20 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.891 0.075 19502 7739 1 20 . 1 1 764 764 VAL CB C 764 34.820 34.820 31.015 3.805 19502 7740 1 20 . 1 1 764 764 VAL H H 764 8.703 8.703 8.502 0.201 19502 7741 1 20 . 1 1 765 765 GLY N N 765 119.292 119.292 118.354 0.938 19502 7742 1 20 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.379 0.244 19502 7743 1 20 . 1 1 765 765 GLY H H 765 9.151 9.151 8.958 0.193 19502 7744 1 20 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.255 0.935 19502 7745 1 20 . 1 1 767 767 ARG N N 767 119.571 119.571 121.752 -2.181 19502 7746 1 20 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.735 -0.342 19502 7747 1 20 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.100 1.249 19502 7748 1 20 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.595 -0.276 19502 7749 1 20 . 1 1 767 767 ARG H H 767 7.595 7.595 7.559 0.036 19502 7750 1 20 . 1 1 768 768 TRP N N 768 122.976 122.976 126.667 -3.691 19502 7751 1 20 . 1 1 768 768 TRP HA H 768 4.570 4.570 4.908 -0.338 19502 7752 1 20 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.085 0.381 19502 7753 1 20 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.030 1.188 19502 7754 1 20 . 1 1 768 768 TRP H H 768 8.056 8.056 8.899 -0.843 19502 7755 1 20 . 1 1 769 769 PHE N N 769 116.997 116.997 123.344 -6.347 19502 7756 1 20 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.842 -0.092 19502 7757 1 20 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.210 2.519 19502 7758 1 20 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.640 -1.343 19502 7759 1 20 . 1 1 769 769 PHE H H 769 7.532 7.532 8.737 -1.205 19502 7760 1 20 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.726 -0.002 19502 7761 1 20 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.665 2.634 19502 7762 1 20 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.841 -0.066 19502 7763 1 20 . 1 1 771 771 ALA N N 771 125.979 125.979 122.351 3.628 19502 7764 1 20 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.102 0.132 19502 7765 1 20 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.995 -0.353 19502 7766 1 20 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.393 0.262 19502 7767 1 20 . 1 1 771 771 ALA H H 771 9.069 9.069 8.171 0.898 19502 7768 1 20 . 1 1 772 772 VAL N N 772 113.901 113.901 118.213 -4.312 19502 7769 1 20 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.762 0.049 19502 7770 1 20 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.559 -0.410 19502 7771 1 20 . 1 1 772 772 VAL CB C 772 35.246 35.246 35.242 0.004 19502 7772 1 20 . 1 1 772 772 VAL H H 772 9.024 9.024 9.068 -0.044 19502 7773 1 20 . 1 1 773 773 CYS N N 773 119.222 119.222 118.472 0.750 19502 7774 1 20 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.734 -0.127 19502 7775 1 20 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.790 -0.032 19502 7776 1 20 . 1 1 773 773 CYS CB C 773 29.841 29.841 30.880 -1.039 19502 7777 1 20 . 1 1 773 773 CYS H H 773 8.597 8.597 8.300 0.297 19502 7778 1 20 . 1 1 774 774 ALA N N 774 124.328 124.328 126.283 -1.955 19502 7779 1 20 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.784 0.019 19502 7780 1 20 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.713 0.518 19502 7781 1 20 . 1 1 774 774 ALA CB C 774 24.125 24.125 22.428 1.697 19502 7782 1 20 . 1 1 774 774 ALA H H 774 9.238 9.238 8.765 0.473 19502 7783 1 20 . 1 1 775 775 HIS HA H 775 5.256 5.256 4.608 0.648 19502 7784 1 20 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.784 0.745 19502 7785 1 20 . 1 1 775 775 HIS CB C 775 30.133 30.133 29.559 0.574 19502 7786 1 20 . 1 1 776 776 SER N N 776 110.366 110.366 112.261 -1.895 19502 7787 1 20 . 1 1 776 776 SER HA H 776 4.766 4.766 4.689 0.077 19502 7788 1 20 . 1 1 776 776 SER CA C 776 57.029 57.029 56.155 0.874 19502 7789 1 20 . 1 1 776 776 SER H H 776 7.550 7.550 7.257 0.293 19502 7790 1 20 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.820 -0.233 19502 7791 1 20 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.658 0.778 19502 7792 1 20 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.126 0.078 19502 7793 1 20 . 1 1 778 778 LYS N N 778 118.469 118.469 118.954 -0.485 19502 7794 1 20 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.895 -0.131 19502 7795 1 20 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.361 0.550 19502 7796 1 20 . 1 1 778 778 LYS CB C 778 33.685 33.685 32.082 1.603 19502 7797 1 20 . 1 1 778 778 LYS H H 778 8.151 8.151 7.901 0.250 19502 7798 1 20 . 1 1 779 779 GLN N N 779 117.975 117.975 117.249 0.726 19502 7799 1 20 . 1 1 779 779 GLN HA H 779 4.013 4.013 3.996 0.017 19502 7800 1 20 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.698 -0.789 19502 7801 1 20 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.300 0.260 19502 7802 1 20 . 1 1 779 779 GLN H H 779 7.773 7.773 8.268 -0.495 19502 7803 1 20 . 1 1 780 780 GLY N N 780 108.214 108.214 108.015 0.199 19502 7804 1 20 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.010 1.001 19502 7805 1 20 . 1 1 780 780 GLY H H 780 8.273 8.273 8.483 -0.210 19502 7806 1 20 . 1 1 781 781 LYS N N 781 120.027 120.027 121.764 -1.737 19502 7807 1 20 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.740 -0.651 19502 7808 1 20 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.670 0.688 19502 7809 1 20 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.837 -0.151 19502 7810 1 20 . 1 1 781 781 LYS H H 781 7.307 7.307 7.155 0.152 19502 7811 1 20 . 1 1 782 782 GLN N N 782 117.131 117.131 118.460 -1.329 19502 7812 1 20 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.889 -0.121 19502 7813 1 20 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.238 0.557 19502 7814 1 20 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.598 -0.045 19502 7815 1 20 . 