data_18986 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18986 _Entry.PDB_ID 2M45 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 18986 _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 1 601 601 SER HA H 601 4.475 4.475 4.641 -0.166 18986 2 1 1 . 1 1 601 601 SER CA C 601 55.508 55.508 58.901 -3.393 18986 3 1 1 . 1 1 601 601 SER CB C 601 61.220 61.220 63.559 -2.340 18986 4 1 1 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.739 -0.123 18986 5 1 1 . 1 1 602 602 HIS C C 602 172.320 172.320 175.108 -2.788 18986 6 1 1 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.257 -1.403 18986 7 1 1 . 1 1 602 602 HIS CB C 602 28.083 28.083 31.512 -3.429 18986 8 1 1 . 1 1 603 603 MET N N 603 121.862 121.862 121.894 -0.032 18986 9 1 1 . 1 1 603 603 MET HA H 603 4.425 4.425 4.442 -0.017 18986 10 1 1 . 1 1 603 603 MET C C 603 173.948 173.948 176.550 -2.602 18986 11 1 1 . 1 1 603 603 MET CA C 603 53.108 53.108 56.152 -3.044 18986 12 1 1 . 1 1 603 603 MET CB C 603 30.049 30.049 32.746 -2.697 18986 13 1 1 . 1 1 603 603 MET H H 603 8.394 8.394 8.743 -0.349 18986 14 1 1 . 1 1 604 604 GLY N N 604 110.382 110.382 107.886 2.496 18986 15 1 1 . 1 1 604 604 GLY C C 604 171.590 171.590 174.387 -2.797 18986 16 1 1 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.016 -2.399 18986 17 1 1 . 1 1 604 604 GLY H H 604 8.411 8.411 8.403 0.008 18986 18 1 1 . 1 1 605 605 GLU N N 605 120.709 120.709 120.572 0.137 18986 19 1 1 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.465 -0.158 18986 20 1 1 . 1 1 605 605 GLU C C 605 174.220 174.220 176.739 -2.519 18986 21 1 1 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.909 -1.943 18986 22 1 1 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.390 -2.779 18986 23 1 1 . 1 1 605 605 GLU H H 605 8.282 8.282 8.157 0.125 18986 24 1 1 . 1 1 606 606 SER N N 606 116.679 116.679 114.951 1.728 18986 25 1 1 . 1 1 606 606 SER HA H 606 4.405 4.405 4.228 0.177 18986 26 1 1 . 1 1 606 606 SER C C 606 172.455 172.455 174.336 -1.881 18986 27 1 1 . 1 1 606 606 SER CA C 606 56.028 56.028 59.157 -3.130 18986 28 1 1 . 1 1 606 606 SER CB C 606 61.039 61.039 63.819 -2.780 18986 29 1 1 . 1 1 606 606 SER H H 606 8.420 8.420 8.437 -0.017 18986 30 1 1 . 1 1 607 607 GLY N N 607 110.716 110.716 109.299 1.417 18986 31 1 1 . 1 1 607 607 GLY C C 607 171.173 171.173 173.341 -2.168 18986 32 1 1 . 1 1 607 607 GLY CA C 607 42.641 42.641 46.242 -3.601 18986 33 1 1 . 1 1 607 607 GLY H H 607 8.386 8.386 8.487 -0.101 18986 34 1 1 . 1 1 608 608 LYS N N 608 120.785 120.785 119.229 1.556 18986 35 1 1 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.392 -0.053 18986 36 1 1 . 1 1 608 608 LYS C C 608 173.673 173.673 175.427 -1.754 18986 37 1 1 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.045 -2.680 18986 38 1 1 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.906 -2.375 18986 39 1 1 . 1 1 608 608 LYS H H 608 8.008 8.008 8.301 -0.293 18986 40 1 1 . 1 1 609 609 ILE N N 609 122.404 122.404 121.169 1.235 18986 41 1 1 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.283 -0.134 18986 42 1 1 . 1 1 609 609 ILE C C 609 172.675 172.675 174.084 -1.409 18986 43 1 1 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.659 -2.656 18986 44 1 1 . 1 1 609 609 ILE CB C 609 36.204 36.204 41.008 -4.804 18986 45 1 1 . 1 1 609 609 ILE H H 609 8.186 8.186 7.497 0.689 18986 46 1 1 . 1 1 610 610 ASP N N 610 125.357 125.357 122.382 2.975 18986 47 1 1 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.986 -0.283 18986 48 1 1 . 