1 1 782 782 GLN H H 782 7.227 7.227 7.495 -0.268 19502 7816 1 20 . 1 1 783 783 GLU N N 783 117.958 117.958 119.647 -1.689 19502 7817 1 20 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.030 0.173 19502 7818 1 20 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.194 -0.230 19502 7819 1 20 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.190 -0.231 19502 7820 1 20 . 1 1 783 783 GLU H H 783 8.896 8.896 8.679 0.217 19502 7821 1 20 . 1 1 784 784 ALA N N 784 124.176 124.176 122.456 1.720 19502 7822 1 20 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.047 0.087 19502 7823 1 20 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.395 -0.180 19502 7824 1 20 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.483 -0.886 19502 7825 1 20 . 1 1 784 784 ALA H H 784 8.532 8.532 8.119 0.413 19502 7826 1 20 . 1 1 785 785 ALA N N 785 121.847 121.847 120.393 1.454 19502 7827 1 20 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.996 0.046 19502 7828 1 20 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.221 -0.052 19502 7829 1 20 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.224 0.169 19502 7830 1 20 . 1 1 785 785 ALA H H 785 8.402 8.402 8.135 0.267 19502 7831 1 20 . 1 1 786 786 ASP N N 786 120.625 120.625 120.054 0.571 19502 7832 1 20 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.268 -0.116 19502 7833 1 20 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.790 0.381 19502 7834 1 20 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.896 1.620 19502 7835 1 20 . 1 1 786 786 ASP H H 786 8.524 8.524 8.232 0.292 19502 7836 1 20 . 1 1 787 787 ALA N N 787 118.408 118.408 121.694 -3.286 19502 7837 1 20 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.089 -0.113 19502 7838 1 20 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.897 0.219 19502 7839 1 20 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.371 -0.101 19502 7840 1 20 . 1 1 787 787 ALA H H 787 8.191 8.191 8.082 0.109 19502 7841 1 20 . 1 1 788 788 ALA N N 788 118.510 118.510 121.832 -3.322 19502 7842 1 20 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.050 -0.346 19502 7843 1 20 . 1 1 788 788 ALA CA C 788 54.893 54.893 55.009 -0.116 19502 7844 1 20 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.951 0.622 19502 7845 1 20 . 1 1 788 788 ALA H H 788 7.533 7.533 8.083 -0.550 19502 7846 1 20 . 1 1 789 789 LEU N N 789 117.413 117.413 118.273 -0.860 19502 7847 1 20 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.823 -0.133 19502 7848 1 20 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.651 0.529 19502 7849 1 20 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.312 0.792 19502 7850 1 20 . 1 1 789 789 LEU H H 789 8.520 8.520 7.892 0.628 19502 7851 1 20 . 1 1 790 790 ARG N N 790 116.360 116.360 119.019 -2.659 19502 7852 1 20 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.040 -0.122 19502 7853 1 20 . 1 1 790 790 ARG CA C 790 60.803 60.803 58.574 2.229 19502 7854 1 20 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.221 0.540 19502 7855 1 20 . 1 1 790 790 ARG H H 790 8.293 8.293 7.888 0.405 19502 7856 1 20 . 1 1 791 791 VAL N N 791 120.700 120.700 120.371 0.329 19502 7857 1 20 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.635 0.277 19502 7858 1 20 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.464 0.020 19502 7859 1 20 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.546 0.190 19502 7860 1 20 . 1 1 791 791 VAL H H 791 7.455 7.455 7.989 -0.534 19502 7861 1 20 . 1 1 792 792 LEU N N 792 120.706 120.706 119.910 0.796 19502 7862 1 20 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.851 0.181 19502 7863 1 20 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.055 -0.188 19502 7864 1 20 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.157 1.091 19502 7865 1 20 . 1 1 792 792 LEU H H 792 8.007 8.007 7.900 0.107 19502 7866 1 20 . 1 1 793 793 ILE N N 793 118.876 118.876 118.595 0.281 19502 7867 1 20 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.632 0.097 19502 7868 1 20 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.520 -0.519 19502 7869 1 20 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.429 1.526 19502 7870 1 20 . 1 1 793 793 ILE H H 793 8.778 8.778 8.630 0.148 19502 7871 1 20 . 1 1 794 794 GLY N N 794 107.008 107.008 107.609 -0.601 19502 7872 1 20 . 1 1 794 794 GLY CA C 794 46.633 46.633 47.249 -0.616 19502 7873 1 20 . 1 1 794 794 GLY H H 794 7.810 7.810 8.274 -0.464 19502 7874 1 20 . 1 1 795 795 GLU N N 795 119.866 119.866 121.949 -2.083 19502 7875 1 20 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.002 0.354 19502 7876 1 20 . 1 1 795 795 GLU CA C 795 57.704 57.704 59.002 -1.298 19502 7877 1 20 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.553 0.527 19502 7878 1 20 . 1 1 795 795 GLU H H 795 7.978 7.978 8.372 -0.394 19502 7879 1 20 . 1 1 796 796 ASN N N 796 118.365 118.365 116.593 1.772 19502 7880 1 20 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.565 0.217 19502 7881 1 20 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.797 -1.215 19502 7882 1 20 . 1 1 796 796 ASN CB C 796 40.045 40.045 38.894 1.151 19502 7883 1 20 . 1 1 796 796 ASN H H 796 8.053 8.053 7.862 0.191 19502 7884 1 20 . 1 1 797 797 GLU N N 797 120.368 120.368 120.785 -0.417 19502 7885 1 20 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.043 0.293 19502 7886 1 20 . 1 1 797 797 GLU CA C 797 57.624 57.624 59.315 -1.691 19502 7887 1 20 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.759 0.583 19502 7888 1 20 . 1 1 797 797 GLU H H 797 8.225 8.225 8.322 -0.097 19502 7889 1 20 . 1 1 798 798 LYS N N 798 120.614 120.614 117.657 2.957 19502 7890 1 20 . 1 1 798 798 LYS H H 798 8.088 8.088 8.287 -0.199 19502 7891 1 20 . 1 1 799 799 ALA N N 799 124.642 124.642 121.568 3.074 19502 7892 1 20 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.304 0.137 19502 7893 1 20 . 1 1 799 799 ALA CA C 799 52.692 52.692 53.892 -1.200 19502 7894 1 20 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.117 0.500 19502 7895 1 20 . 1 1 799 799 ALA H H 799 8.138 8.138 7.411 0.727 19502 7896 1 20 . 1 1 800 800 GLU N N 800 120.408 120.408 117.901 2.507 19502 7897 1 20 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.306 0.089 19502 7898 1 20 . 1 1 800 800 GLU CA C 800 56.810 56.810 55.876 0.934 19502 7899 1 20 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.749 0.855 19502 7900 1 20 . 1 1 800 800 GLU H H 800 8.337 8.337 8.221 0.116 19502 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 78 2.606 0.895 2.463 19502 2 1 1 "Average Difference" HA 95 0.272 -0.006 0.273 19502 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19502 4 1 1 "Average Difference" CA 86 0.865 -0.319 0.808 19502 5 1 1 "Average Difference" CB 76 1.390 -0.561 1.281 19502 6 1 1 "Average Difference" HN 78 0.483 -0.097 0.476 19502 7 1 2 "Average Difference" N 78 2.777 1.168 2.536 19502 8 1 2 "Average Difference" HA 95 0.288 -0.039 0.286 19502 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19502 10 1 2 "Average Difference" CA 86 0.935 -0.430 0.835 19502 11 1 2 "Average Difference" CB 76 1.473 -0.660 1.326 19502 12 1 2 "Average Difference" HN 78 0.474 -0.094 0.468 19502 13 1 3 "Average Difference" N 78 2.593 0.789 2.486 19502 14 1 3 "Average Difference" HA 95 0.280 -0.025 0.280 19502 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19502 16 1 3 "Average Difference" CA 86 0.840 -0.186 0.824 19502 17 1 3 "Average Difference" CB 76 1.321 -0.617 1.175 19502 18 1 3 "Average Difference" HN 78 0.454 -0.055 0.453 19502 19 1 4 "Average Difference" N 78 2.653 0.928 2.501 19502 20 1 4 "Average Difference" HA 95 0.302 -0.018 0.303 19502 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19502 22 1 4 "Average Difference" CA 86 0.990 -0.230 0.968 19502 23 1 4 "Average Difference" CB 76 1.382 -0.623 1.242 19502 24 1 4 "Average Difference" HN 78 0.493 -0.040 0.494 19502 25 1 5 "Average Difference" N 78 2.873 0.920 2.739 19502 26 1 5 "Average Difference" HA 95 0.272 -0.023 0.273 19502 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19502 28 1 5 "Average Difference" CA 86 0.909 -0.208 0.890 19502 29 1 5 "Average Difference" CB 76 1.347 -0.527 1.248 19502 30 1 5 "Average Difference" HN 78 0.489 -0.027 0.491 19502 31 1 6 "Average Difference" N 78 2.734 0.932 2.587 19502 32 1 6 "Average Difference" HA 95 0.296 -0.044 0.294 19502 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19502 34 1 6 "Average Difference" CA 86 0.932 -0.249 0.904 19502 35 1 6 "Average Difference" CB 76 1.310 -0.601 1.171 19502 36 1 6 "Average Difference" HN 78 0.474 -0.053 0.474 19502 37 1 7 "Average Difference" N 78 2.862 0.966 2.712 19502 38 1 7 "Average Difference" HA 95 0.269 -0.024 0.269 19502 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19502 40 1 7 "Average Difference" CA 86 0.872 -0.248 0.841 19502 41 1 7 "Average Difference" CB 76 1.279 -0.557 1.159 19502 42 1 7 "Average Difference" HN 78 0.461 -0.046 0.462 19502 43 1 8 "Average Difference" N 78 2.732 0.931 2.585 19502 44 1 8 "Average Difference" HA 95 0.314 -0.057 0.310 19502 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19502 46 1 8 "Average Difference" CA 86 0.856 -0.186 0.841 19502 47 1 8 "Average Difference" CB 76 1.365 -0.539 1.262 19502 48 1 8 "Average Difference" HN 78 0.512 -0.044 0.514 19502 49 1 9 "Average Difference" N 78 2.948 1.013 2.787 19502 50 1 9 "Average Difference" HA 95 0.271 -0.029 0.271 19502 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19502 52 1 9 "Average Difference" CA 86 0.846 -0.263 0.808 19502 53 1 9 "Average Difference" CB 76 1.347 -0.589 1.220 19502 54 1 9 "Average Difference" HN 78 0.481 -0.020 0.484 19502 55 1 10 "Average Difference" N 78 2.886 1.102 2.685 19502 56 1 10 "Average Difference" HA 95 0.296 -0.019 0.297 19502 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19502 58 1 10 "Average Difference" CA 86 0.894 -0.327 0.836 19502 59 1 10 "Average Difference" CB 76 1.386 -0.517 1.295 19502 60 1 10 "Average Difference" HN 78 0.481 -0.064 0.480 19502 61 1 11 "Average Difference" N 78 2.501 0.948 2.330 19502 62 1 11 "Average Difference" HA 95 0.289 -0.010 0.291 19502 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19502 64 1 11 "Average Difference" CA 86 0.889 -0.205 0.870 19502 65 1 11 "Average Difference" CB 76 1.407 -0.544 1.306 19502 66 1 11 "Average Difference" HN 78 0.505 -0.032 0.508 19502 67 1 12 "Average Difference" N 78 2.644 0.854 2.519 19502 68 1 12 "Average Difference" HA 95 0.292 -0.014 0.293 19502 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19502 70 1 12 "Average Difference" CA 86 0.873 -0.313 0.819 19502 71 1 12 "Average Difference" CB 76 1.266 -0.498 1.171 19502 72 1 12 "Average Difference" HN 78 0.453 -0.054 0.453 19502 73 1 13 "Average Difference" N 78 2.647 0.889 2.510 19502 74 1 13 "Average Difference" HA 95 0.277 -0.010 0.278 19502 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19502 76 1 13 "Average Difference" CA 86 0.911 -0.363 0.841 19502 77 1 13 "Average Difference" CB 76 1.300 -0.474 1.219 19502 78 1 13 "Average Difference" HN 78 0.479 -0.041 0.480 19502 79 1 14 "Average Difference" N 78 2.721 0.855 2.599 19502 80 1 14 "Average Difference" HA 95 0.285 -0.024 0.286 19502 