1 1 610 610 ASP C C 610 173.668 173.668 175.731 -2.063 18986 49 1 1 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.020 -2.318 18986 50 1 1 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.564 -4.874 18986 51 1 1 . 1 1 610 610 ASP H H 610 8.369 8.369 8.248 0.121 18986 52 1 1 . 1 1 611 611 ILE N N 611 122.494 122.494 119.569 2.925 18986 53 1 1 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.956 -0.047 18986 54 1 1 . 1 1 611 611 ILE C C 611 173.618 173.618 177.353 -3.735 18986 55 1 1 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.477 -3.437 18986 56 1 1 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.068 -2.270 18986 57 1 1 . 1 1 611 611 ILE H H 611 8.284 8.284 8.676 -0.392 18986 58 1 1 . 1 1 612 612 ASP N N 612 121.440 121.440 119.546 1.894 18986 59 1 1 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.355 0.079 18986 60 1 1 . 1 1 612 612 ASP C C 612 175.129 175.129 178.403 -3.274 18986 61 1 1 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.268 -4.502 18986 62 1 1 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.906 -1.768 18986 63 1 1 . 1 1 612 612 ASP H H 612 8.279 8.279 8.597 -0.318 18986 64 1 1 . 1 1 613 613 THR N N 613 114.422 114.422 112.099 2.323 18986 65 1 1 . 1 1 613 613 THR HA H 613 4.106 4.106 4.134 -0.028 18986 66 1 1 . 1 1 613 613 THR C C 613 173.338 173.338 175.433 -2.095 18986 67 1 1 . 1 1 613 613 THR CA C 613 61.545 61.545 64.932 -3.387 18986 68 1 1 . 1 1 613 613 THR CB C 613 66.267 66.267 68.823 -2.556 18986 69 1 1 . 1 1 613 613 THR H H 613 7.866 7.866 8.272 -0.406 18986 70 1 1 . 1 1 614 614 ILE N N 614 121.654 121.654 118.865 2.789 18986 71 1 1 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.146 -0.117 18986 72 1 1 . 1 1 614 614 ILE C C 614 174.471 174.471 177.967 -3.496 18986 73 1 1 . 1 1 614 614 ILE CA C 614 60.173 60.173 61.651 -1.478 18986 74 1 1 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.993 -2.179 18986 75 1 1 . 1 1 614 614 ILE H H 614 7.819 7.819 7.533 0.286 18986 76 1 1 . 1 1 615 615 MET N N 615 119.713 119.713 118.901 0.812 18986 77 1 1 . 1 1 615 615 MET HA H 615 4.478 4.478 4.636 -0.158 18986 78 1 1 . 1 1 615 615 MET C C 615 174.075 174.075 177.864 -3.789 18986 79 1 1 . 1 1 615 615 MET CA C 615 52.764 52.764 57.512 -4.748 18986 80 1 1 . 1 1 615 615 MET CB C 615 29.337 29.337 31.938 -2.601 18986 81 1 1 . 1 1 615 615 MET H H 615 8.188 8.188 8.473 -0.285 18986 82 1 1 . 1 1 616 616 THR N N 616 114.770 114.770 114.473 0.297 18986 83 1 1 . 1 1 616 616 THR HA H 616 4.099 4.099 4.185 -0.086 18986 84 1 1 . 1 1 616 616 THR C C 616 172.535 172.535 175.992 -3.457 18986 85 1 1 . 1 1 616 616 THR CA C 616 61.112 61.112 64.754 -3.642 18986 86 1 1 . 1 1 616 616 THR CB C 616 66.617 66.617 69.240 -2.623 18986 87 1 1 . 1 1 616 616 THR H H 616 7.722 7.722 8.089 -0.367 18986 88 1 1 . 1 1 617 617 GLY N N 617 111.384 111.384 106.282 5.102 18986 89 1 1 . 1 1 617 617 GLY C C 617 171.437 171.437 173.677 -2.240 18986 90 1 1 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.146 -2.704 18986 91 1 1 . 1 1 617 617 GLY H H 617 8.431 8.431 7.870 0.561 18986 92 1 1 . 1 1 618 618 LYS N N 618 120.996 120.996 120.735 0.261 18986 93 1 1 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.839 -0.172 18986 94 1 1 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.915 -2.087 18986 95 1 1 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.788 -5.311 18986 96 1 1 . 