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19502 82 1 14 "Average Difference" CA 86 0.873 -0.234 0.846 19502 83 1 14 "Average Difference" CB 76 1.388 -0.495 1.305 19502 84 1 14 "Average Difference" HN 78 0.492 -0.072 0.490 19502 85 1 15 "Average Difference" N 78 2.685 0.905 2.544 19502 86 1 15 "Average Difference" HA 95 0.299 -0.061 0.294 19502 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19502 88 1 15 "Average Difference" CA 86 0.944 -0.228 0.922 19502 89 1 15 "Average Difference" CB 76 1.375 -0.582 1.254 19502 90 1 15 "Average Difference" HN 78 0.457 -0.102 0.448 19502 91 1 16 "Average Difference" N 78 2.598 0.866 2.466 19502 92 1 16 "Average Difference" HA 95 0.279 0.013 0.280 19502 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19502 94 1 16 "Average Difference" CA 86 0.889 -0.379 0.809 19502 95 1 16 "Average Difference" CB 76 1.384 -0.537 1.284 19502 96 1 16 "Average Difference" HN 78 0.458 -0.045 0.458 19502 97 1 17 "Average Difference" N 78 2.650 0.854 2.525 19502 98 1 17 "Average Difference" HA 95 0.283 -0.011 0.285 19502 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19502 100 1 17 "Average Difference" CA 86 0.874 -0.228 0.848 19502 101 1 17 "Average Difference" CB 76 1.449 -0.492 1.372 19502 102 1 17 "Average Difference" HN 78 0.462 -0.023 0.465 19502 103 1 18 "Average Difference" N 78 2.582 0.758 2.484 19502 104 1 18 "Average Difference" HA 95 0.292 -0.002 0.293 19502 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19502 106 1 18 "Average Difference" CA 86 0.942 -0.299 0.898 19502 107 1 18 "Average Difference" CB 76 1.223 -0.372 1.173 19502 108 1 18 "Average Difference" HN 78 0.471 -0.052 0.471 19502 109 1 19 "Average Difference" N 78 2.727 0.871 2.601 19502 110 1 19 "Average Difference" HA 95 0.269 -0.008 0.271 19502 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19502 112 1 19 "Average Difference" CA 86 0.904 -0.283 0.864 19502 113 1 19 "Average Difference" CB 76 1.347 -0.603 1.212 19502 114 1 19 "Average Difference" HN 78 0.466 -0.062 0.465 19502 115 1 20 "Average Difference" N 78 2.536 0.779 2.429 19502 116 1 20 "Average Difference" HA 95 0.283 -0.023 0.283 19502 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19502 118 1 20 "Average Difference" CA 86 0.926 -0.274 0.890 19502 119 1 20 "Average Difference" CB 76 1.293 -0.560 1.173 19502 120 1 20 "Average Difference" HN 78 0.497 -0.115 0.486 19502 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 19502 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 713 713 VAL N N 713 120.649 120.649 121.226 -0.577 19502 2 1 . 1 1 713 713 VAL HA H 713 4.120 4.120 4.149 -0.029 19502 3 1 . 1 1 713 713 VAL CA C 713 63.009 63.009 61.569 1.440 19502 4 1 . 1 1 713 713 VAL CB C 713 32.747 32.747 33.425 -0.678 19502 5 1 . 1 1 713 713 VAL H H 713 8.051 8.051 8.105 -0.054 19502 6 1 . 1 1 715 715 LYS HA H 715 4.481 4.481 4.451 0.030 19502 7 1 . 1 1 715 715 LYS CA C 715 56.754 56.754 55.609 1.145 19502 8 1 . 1 1 715 715 LYS CB C 715 33.015 33.015 32.596 0.419 19502 9 1 . 1 1 716 716 ILE N N 716 121.593 121.593 123.191 -1.598 19502 10 1 . 1 1 716 716 ILE HA H 716 4.099 4.099 4.050 0.049 19502 11 1 . 1 1 716 716 ILE CA C 716 62.829 62.829 62.415 0.414 19502 12 1 . 1 1 716 716 ILE CB C 716 38.166 38.166 37.545 0.621 19502 13 1 . 1 1 716 716 ILE H H 716 8.406 8.406 8.335 0.071 19502 14 1 . 1 1 717 717 GLY N N 717 108.628 108.628 107.762 0.866 19502 15 1 . 1 1 717 717 GLY CA C 717 46.674 46.674 47.056 -0.382 19502 16 1 . 1 1 717 717 GLY H H 717 8.476 8.476 8.709 -0.233 19502 17 1 . 1 1 718 718 GLU N N 718 119.944 119.944 121.398 -1.454 19502 18 1 . 1 1 718 718 GLU HA H 718 4.277 4.277 4.147 0.130 19502 19 1 . 1 1 718 718 GLU CA C 718 58.187 58.187 58.749 -0.562 19502 20 1 . 1 1 718 718 GLU CB C 718 30.037 30.037 29.273 0.764 19502 21 1 . 1 1 718 718 GLU H H 718 8.055 8.055 7.859 0.196 19502 22 1 . 1 1 719 719 LEU N N 719 118.538 118.538 119.361 -0.823 19502 23 1 . 1 1 719 719 LEU HA H 719 4.378 4.378 4.363 0.015 19502 24 1 . 1 1 719 719 LEU CA C 719 57.342 57.342 56.968 0.374 19502 25 1 . 1 1 719 719 LEU CB C 719 42.040 42.040 40.764 1.276 19502 26 1 . 1 1 719 719 LEU H H 719 8.098 8.098 7.685 0.413 19502 27 1 . 1 1 720 720 VAL N N 720 117.613 117.613 118.767 -1.154 19502 28 1 . 1 1 720 720 VAL HA H 720 3.704 3.704 3.652 0.052 19502 29 1 . 1 1 720 720 VAL CA C 720 65.619 65.619 66.688 -1.069 19502 30 1 . 1 1 720 720 VAL CB C 720 31.924 31.924 31.224 0.700 19502 31 1 . 1 1 720 720 VAL H H 720 7.838 7.838 7.728 0.110 19502 32 1 . 1 1 721 721 ARG N N 721 118.905 118.905 119.714 -0.809 19502 33 1 . 1 1 721 721 ARG HA H 721 4.179 4.179 3.977 0.202 19502 34 1 . 1 1 721 721 ARG CA C 721 58.420 58.420 59.295 -0.875 19502 35 1 . 1 1 721 721 ARG CB C 721 29.587 29.587 29.474 0.113 19502 36 1 . 1 1 721 721 ARG H H 721 7.614 7.614 7.611 0.003 19502 37 1 . 1 1 722 722 TYR N N 722 117.574 117.574 118.362 -0.788 19502 38 1 . 1 1 722 722 TYR HA H 722 4.349 4.349 4.349 -0.000 19502 39 1 . 1 1 722 722 TYR CA C 722 60.065 60.065 60.940 -0.875 19502 40 1 . 1 1 722 722 TYR CB C 722 38.831 38.831 38.270 0.561 19502 41 1 . 1 1 722 722 TYR H H 722 7.885 7.885 7.477 0.408 19502 42 1 . 1 1 723 723 LEU N N 723 120.520 120.520 117.369 3.151 19502 43 1 . 1 1 723 723 LEU HA H 723 3.995 3.995 4.067 -0.072 19502 44 1 . 1 1 723 723 LEU CA C 723 57.555 57.555 56.847 0.708 19502 45 1 . 1 1 723 723 LEU CB C 723 42.038 42.038 41.872 0.166 19502 46 1 . 1 1 723 723 LEU H H 723 7.794 7.794 7.627 0.167 19502 47 1 . 1 1 724 724 ASN N N 724 115.161 115.161 115.413 -0.252 19502 48 1 . 1 1 724 724 ASN HA H 724 4.612 4.612 4.681 -0.069 19502 49 1 . 1 1 724 724 ASN CA C 724 55.237 55.237 55.268 -0.031 19502 50 1 . 