1 1 618 618 LYS H H 618 7.821 7.821 7.898 -0.077 18986 97 1 1 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.478 -0.009 18986 98 1 1 . 1 1 619 619 PRO C C 619 174.453 174.453 178.209 -3.756 18986 99 1 1 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.545 -2.353 18986 100 1 1 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.590 -3.010 18986 101 1 1 . 1 1 620 620 LYS N N 620 123.464 123.464 122.054 1.410 18986 102 1 1 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.926 0.120 18986 103 1 1 . 1 1 620 620 LYS C C 620 174.895 174.895 178.247 -3.352 18986 104 1 1 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.350 -3.061 18986 105 1 1 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.330 -0.876 18986 106 1 1 . 1 1 620 620 LYS H H 620 8.728 8.728 8.727 0.001 18986 107 1 1 . 1 1 621 621 SER N N 621 113.921 113.921 116.126 -2.205 18986 108 1 1 . 1 1 621 621 SER HA H 621 4.336 4.336 4.181 0.155 18986 109 1 1 . 1 1 621 621 SER C C 621 173.149 173.149 176.209 -3.060 18986 110 1 1 . 1 1 621 621 SER CA C 621 56.691 56.691 60.441 -3.750 18986 111 1 1 . 1 1 621 621 SER CB C 621 60.689 60.689 62.584 -1.895 18986 112 1 1 . 1 1 621 621 SER H H 621 8.531 8.531 8.320 0.211 18986 113 1 1 . 1 1 622 622 ALA N N 622 124.177 124.177 124.114 0.063 18986 114 1 1 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.023 0.145 18986 115 1 1 . 1 1 622 622 ALA C C 622 176.804 176.804 178.986 -2.182 18986 116 1 1 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.171 -2.803 18986 117 1 1 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.247 -2.393 18986 118 1 1 . 1 1 622 622 ALA H H 622 7.835 7.835 8.283 -0.448 18986 119 1 1 . 1 1 623 623 ARG N N 623 118.263 118.263 118.544 -0.281 18986 120 1 1 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.951 -0.001 18986 121 1 1 . 1 1 623 623 ARG C C 623 175.683 175.683 178.407 -2.724 18986 122 1 1 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.113 -1.950 18986 123 1 1 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.441 -1.990 18986 124 1 1 . 1 1 623 623 ARG H H 623 8.148 8.148 8.191 -0.043 18986 125 1 1 . 1 1 624 624 GLU N N 624 117.953 117.953 119.997 -2.044 18986 126 1 1 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.037 -0.069 18986 127 1 1 . 1 1 624 624 GLU C C 624 177.204 177.204 178.730 -1.526 18986 128 1 1 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.164 -2.307 18986 129 1 1 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.227 -2.260 18986 130 1 1 . 1 1 624 624 GLU H H 624 8.143 8.143 8.227 -0.084 18986 131 1 1 . 1 1 625 625 LYS N N 625 119.222 119.222 119.117 0.105 18986 132 1 1 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.140 -0.283 18986 133 1 1 . 1 1 625 625 LYS C C 625 175.480 175.480 179.209 -3.729 18986 134 1 1 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.136 -1.649 18986 135 1 1 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.713 -2.050 18986 136 1 1 . 1 1 625 625 LYS H H 625 7.772 7.772 7.921 -0.149 18986 137 1 1 . 1 1 626 626 MET N N 626 117.883 117.883 119.665 -1.782 18986 138 1 1 . 1 1 626 626 MET HA H 626 3.807 3.807 4.026 -0.219 18986 139 1 1 . 1 1 626 626 MET C C 626 175.278 175.278 178.403 -3.125 18986 140 1 1 . 1 1 626 626 MET CA C 626 57.782 57.782 59.730 -1.948 18986 141 1 1 . 1 1 626 626 MET CB C 626 30.657 30.657 32.743 -2.086 18986 142 1 1 . 1 1 626 626 MET H H 626 8.367 8.367 8.583 -0.216 18986 143 1 1 . 1 1 627 627 MET N N 627 116.185 116.185 117.354 -1.169 18986 144 1 1 . 