1 1 724 724 ASN CB C 724 39.277 39.277 39.246 0.031 19502 51 1 . 1 1 724 724 ASN H H 724 8.892 8.892 7.712 1.180 19502 52 1 . 1 1 725 725 THR N N 725 110.273 110.273 114.789 -4.516 19502 53 1 . 1 1 725 725 THR HA H 725 4.527 4.527 4.322 0.205 19502 54 1 . 1 1 725 725 THR CA C 725 62.903 62.903 64.439 -1.536 19502 55 1 . 1 1 725 725 THR CB C 725 70.619 70.619 69.729 0.890 19502 56 1 . 1 1 725 725 THR H H 725 7.874 7.874 7.857 0.017 19502 57 1 . 1 1 726 726 ASN N N 726 117.048 117.048 118.307 -1.259 19502 58 1 . 1 1 726 726 ASN HA H 726 5.139 5.139 5.123 0.016 19502 59 1 . 1 1 726 726 ASN CA C 726 51.838 51.838 50.578 1.260 19502 60 1 . 1 1 726 726 ASN CB C 726 37.907 37.907 39.850 -1.943 19502 61 1 . 1 1 726 726 ASN H H 726 8.613 8.613 7.957 0.656 19502 62 1 . 1 1 727 727 PRO HA H 727 4.064 4.064 4.375 -0.311 19502 63 1 . 1 1 727 727 PRO CA C 727 65.509 65.509 65.257 0.252 19502 64 1 . 1 1 727 727 PRO CB C 727 31.445 31.445 32.482 -1.037 19502 65 1 . 1 1 728 728 VAL N N 728 118.643 118.643 118.754 -0.111 19502 66 1 . 1 1 728 728 VAL HA H 728 3.400 3.400 3.673 -0.273 19502 67 1 . 1 1 728 728 VAL CA C 728 67.566 67.566 66.506 1.060 19502 68 1 . 1 1 728 728 VAL CB C 728 31.426 31.426 30.854 0.572 19502 69 1 . 1 1 728 728 VAL H H 728 8.182 8.182 7.759 0.423 19502 70 1 . 1 1 729 729 GLY N N 729 105.307 105.307 106.946 -1.639 19502 71 1 . 1 1 729 729 GLY CA C 729 47.650 47.650 46.841 0.809 19502 72 1 . 1 1 729 729 GLY H H 729 7.297 7.297 8.313 -1.016 19502 73 1 . 1 1 730 730 GLY N N 730 109.038 109.038 109.578 -0.540 19502 74 1 . 1 1 730 730 GLY CA C 730 46.692 46.692 45.959 0.733 19502 75 1 . 1 1 730 730 GLY H H 730 8.080 8.080 7.388 0.692 19502 76 1 . 1 1 731 731 LEU N N 731 123.822 123.822 123.574 0.248 19502 77 1 . 1 1 731 731 LEU HA H 731 4.036 4.036 4.032 0.004 19502 78 1 . 1 1 731 731 LEU CA C 731 57.596 57.596 57.433 0.164 19502 79 1 . 1 1 731 731 LEU CB C 731 42.215 42.215 41.543 0.672 19502 80 1 . 1 1 731 731 LEU H H 731 8.287 8.287 8.210 0.077 19502 81 1 . 1 1 732 732 LEU N N 732 118.759 118.759 118.248 0.511 19502 82 1 . 1 1 732 732 LEU HA H 732 4.086 4.086 3.903 0.183 19502 83 1 . 1 1 732 732 LEU CA C 732 58.508 58.508 58.184 0.324 19502 84 1 . 1 1 732 732 LEU CB C 732 40.983 40.983 41.506 -0.523 19502 85 1 . 1 1 732 732 LEU H H 732 8.412 8.412 8.085 0.327 19502 86 1 . 1 1 733 733 GLU N N 733 121.155 121.155 119.754 1.401 19502 87 1 . 1 1 733 733 GLU HA H 733 4.273 4.273 3.982 0.291 19502 88 1 . 1 1 733 733 GLU CA C 733 59.073 59.073 58.967 0.107 19502 89 1 . 1 1 733 733 GLU CB C 733 28.980 28.980 29.048 -0.068 19502 90 1 . 1 1 733 733 GLU H H 733 8.003 8.003 7.971 0.032 19502 91 1 . 1 1 734 734 TYR N N 734 122.518 122.518 121.952 0.566 19502 92 1 . 1 1 734 734 TYR HA H 734 4.181 4.181 3.971 0.210 19502 93 1 . 1 1 734 734 TYR CA C 734 61.959 61.959 61.505 0.454 19502 94 1 . 1 1 734 734 TYR CB C 734 37.844 37.844 38.248 -0.404 19502 95 1 . 1 1 734 734 TYR H H 734 8.419 8.419 8.412 0.007 19502 96 1 . 1 1 735 735 ALA N N 735 122.353 122.353 121.140 1.213 19502 97 1 . 1 1 735 735 ALA HA H 735 3.812 3.812 3.784 0.028 19502 98 1 . 1 1 735 735 ALA CA C 735 56.172 56.172 55.026 1.146 19502 99 1 . 1 1 735 735 ALA CB C 735 18.833 18.833 18.552 0.281 19502 100 1 . 1 1 735 735 ALA H H 735 8.777 8.777 7.868 0.910 19502 101 1 . 1 1 736 736 ARG N N 736 118.852 118.852 118.077 0.775 19502 102 1 . 1 1 736 736 ARG HA H 736 4.173 4.173 4.044 0.129 19502 103 1 . 1 1 736 736 ARG CA C 736 59.523 59.523 58.737 0.786 19502 104 1 . 1 1 736 736 ARG CB C 736 30.156 30.156 29.822 0.334 19502 105 1 . 1 1 736 736 ARG H H 736 8.570 8.570 8.230 0.340 19502 106 1 . 1 1 737 737 SER N N 737 115.125 115.125 113.324 1.801 19502 107 1 . 1 1 737 737 SER HA H 737 4.149 4.149 4.368 -0.219 19502 108 1 . 1 1 737 737 SER CA C 737 61.300 61.300 60.233 1.067 19502 109 1 . 1 1 737 737 SER CB C 737 63.166 63.166 63.546 -0.380 19502 110 1 . 1 1 737 737 SER H H 737 8.257 8.257 8.147 0.110 19502 111 1 . 1 1 738 738 HIS N N 738 117.591 117.591 116.763 0.828 19502 112 1 . 1 1 738 738 HIS HA H 738 4.340 4.340 4.544 -0.204 19502 113 1 . 1 1 738 738 HIS CA C 738 57.008 57.008 55.909 1.099 19502 114 1 . 1 1 738 738 HIS CB C 738 30.530 30.530 30.964 -0.434 19502 115 1 . 1 1 738 738 HIS H H 738 7.300 7.300 7.674 -0.374 19502 116 1 . 1 1 739 739 GLY N N 739 107.604 107.604 107.724 -0.120 19502 117 1 . 1 1 739 739 GLY CA C 739 46.131 46.131 45.021 1.110 19502 118 1 . 1 1 739 739 GLY H H 739 7.638 7.638 8.039 -0.401 19502 119 1 . 1 1 740 740 PHE N N 740 118.114 118.114 120.103 -1.989 19502 120 1 . 1 1 740 740 PHE HA H 740 5.187 5.187 4.560 0.627 19502 121 1 . 1 1 740 740 PHE CA C 740 54.403 54.403 56.340 -1.937 19502 122 1 . 1 1 740 740 PHE CB C 740 42.982 42.982 40.364 2.618 19502 123 1 . 1 1 740 740 PHE H H 740 8.138 8.138 7.798 0.340 19502 124 1 . 1 1 741 741 ALA N N 741 122.577 122.577 121.791 0.786 19502 125 1 . 1 1 741 741 ALA HA H 741 4.655 4.655 4.552 0.103 19502 126 1 . 1 1 741 741 ALA CA C 741 51.271 51.271 50.809 0.462 19502 127 1 . 1 1 741 741 ALA CB C 741 19.976 19.976 20.445 -0.468 19502 128 1 . 1 1 741 741 ALA H H 741 8.550 8.550 8.623 -0.073 19502 129 1 . 1 1 742 742 ALA N N 742 124.016 124.016 127.969 -3.953 19502 130 1 . 1 1 742 742 ALA HA H 742 4.906 4.906 4.864 0.042 19502 131 1 . 1 1 742 742 ALA CA C 742 51.029 51.029 51.008 0.021 19502 132 1 . 1 1 742 742 ALA CB C 742 20.360 20.360 19.749 0.611 19502 133 1 . 1 1 742 742 ALA H H 742 8.511 8.511 8.610 -0.099 19502 134 1 . 1 1 743 743 GLU N N 743 120.968 120.968 123.481 -2.513 19502 135 1 . 1 1 743 743 GLU HA H 743 4.550 4.550 4.647 -0.097 19502 136 1 . 1 1 743 743 GLU CA C 743 54.766 54.766 54.797 -0.031 19502 137 1 . 