1 1 627 627 MET HA H 627 4.152 4.152 4.141 0.011 18986 145 1 1 . 1 1 627 627 MET C C 627 176.393 176.393 178.423 -2.030 18986 146 1 1 . 1 1 627 627 MET CA C 627 55.359 55.359 58.048 -2.689 18986 147 1 1 . 1 1 627 627 MET CB C 627 28.803 28.803 31.207 -2.404 18986 148 1 1 . 1 1 627 627 MET H H 627 8.197 8.197 8.762 -0.565 18986 149 1 1 . 1 1 628 628 LYS N N 628 119.859 119.859 120.524 -0.665 18986 150 1 1 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.153 0.047 18986 151 1 1 . 1 1 628 628 LYS C C 628 175.885 175.885 179.345 -3.460 18986 152 1 1 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.517 -4.440 18986 153 1 1 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.246 -3.715 18986 154 1 1 . 1 1 628 628 LYS H H 628 7.700 7.700 7.421 0.279 18986 155 1 1 . 1 1 629 629 ILE N N 629 119.001 119.001 120.343 -1.342 18986 156 1 1 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.626 -0.078 18986 157 1 1 . 1 1 629 629 ILE C C 629 174.891 174.891 177.893 -3.002 18986 158 1 1 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.512 -3.247 18986 159 1 1 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.969 -4.120 18986 160 1 1 . 1 1 629 629 ILE H H 629 7.970 7.970 8.286 -0.316 18986 161 1 1 . 1 1 630 630 ILE N N 630 120.737 120.737 117.350 3.387 18986 162 1 1 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.620 -0.153 18986 163 1 1 . 1 1 630 630 ILE C C 630 173.875 173.875 177.766 -3.891 18986 164 1 1 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.852 -2.098 18986 165 1 1 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.868 -2.591 18986 166 1 1 . 1 1 630 630 ILE H H 630 8.213 8.213 8.135 0.078 18986 167 1 1 . 1 1 631 631 GLU N N 631 119.546 119.546 121.416 -1.870 18986 168 1 1 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.992 0.073 18986 169 1 1 . 1 1 631 631 GLU C C 631 177.300 177.300 179.351 -2.051 18986 170 1 1 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.708 -2.728 18986 171 1 1 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.499 -2.506 18986 172 1 1 . 1 1 631 631 GLU H H 631 7.742 7.742 8.095 -0.353 18986 173 1 1 . 1 1 632 632 ILE N N 632 121.547 121.547 121.636 -0.089 18986 174 1 1 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.757 -0.074 18986 175 1 1 . 1 1 632 632 ILE C C 632 175.454 175.454 178.398 -2.944 18986 176 1 1 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.890 -3.234 18986 177 1 1 . 1 1 632 632 ILE CB C 632 35.830 35.830 38.089 -2.259 18986 178 1 1 . 1 1 632 632 ILE H H 632 8.013 8.013 8.326 -0.313 18986 179 1 1 . 1 1 633 633 ILE N N 633 121.605 121.605 119.717 1.888 18986 180 1 1 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.580 -0.245 18986 181 1 1 . 1 1 633 633 ILE C C 633 174.558 174.558 177.891 -3.333 18986 182 1 1 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.442 -1.524 18986 183 1 1 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.009 -1.725 18986 184 1 1 . 1 1 633 633 ILE H H 633 8.594 8.594 8.446 0.148 18986 185 1 1 . 1 1 634 634 ASP N N 634 118.706 118.706 120.514 -1.808 18986 186 1 1 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.298 0.137 18986 187 1 1 . 1 1 634 634 ASP C C 634 176.574 176.574 178.523 -1.949 18986 188 1 1 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.590 -3.019 18986 189 1 1 . 1 1 634 634 ASP CB C 634 37.914 37.914 41.227 -3.312 18986 190 1 1 . 1 1 634 634 ASP H H 634 8.724 8.724 8.508 0.216 18986 191 1 1 . 1 1 635 635 SER N N 635 114.064 114.064 115.989 -1.925 18986 192 1 1 . 