1 1 743 743 GLU CB C 743 33.989 33.989 33.201 0.788 19502 138 1 . 1 1 743 743 GLU H H 743 8.628 8.628 8.472 0.156 19502 139 1 . 1 1 744 744 PHE N N 744 120.078 120.078 122.425 -2.347 19502 140 1 . 1 1 744 744 PHE HA H 744 4.815 4.815 5.068 -0.253 19502 141 1 . 1 1 744 744 PHE CA C 744 57.171 57.171 57.281 -0.110 19502 142 1 . 1 1 744 744 PHE CB C 744 40.375 40.375 40.215 0.160 19502 143 1 . 1 1 744 744 PHE H H 744 8.792 8.792 8.902 -0.110 19502 144 1 . 1 1 745 745 LYS N N 745 124.937 124.937 123.978 0.959 19502 145 1 . 1 1 745 745 LYS HA H 745 4.593 4.593 4.819 -0.226 19502 146 1 . 1 1 745 745 LYS CA C 745 55.070 55.070 54.401 0.669 19502 147 1 . 1 1 745 745 LYS CB C 745 33.545 33.545 35.701 -2.156 19502 148 1 . 1 1 745 745 LYS H H 745 9.180 9.180 8.416 0.764 19502 149 1 . 1 1 746 746 LEU N N 746 129.002 129.002 125.468 3.534 19502 150 1 . 1 1 746 746 LEU HA H 746 3.924 3.924 3.788 0.136 19502 151 1 . 1 1 746 746 LEU CA C 746 54.698 54.698 54.698 0.000 19502 152 1 . 1 1 746 746 LEU CB C 746 40.579 40.579 41.752 -1.173 19502 153 1 . 1 1 746 746 LEU H H 746 8.687 8.687 8.519 0.168 19502 154 1 . 1 1 747 747 VAL N N 747 131.114 131.114 127.424 3.690 19502 155 1 . 1 1 747 747 VAL HA H 747 3.745 3.745 3.939 -0.194 19502 156 1 . 1 1 747 747 VAL CA C 747 64.134 64.134 64.392 -0.258 19502 157 1 . 1 1 747 747 VAL CB C 747 32.971 32.971 32.542 0.429 19502 158 1 . 1 1 747 747 VAL H H 747 9.033 9.033 8.909 0.124 19502 159 1 . 1 1 748 748 ASP N N 748 113.346 113.346 116.399 -3.054 19502 160 1 . 1 1 748 748 ASP HA H 748 4.784 4.784 4.832 -0.048 19502 161 1 . 1 1 748 748 ASP CA C 748 54.334 54.334 53.679 0.655 19502 162 1 . 1 1 748 748 ASP CB C 748 46.191 46.191 43.604 2.587 19502 163 1 . 1 1 748 748 ASP H H 748 7.426 7.426 7.604 -0.178 19502 164 1 . 1 1 749 749 GLN N N 749 120.867 120.867 122.028 -1.161 19502 165 1 . 1 1 749 749 GLN HA H 749 5.070 5.070 5.024 0.046 19502 166 1 . 1 1 749 749 GLN CA C 749 54.603 54.603 54.786 -0.183 19502 167 1 . 1 1 749 749 GLN CB C 749 31.923 31.923 30.960 0.963 19502 168 1 . 1 1 749 749 GLN H H 749 7.647 7.647 8.482 -0.835 19502 169 1 . 1 1 750 750 SER N N 750 119.661 119.661 121.331 -1.670 19502 170 1 . 1 1 750 750 SER HA H 750 4.791 4.791 4.741 0.050 19502 171 1 . 1 1 750 750 SER CA C 750 57.575 57.575 57.713 -0.138 19502 172 1 . 1 1 750 750 SER CB C 750 65.910 65.910 64.362 1.548 19502 173 1 . 1 1 750 750 SER H H 750 8.891 8.891 8.471 0.420 19502 174 1 . 1 1 751 751 GLY N N 751 106.531 106.531 110.122 -3.591 19502 175 1 . 1 1 751 751 GLY CA C 751 44.214 44.214 44.049 0.166 19502 176 1 . 1 1 751 751 GLY H H 751 8.183 8.183 7.926 0.257 19502 177 1 . 1 1 752 752 PRO HA H 752 4.848 4.848 4.685 0.163 19502 178 1 . 1 1 752 752 PRO CA C 752 61.538 61.538 61.241 0.297 19502 179 1 . 1 1 752 752 PRO CB C 752 30.898 30.898 30.840 0.058 19502 180 1 . 1 1 753 753 PRO HA H 753 4.226 4.226 4.252 -0.026 19502 181 1 . 1 1 753 753 PRO CA C 753 65.345 65.345 64.828 0.517 19502 182 1 . 1 1 753 753 PRO CB C 753 31.907 31.907 31.536 0.371 19502 183 1 . 1 1 754 754 HIS N N 754 109.780 109.780 113.341 -3.561 19502 184 1 . 1 1 754 754 HIS HA H 754 4.758 4.758 4.700 0.058 19502 185 1 . 1 1 754 754 HIS CA C 754 56.229 56.229 56.552 -0.324 19502 186 1 . 1 1 754 754 HIS CB C 754 30.494 30.494 30.077 0.417 19502 187 1 . 1 1 754 754 HIS H H 754 7.707 7.707 8.095 -0.388 19502 188 1 . 1 1 755 755 GLU N N 755 122.843 122.843 120.570 2.273 19502 189 1 . 1 1 755 755 GLU HA H 755 4.612 4.612 4.785 -0.173 19502 190 1 . 1 1 755 755 GLU CA C 755 54.649 54.649 53.373 1.276 19502 191 1 . 1 1 755 755 GLU CB C 755 30.813 30.813 30.935 -0.122 19502 192 1 . 1 1 755 755 GLU H H 755 7.404 7.404 7.381 0.023 19502 193 1 . 1 1 756 756 PRO HA H 756 4.617 4.617 4.240 0.377 19502 194 1 . 1 1 756 756 PRO CA C 756 63.116 63.116 62.693 0.423 19502 195 1 . 1 1 756 756 PRO CB C 756 33.251 33.251 31.451 1.800 19502 196 1 . 1 1 757 757 LYS N N 757 119.032 119.032 124.946 -5.914 19502 197 1 . 1 1 757 757 LYS HA H 757 4.604 4.604 4.711 -0.107 19502 198 1 . 1 1 757 757 LYS CA C 757 55.644 55.644 55.182 0.462 19502 199 1 . 1 1 757 757 LYS CB C 757 35.196 35.196 33.784 1.412 19502 200 1 . 1 1 757 757 LYS H H 757 8.195 8.195 8.049 0.146 19502 201 1 . 1 1 758 758 PHE N N 758 120.288 120.288 125.962 -5.674 19502 202 1 . 1 1 758 758 PHE HA H 758 5.040 5.040 4.846 0.194 19502 203 1 . 1 1 758 758 PHE CA C 758 56.816 56.816 56.888 -0.072 19502 204 1 . 1 1 758 758 PHE CB C 758 43.300 43.300 40.650 2.650 19502 205 1 . 1 1 758 758 PHE H H 758 8.844 8.844 9.313 -0.469 19502 206 1 . 1 1 759 759 VAL N N 759 121.385 121.385 124.356 -2.971 19502 207 1 . 1 1 759 759 VAL HA H 759 5.392 5.392 4.673 0.719 19502 208 1 . 1 1 759 759 VAL CA C 759 60.650 60.650 61.933 -1.283 19502 209 1 . 1 1 759 759 VAL CB C 759 33.238 33.238 31.241 1.997 19502 210 1 . 1 1 759 759 VAL H H 759 8.609 8.609 9.229 -0.620 19502 211 1 . 1 1 760 760 TYR N N 760 126.374 126.374 128.671 -2.297 19502 212 1 . 1 1 760 760 TYR HA H 760 5.797 5.797 5.223 0.574 19502 213 1 . 1 1 760 760 TYR CA C 760 56.920 56.920 57.123 -0.203 19502 214 1 . 1 1 760 760 TYR CB C 760 46.853 46.853 42.251 4.602 19502 215 1 . 1 1 760 760 TYR H H 760 8.903 8.903 9.343 -0.440 19502 216 1 . 1 1 761 761 GLN N N 761 115.228 115.228 122.685 -7.457 19502 217 1 . 1 1 761 761 GLN HA H 761 4.824 4.824 5.741 -0.917 19502 218 1 . 1 1 761 761 GLN CA C 761 55.526 55.526 53.579 1.947 19502 219 1 . 1 1 761 761 GLN CB C 761 33.318 33.318 33.880 -0.562 19502 220 1 . 1 1 761 761 GLN H H 761 9.016 9.016 8.598 0.418 19502 221 1 . 1 1 762 762 ALA N N 762 128.023 128.023 129.334 -1.311 19502 222 1 . 1 1 762 762 ALA HA H 762 5.181 5.181 4.653 0.528 19502 223 1 . 