1 1 635 635 SER HA H 635 4.232 4.232 4.228 0.004 18986 193 1 1 . 1 1 635 635 SER C C 635 174.487 174.487 177.190 -2.703 18986 194 1 1 . 1 1 635 635 SER CA C 635 58.540 58.540 61.670 -3.130 18986 195 1 1 . 1 1 635 635 SER CB C 635 60.319 60.319 63.177 -2.858 18986 196 1 1 . 1 1 635 635 SER H H 635 7.992 7.992 8.130 -0.138 18986 197 1 1 . 1 1 636 636 LEU N N 636 122.493 122.493 123.116 -0.623 18986 198 1 1 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.240 0.014 18986 199 1 1 . 1 1 636 636 LEU C C 636 176.194 176.194 178.526 -2.332 18986 200 1 1 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.147 -3.052 18986 201 1 1 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.414 -1.708 18986 202 1 1 . 1 1 636 636 LEU H H 636 8.169 8.169 8.624 -0.455 18986 203 1 1 . 1 1 637 637 ALA N N 637 121.891 121.891 120.093 1.798 18986 204 1 1 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.404 -0.315 18986 205 1 1 . 1 1 637 637 ALA C C 637 175.131 175.131 178.229 -3.098 18986 206 1 1 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.777 -3.441 18986 207 1 1 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.475 -2.987 18986 208 1 1 . 1 1 637 637 ALA H H 637 8.482 8.482 8.116 0.366 18986 209 1 1 . 1 1 638 638 VAL N N 638 117.140 117.140 116.268 0.872 18986 210 1 1 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.901 0.034 18986 211 1 1 . 1 1 638 638 VAL C C 638 174.712 174.712 176.522 -1.810 18986 212 1 1 . 1 1 638 638 VAL CA C 638 62.001 62.001 63.721 -1.720 18986 213 1 1 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.167 -2.816 18986 214 1 1 . 1 1 638 638 VAL H H 638 7.291 7.291 7.624 -0.333 18986 215 1 1 . 1 1 639 639 SER N N 639 114.143 114.143 115.273 -1.130 18986 216 1 1 . 1 1 639 639 SER HA H 639 4.481 4.481 4.533 -0.052 18986 217 1 1 . 1 1 639 639 SER C C 639 172.122 172.122 174.017 -1.895 18986 218 1 1 . 1 1 639 639 SER CA C 639 56.002 56.002 59.760 -3.758 18986 219 1 1 . 1 1 639 639 SER CB C 639 60.921 60.921 64.380 -3.459 18986 220 1 1 . 1 1 639 639 SER H H 639 7.918 7.918 8.154 -0.236 18986 221 1 1 . 1 1 640 640 SER N N 640 115.370 115.370 116.150 -0.780 18986 222 1 1 . 1 1 640 640 SER HA H 640 4.711 4.711 4.906 -0.195 18986 223 1 1 . 1 1 640 640 SER C C 640 171.185 171.185 174.369 -3.184 18986 224 1 1 . 1 1 640 640 SER CA C 640 55.009 55.009 56.896 -1.887 18986 225 1 1 . 1 1 640 640 SER CB C 640 61.974 61.974 65.116 -3.142 18986 226 1 1 . 1 1 640 640 SER H H 640 7.765 7.765 7.970 -0.205 18986 227 1 1 . 1 1 641 641 GLU N N 641 119.994 119.994 119.245 0.749 18986 228 1 1 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.134 -0.090 18986 229 1 1 . 1 1 641 641 GLU C C 641 173.167 173.167 175.925 -2.758 18986 230 1 1 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.209 -2.558 18986 231 1 1 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.692 -2.208 18986 232 1 1 . 1 1 641 641 GLU H H 641 8.363 8.363 8.866 -0.503 18986 233 1 1 . 1 1 642 642 CYS N N 642 110.257 110.257 111.328 -1.071 18986 234 1 1 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.661 -0.202 18986 235 1 1 . 1 1 642 642 CYS C C 642 168.058 168.058 172.677 -4.619 18986 236 1 1 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.430 -4.484 18986 237 1 1 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.362 9.999 18986 238 1 1 . 1 1 642 642 CYS H H 642 7.881 7.881 7.323 0.558 18986 239 1 1 . 