1 1 762 762 ALA CA C 762 50.875 50.875 50.514 0.361 19502 224 1 . 1 1 762 762 ALA CB C 762 20.151 20.151 19.854 0.297 19502 225 1 . 1 1 762 762 ALA H H 762 9.500 9.500 8.592 0.908 19502 226 1 . 1 1 763 763 LYS N N 763 122.022 122.022 126.793 -4.771 19502 227 1 . 1 1 763 763 LYS HA H 763 4.864 4.864 4.495 0.369 19502 228 1 . 1 1 763 763 LYS CA C 763 55.145 55.145 54.798 0.347 19502 229 1 . 1 1 763 763 LYS CB C 763 36.456 36.456 33.420 3.036 19502 230 1 . 1 1 763 763 LYS H H 763 8.347 8.347 8.713 -0.366 19502 231 1 . 1 1 764 764 VAL N N 764 123.980 123.980 127.915 -3.935 19502 232 1 . 1 1 764 764 VAL HA H 764 4.627 4.627 4.634 -0.007 19502 233 1 . 1 1 764 764 VAL CA C 764 60.966 60.966 60.572 0.394 19502 234 1 . 1 1 764 764 VAL CB C 764 34.820 34.820 30.815 4.004 19502 235 1 . 1 1 764 764 VAL H H 764 8.703 8.703 8.407 0.296 19502 236 1 . 1 1 765 765 GLY N N 765 119.292 119.292 118.142 1.150 19502 237 1 . 1 1 765 765 GLY CA C 765 46.623 46.623 46.387 0.236 19502 238 1 . 1 1 765 765 GLY H H 765 9.151 9.151 8.958 0.193 19502 239 1 . 1 1 766 766 GLY CA C 766 45.190 45.190 44.477 0.713 19502 240 1 . 1 1 767 767 ARG N N 767 119.571 119.571 121.411 -1.840 19502 241 1 . 1 1 767 767 ARG HA H 767 4.393 4.393 4.689 -0.296 19502 242 1 . 1 1 767 767 ARG CA C 767 55.349 55.349 54.397 0.952 19502 243 1 . 1 1 767 767 ARG CB C 767 32.319 32.319 32.002 0.317 19502 244 1 . 1 1 767 767 ARG H H 767 7.595 7.595 7.566 0.029 19502 245 1 . 1 1 768 768 TRP N N 768 122.976 122.976 125.000 -2.024 19502 246 1 . 1 1 768 768 TRP HA H 768 4.570 4.570 5.067 -0.497 19502 247 1 . 1 1 768 768 TRP CA C 768 56.466 56.466 56.138 0.328 19502 248 1 . 1 1 768 768 TRP CB C 768 30.218 30.218 29.748 0.470 19502 249 1 . 1 1 768 768 TRP H H 768 8.056 8.056 8.815 -0.759 19502 250 1 . 1 1 769 769 PHE N N 769 116.997 116.997 122.895 -5.898 19502 251 1 . 1 1 769 769 PHE HA H 769 4.750 4.750 4.811 -0.061 19502 252 1 . 1 1 769 769 PHE CA C 769 57.729 57.729 55.615 2.114 19502 253 1 . 1 1 769 769 PHE CB C 769 39.297 39.297 40.192 -0.895 19502 254 1 . 1 1 769 769 PHE H H 769 7.532 7.532 8.741 -1.209 19502 255 1 . 1 1 770 770 PRO HA H 770 4.724 4.724 4.742 -0.018 19502 256 1 . 1 1 770 770 PRO CA C 770 64.299 64.299 61.756 2.543 19502 257 1 . 1 1 770 770 PRO CB C 770 33.775 33.775 33.776 -0.001 19502 258 1 . 1 1 771 771 ALA N N 771 125.979 125.979 122.140 3.839 19502 259 1 . 1 1 771 771 ALA HA H 771 5.234 5.234 5.193 0.042 19502 260 1 . 1 1 771 771 ALA CA C 771 50.642 50.642 50.627 0.015 19502 261 1 . 1 1 771 771 ALA CB C 771 19.655 19.655 19.731 -0.076 19502 262 1 . 1 1 771 771 ALA H H 771 9.069 9.069 8.195 0.874 19502 263 1 . 1 1 772 772 VAL N N 772 113.901 113.901 118.716 -4.814 19502 264 1 . 1 1 772 772 VAL HA H 772 4.811 4.811 4.796 0.015 19502 265 1 . 1 1 772 772 VAL CA C 772 59.149 59.149 59.759 -0.610 19502 266 1 . 1 1 772 772 VAL CB C 772 35.246 35.246 34.961 0.285 19502 267 1 . 1 1 772 772 VAL H H 772 9.024 9.024 9.155 -0.131 19502 268 1 . 1 1 773 773 CYS N N 773 119.222 119.222 120.034 -0.812 19502 269 1 . 1 1 773 773 CYS HA H 773 5.607 5.607 5.632 -0.026 19502 270 1 . 1 1 773 773 CYS CA C 773 56.758 56.758 56.063 0.695 19502 271 1 . 1 1 773 773 CYS CB C 773 29.841 29.841 28.962 0.879 19502 272 1 . 1 1 773 773 CYS H H 773 8.597 8.597 8.461 0.136 19502 273 1 . 1 1 774 774 ALA N N 774 124.328 124.328 127.232 -2.904 19502 274 1 . 1 1 774 774 ALA HA H 774 4.803 4.803 4.702 0.101 19502 275 1 . 1 1 774 774 ALA CA C 774 51.231 51.231 50.705 0.526 19502 276 1 . 1 1 774 774 ALA CB C 774 24.125 24.125 21.807 2.318 19502 277 1 . 1 1 774 774 ALA H H 774 9.238 9.238 8.787 0.451 19502 278 1 . 1 1 775 775 HIS HA H 775 5.256 5.256 5.016 0.240 19502 279 1 . 1 1 775 775 HIS CA C 775 56.529 56.529 55.932 0.597 19502 280 1 . 1 1 775 775 HIS CB C 775 30.133 30.133 30.213 -0.080 19502 281 1 . 1 1 776 776 SER N N 776 110.366 110.366 113.291 -2.925 19502 282 1 . 1 1 776 776 SER HA H 776 4.766 4.766 4.729 0.037 19502 283 1 . 1 1 776 776 SER CA C 776 57.029 57.029 56.883 0.146 19502 284 1 . 1 1 776 776 SER H H 776 7.550 7.550 7.590 -0.040 19502 285 1 . 1 1 777 777 LYS HA H 777 3.587 3.587 3.677 -0.090 19502 286 1 . 1 1 777 777 LYS CA C 777 60.436 60.436 59.628 0.808 19502 287 1 . 1 1 777 777 LYS CB C 777 32.204 32.204 32.062 0.141 19502 288 1 . 1 1 778 778 LYS N N 778 118.469 118.469 118.325 0.144 19502 289 1 . 1 1 778 778 LYS HA H 778 3.764 3.764 3.853 -0.089 19502 290 1 . 1 1 778 778 LYS CA C 778 59.911 59.911 59.157 0.754 19502 291 1 . 1 1 778 778 LYS CB C 778 33.685 33.685 31.807 1.878 19502 292 1 . 1 1 778 778 LYS H H 778 8.151 8.151 8.076 0.075 19502 293 1 . 1 1 779 779 GLN N N 779 117.975 117.975 118.059 -0.084 19502 294 1 . 1 1 779 779 GLN HA H 779 4.013 4.013 4.002 0.011 19502 295 1 . 1 1 779 779 GLN CA C 779 57.909 57.909 58.753 -0.844 19502 296 1 . 1 1 779 779 GLN CB C 779 28.560 28.560 28.283 0.277 19502 297 1 . 1 1 779 779 GLN H H 779 7.773 7.773 8.104 -0.331 19502 298 1 . 1 1 780 780 GLY N N 780 108.214 108.214 108.044 0.170 19502 299 1 . 1 1 780 780 GLY CA C 780 48.011 48.011 47.027 0.984 19502 300 1 . 1 1 780 780 GLY H H 780 8.273 8.273 8.294 -0.021 19502 301 1 . 1 1 781 781 LYS N N 781 120.027 120.027 121.709 -1.682 19502 302 1 . 1 1 781 781 LYS HA H 781 3.089 3.089 3.639 -0.550 19502 303 1 . 1 1 781 781 LYS CA C 781 60.358 60.358 59.593 0.765 19502 304 1 . 1 1 781 781 LYS CB C 781 31.686 31.686 31.802 -0.116 19502 305 1 . 1 1 781 781 LYS H H 781 7.307 7.307 7.384 -0.077 19502 306 1 . 1 1 782 782 GLN N N 782 117.131 117.131 118.626 -1.495 19502 307 1 . 1 1 782 782 GLN HA H 782 3.768 3.768 3.864 -0.096 19502 308 1 . 1 1 782 782 GLN CA C 782 59.795 59.795 59.325 0.470 19502 309 1 . 1 1 782 782 GLN CB C 782 28.553 28.553 28.620 -0.067 19502 310 1 . 