1 1 643 643 ALA N N 643 123.922 123.922 122.622 1.300 18986 240 1 1 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.748 -0.110 18986 241 1 1 . 1 1 643 643 ALA C C 643 172.517 172.517 176.472 -3.955 18986 242 1 1 . 1 1 643 643 ALA CA C 643 47.620 47.620 50.549 -2.929 18986 243 1 1 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.338 -0.894 18986 244 1 1 . 1 1 643 643 ALA H H 643 9.787 9.787 9.052 0.735 18986 245 1 1 . 1 1 644 644 LYS N N 644 128.479 128.479 125.941 2.538 18986 246 1 1 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.346 0.165 18986 247 1 1 . 1 1 644 644 LYS C C 644 176.945 176.945 177.759 -0.814 18986 248 1 1 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.776 -2.438 18986 249 1 1 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.811 -1.869 18986 250 1 1 . 1 1 644 644 LYS H H 644 9.809 9.809 8.946 0.863 18986 251 1 1 . 1 1 645 645 VAL N N 645 124.257 124.257 127.507 -3.250 18986 252 1 1 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.714 -0.066 18986 253 1 1 . 1 1 645 645 VAL C C 645 173.996 173.996 176.681 -2.685 18986 254 1 1 . 1 1 645 645 VAL CA C 645 64.862 64.862 64.464 0.398 18986 255 1 1 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.598 -2.397 18986 256 1 1 . 1 1 645 645 VAL H H 645 8.458 8.458 9.298 -0.840 18986 257 1 1 . 1 1 646 646 LYS N N 646 117.598 117.598 121.190 -3.592 18986 258 1 1 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.927 0.080 18986 259 1 1 . 1 1 646 646 LYS C C 646 176.047 176.047 178.252 -2.205 18986 260 1 1 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.472 -3.227 18986 261 1 1 . 1 1 646 646 LYS CB C 646 29.398 29.398 32.135 -2.737 18986 262 1 1 . 1 1 646 646 LYS H H 646 8.706 8.706 9.345 -0.639 18986 263 1 1 . 1 1 647 647 ASP N N 647 119.229 119.229 119.039 0.190 18986 264 1 1 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.494 0.124 18986 265 1 1 . 1 1 647 647 ASP C C 647 175.211 175.211 178.769 -3.558 18986 266 1 1 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.227 -2.904 18986 267 1 1 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.836 -2.098 18986 268 1 1 . 1 1 647 647 ASP H H 647 7.012 7.012 7.937 -0.925 18986 269 1 1 . 1 1 648 648 ILE N N 648 121.939 121.939 120.820 1.119 18986 270 1 1 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.659 -0.278 18986 271 1 1 . 1 1 648 648 ILE C C 648 175.243 175.243 177.933 -2.690 18986 272 1 1 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.086 -2.045 18986 273 1 1 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.781 -1.819 18986 274 1 1 . 1 1 648 648 ILE H H 648 8.152 8.152 7.642 0.510 18986 275 1 1 . 1 1 649 649 LEU N N 649 117.310 117.310 120.773 -3.463 18986 276 1 1 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.810 0.063 18986 277 1 1 . 1 1 649 649 LEU C C 649 176.439 176.439 178.853 -2.414 18986 278 1 1 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.459 -2.574 18986 279 1 1 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.595 -2.289 18986 280 1 1 . 1 1 649 649 LEU H H 649 8.638 8.638 8.741 -0.103 18986 281 1 1 . 1 1 650 650 LYS N N 650 118.810 118.810 118.276 0.534 18986 282 1 1 . 1 1 650 650 LYS HA H 650 4.046 4.046 4.060 -0.014 18986 283 1 1 . 1 1 650 650 LYS C C 650 176.801 176.801 179.237 -2.436 18986 284 1 1 . 1 1 650 650 LYS CA C 650 57.051 57.051 58.779 -1.728 18986 285 1 1 . 1 1 650 650 LYS CB C 650 30.064 30.064 31.528 -1.464 18986 286 1 1 . 1 1 650 650 LYS H H 650 7.296 7.296 7.953 -0.657 18986 287 1 1 . 1 1 651 651 GLU N N 651 117.713 117.713 120.651 -2.938 18986 288 1 1 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.084 0.024 18986 289 1 1 . 1 1 651 651 GLU C C 651 176.903 176.903 178.905 -2.002 18986 290 1 1 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.927 -3.117 18986 291 1 1 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.280 -1.833 18986 292 1 1 . 1 1 651 651 GLU H H 651 8.036 8.036 8.414 -0.378 18986 293 1 1 . 1 1 652 652 ALA N N 652 121.206 121.206 121.900 -0.694 18986 294 1 1 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.037 -0.039 18986 295 1 1 . 1 1 652 652 ALA C C 652 176.766 176.766 179.929 -3.163 18986 296 1 1 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.230 -3.496 18986 297 1 1 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.202 -2.886 18986 298 1 1 . 1 1 652 652 ALA H H 652 8.973 8.973 8.624 0.349 18986 299 1 1 . 1 1 653 653 GLN N N 653 117.768 117.768 117.331 0.437 18986 300 1 1 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.363 0.114 18986 301 1 1 . 1 1 653 653 GLN C C 653 177.388 177.388 179.069 -1.681 18986 302 1 1 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.208 -2.148 18986 303 1 1 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.714 -1.945 18986 304 1 1 . 1 1 653 653 GLN H H 653 8.059 8.059 8.138 -0.079 18986 305 1 1 . 1 1 654 654 GLN N N 654 117.979 117.979 118.773 -0.794 18986 306 1 1 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.114 0.063 18986 307 1 1 . 1 1 654 654 GLN C C 654 174.834 174.834 177.813 -2.979 18986 308 1 1 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.124 -2.706 18986 309 1 1 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.705 -2.728 18986 310 1 1 . 1 1 654 654 GLN H H 654 7.495 7.495 7.698 -0.203 18986 311 1 1 . 1 1 655 655 VAL N N 655 110.080 110.080 118.156 -8.076 18986 312 1 1 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.875 0.652 18986 313 1 1 . 1 1 655 655 VAL C C 655 173.369 173.369 176.610 -3.241 18986 314 1 1 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.822 -6.755 18986 315 1 1 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.581 -4.397 18986 316 1 1 . 1 1 655 655 VAL H H 655 7.197 7.197 8.043 -0.846 18986 317 1 1 . 1 1 656 656 GLY N N 656 107.089 107.089 106.493 0.596 18986 318 1 1 . 1 1 656 656 GLY C C 656 171.639 171.639 172.955 -1.316 18986 319 1 1 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.975 -1.664 18986 320 1 1 . 1 1 656 656 GLY H H 656 7.541 7.541 7.926 -0.385 18986 321 1 1 . 1 1 657 657 ILE N N 657 121.266 121.266 118.035 3.231 18986 322 1 1 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.500 -0.366 18986 323 1 1 . 1 1 657 657 ILE C C 657 171.885 171.885 174.059 -2.174 18986 324 1 1 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.342 -1.112 18986 325 1 1 . 1 1 657 657 ILE CB C 657 35.191 35.191 42.426 -7.235 18986 326 1 1 . 1 1 657 657 ILE H H 657 7.633 7.633 7.613 0.020 18986 327 1 1 . 1 1 658 658 GLU N N 658 127.252 127.252 120.743 6.509 18986 328 1 1 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.893 -0.690 18986 329 1 1 . 1 1 658 658 GLU C C 658 175.316 175.316 177.418 -2.102 18986 330 1 1 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.361 -0.001 18986 331 1 1 . 1 1 658 658 GLU CB C 658 27.610 27.610 32.647 -5.037 18986 332 1 1 . 1 1 658 658 GLU H H 658 8.690 8.690 8.326 0.364 18986 333 1 1 . 1 1 659 659 LYS N N 659 124.533 124.533 125.243 -0.710 18986 334 1 1 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.769 0.019 18986 335 1 1 . 