1 1 782 782 GLN H H 782 7.227 7.227 7.821 -0.594 19502 311 1 . 1 1 783 783 GLU N N 783 117.958 117.958 119.368 -1.410 19502 312 1 . 1 1 783 783 GLU HA H 783 4.203 4.203 4.038 0.165 19502 313 1 . 1 1 783 783 GLU CA C 783 58.964 58.964 59.086 -0.122 19502 314 1 . 1 1 783 783 GLU CB C 783 28.959 28.959 29.135 -0.176 19502 315 1 . 1 1 783 783 GLU H H 783 8.896 8.896 8.676 0.220 19502 316 1 . 1 1 784 784 ALA N N 784 124.176 124.176 122.586 1.590 19502 317 1 . 1 1 784 784 ALA HA H 784 4.134 4.134 4.050 0.084 19502 318 1 . 1 1 784 784 ALA CA C 784 55.215 55.215 55.399 -0.184 19502 319 1 . 1 1 784 784 ALA CB C 784 17.597 17.597 18.454 -0.857 19502 320 1 . 1 1 784 784 ALA H H 784 8.532 8.532 8.151 0.381 19502 321 1 . 1 1 785 785 ALA N N 785 121.847 121.847 120.684 1.163 19502 322 1 . 1 1 785 785 ALA HA H 785 4.042 4.042 3.997 0.045 19502 323 1 . 1 1 785 785 ALA CA C 785 55.169 55.169 55.223 -0.054 19502 324 1 . 1 1 785 785 ALA CB C 785 18.393 18.393 18.332 0.061 19502 325 1 . 1 1 785 785 ALA H H 785 8.402 8.402 8.142 0.260 19502 326 1 . 1 1 786 786 ASP N N 786 120.625 120.625 120.039 0.586 19502 327 1 . 1 1 786 786 ASP HA H 786 4.152 4.152 4.247 -0.095 19502 328 1 . 1 1 786 786 ASP CA C 786 58.171 58.171 57.857 0.314 19502 329 1 . 1 1 786 786 ASP CB C 786 42.516 42.516 40.844 1.671 19502 330 1 . 1 1 786 786 ASP H H 786 8.524 8.524 8.407 0.117 19502 331 1 . 1 1 787 787 ALA N N 787 118.408 118.408 121.479 -3.071 19502 332 1 . 1 1 787 787 ALA HA H 787 3.976 3.976 4.104 -0.128 19502 333 1 . 1 1 787 787 ALA CA C 787 55.116 55.116 54.918 0.198 19502 334 1 . 1 1 787 787 ALA CB C 787 18.270 18.270 18.370 -0.100 19502 335 1 . 1 1 787 787 ALA H H 787 8.191 8.191 8.138 0.053 19502 336 1 . 1 1 788 788 ALA N N 788 118.510 118.510 121.903 -3.393 19502 337 1 . 1 1 788 788 ALA HA H 788 3.704 3.704 4.053 -0.349 19502 338 1 . 1 1 788 788 ALA CA C 788 54.893 54.893 54.997 -0.104 19502 339 1 . 1 1 788 788 ALA CB C 788 18.573 18.573 17.984 0.589 19502 340 1 . 1 1 788 788 ALA H H 788 7.533 7.533 8.024 -0.491 19502 341 1 . 1 1 789 789 LEU N N 789 117.413 117.413 118.373 -0.960 19502 342 1 . 1 1 789 789 LEU HA H 789 3.690 3.690 3.766 -0.076 19502 343 1 . 1 1 789 789 LEU CA C 789 58.180 58.180 57.834 0.347 19502 344 1 . 1 1 789 789 LEU CB C 789 42.104 42.104 41.298 0.806 19502 345 1 . 1 1 789 789 LEU H H 789 8.520 8.520 8.178 0.342 19502 346 1 . 1 1 790 790 ARG N N 790 116.360 116.360 119.068 -2.708 19502 347 1 . 1 1 790 790 ARG HA H 790 3.918 3.918 4.012 -0.094 19502 348 1 . 1 1 790 790 ARG CA C 790 60.803 60.803 59.071 1.732 19502 349 1 . 1 1 790 790 ARG CB C 790 29.761 29.761 29.536 0.225 19502 350 1 . 1 1 790 790 ARG H H 790 8.293 8.293 7.826 0.467 19502 351 1 . 1 1 791 791 VAL N N 791 120.700 120.700 120.424 0.276 19502 352 1 . 1 1 791 791 VAL HA H 791 3.912 3.912 3.673 0.239 19502 353 1 . 1 1 791 791 VAL CA C 791 66.484 66.484 66.406 0.078 19502 354 1 . 1 1 791 791 VAL CB C 791 31.736 31.736 31.323 0.413 19502 355 1 . 1 1 791 791 VAL H H 791 7.455 7.455 7.916 -0.461 19502 356 1 . 1 1 792 792 LEU N N 792 120.706 120.706 119.869 0.837 19502 357 1 . 1 1 792 792 LEU HA H 792 4.032 4.032 3.842 0.190 19502 358 1 . 1 1 792 792 LEU CA C 792 57.867 57.867 58.063 -0.196 19502 359 1 . 1 1 792 792 LEU CB C 792 42.247 42.247 41.092 1.155 19502 360 1 . 1 1 792 792 LEU H H 792 8.007 8.007 7.815 0.192 19502 361 1 . 1 1 793 793 ILE N N 793 118.876 118.876 118.691 0.185 19502 362 1 . 1 1 793 793 ILE HA H 793 3.729 3.729 3.629 0.100 19502 363 1 . 1 1 793 793 ILE CA C 793 65.001 65.001 65.454 -0.453 19502 364 1 . 1 1 793 793 ILE CB C 793 38.955 38.955 37.544 1.410 19502 365 1 . 1 1 793 793 ILE H H 793 8.778 8.778 8.674 0.104 19502 366 1 . 1 1 794 794 GLY N N 794 107.008 107.008 107.023 -0.015 19502 367 1 . 1 1 794 794 GLY CA C 794 46.633 46.633 46.996 -0.363 19502 368 1 . 1 1 794 794 GLY H H 794 7.810 7.810 8.251 -0.441 19502 369 1 . 1 1 795 795 GLU N N 795 119.866 119.866 121.193 -1.327 19502 370 1 . 1 1 795 795 GLU HA H 795 4.356 4.356 4.052 0.304 19502 371 1 . 1 1 795 795 GLU CA C 795 57.704 57.704 58.963 -1.259 19502 372 1 . 1 1 795 795 GLU CB C 795 30.080 30.080 29.487 0.593 19502 373 1 . 1 1 795 795 GLU H H 795 7.978 7.978 8.247 -0.269 19502 374 1 . 1 1 796 796 ASN N N 796 118.365 118.365 117.022 1.343 19502 375 1 . 1 1 796 796 ASN HA H 796 4.782 4.782 4.617 0.165 19502 376 1 . 1 1 796 796 ASN CA C 796 54.582 54.582 55.161 -0.579 19502 377 1 . 1 1 796 796 ASN CB C 796 40.045 40.045 39.055 0.990 19502 378 1 . 1 1 796 796 ASN H H 796 8.053 8.053 7.954 0.099 19502 379 1 . 1 1 797 797 GLU N N 797 120.368 120.368 120.223 0.145 19502 380 1 . 1 1 797 797 GLU HA H 797 4.336 4.336 4.155 0.181 19502 381 1 . 1 1 797 797 GLU CA C 797 57.624 57.624 58.541 -0.917 19502 382 1 . 1 1 797 797 GLU CB C 797 30.342 30.342 29.521 0.821 19502 383 1 . 1 1 797 797 GLU H H 797 8.225 8.225 8.014 0.211 19502 384 1 . 1 1 798 798 LYS N N 798 120.614 120.614 117.454 3.160 19502 385 1 . 1 1 798 798 LYS H H 798 8.088 8.088 7.911 0.177 19502 386 1 . 1 1 799 799 ALA N N 799 124.642 124.642 122.241 2.401 19502 387 1 . 1 1 799 799 ALA HA H 799 4.441 4.441 4.440 0.001 19502 388 1 . 1 1 799 799 ALA CA C 799 52.692 52.692 51.978 0.714 19502 389 1 . 1 1 799 799 ALA CB C 799 19.617 19.617 19.911 -0.294 19502 390 1 . 1 1 799 799 ALA H H 799 8.138 8.138 7.609 0.529 19502 391 1 . 1 1 800 800 GLU N N 800 120.408 120.408 119.902 0.506 19502 392 1 . 1 1 800 800 GLU HA H 800 4.395 4.395 4.326 0.069 19502 393 1 . 1 1 800 800 GLU CA C 800 56.810 56.810 56.285 0.525 19502 394 1 . 1 1 800 800 GLU CB C 800 30.604 30.604 29.446 1.158 19502 395 1 . 1 1 800 800 GLU H H 800 8.337 8.337 8.486 -0.149 19502 stop_ save_