1 1 659 659 LYS C C 659 175.170 175.170 178.335 -3.165 18986 336 1 1 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.884 -2.713 18986 337 1 1 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.942 -1.825 18986 338 1 1 . 1 1 659 659 LYS H H 659 8.706 8.706 9.058 -0.352 18986 339 1 1 . 1 1 660 660 SER N N 660 113.137 113.137 115.159 -2.022 18986 340 1 1 . 1 1 660 660 SER HA H 660 4.273 4.273 4.268 0.005 18986 341 1 1 . 1 1 660 660 SER C C 660 173.939 173.939 176.658 -2.719 18986 342 1 1 . 1 1 660 660 SER CA C 660 58.350 58.350 60.756 -2.406 18986 343 1 1 . 1 1 660 660 SER CB C 660 59.504 59.504 62.537 -3.033 18986 344 1 1 . 1 1 660 660 SER H H 660 8.777 8.777 8.702 0.075 18986 345 1 1 . 1 1 661 661 ASN N N 661 119.986 119.986 121.163 -1.177 18986 346 1 1 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.400 0.306 18986 347 1 1 . 1 1 661 661 ASN C C 661 174.516 174.516 177.816 -3.300 18986 348 1 1 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.833 -4.785 18986 349 1 1 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.566 -1.823 18986 350 1 1 . 1 1 661 661 ASN H H 661 7.486 7.486 8.680 -1.194 18986 351 1 1 . 1 1 662 662 ILE N N 662 120.639 120.639 121.025 -0.386 18986 352 1 1 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.649 -0.203 18986 353 1 1 . 1 1 662 662 ILE C C 662 174.252 174.252 177.898 -3.646 18986 354 1 1 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.751 -3.146 18986 355 1 1 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.753 -3.330 18986 356 1 1 . 1 1 662 662 ILE H H 662 7.999 7.999 8.541 -0.542 18986 357 1 1 . 1 1 663 663 GLU N N 663 117.706 117.706 119.283 -1.577 18986 358 1 1 . 1 1 663 663 GLU HA H 663 3.790 3.790 4.091 -0.301 18986 359 1 1 . 1 1 663 663 GLU C C 663 176.509 176.509 178.945 -2.436 18986 360 1 1 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.457 -1.749 18986 361 1 1 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.443 -2.688 18986 362 1 1 . 1 1 663 663 GLU H H 663 8.190 8.190 8.188 0.002 18986 363 1 1 . 1 1 664 664 LYS N N 664 119.586 119.586 121.084 -1.498 18986 364 1 1 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.078 -0.025 18986 365 1 1 . 1 1 664 664 LYS C C 664 175.941 175.941 178.921 -2.980 18986 366 1 1 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.396 -2.815 18986 367 1 1 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.148 -2.325 18986 368 1 1 . 1 1 664 664 LYS H H 664 7.590 7.590 8.326 -0.736 18986 369 1 1 . 1 1 665 665 LEU N N 665 119.756 119.756 121.554 -1.798 18986 370 1 1 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.938 0.142 18986 371 1 1 . 1 1 665 665 LEU C C 665 176.700 176.700 179.078 -2.378 18986 372 1 1 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.879 -2.494 18986 373 1 1 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.822 -2.630 18986 374 1 1 . 1 1 665 665 LEU H H 665 8.075 8.075 8.221 -0.146 18986 375 1 1 . 1 1 666 666 LEU N N 666 118.788 118.788 118.751 0.037 18986 376 1 1 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.727 0.037 18986 377 1 1 . 1 1 666 666 LEU C C 666 176.484 176.484 179.166 -2.682 18986 378 1 1 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.235 -2.577 18986 379 1 1 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.578 -1.967 18986 380 1 1 . 1 1 666 666 LEU H H 666 8.550 8.550 8.613 -0.063 18986 381 1 1 . 1 1 667 667 THR N N 667 115.244 115.244 115.427 -0.183 18986 382 1 1 . 1 1 667 667 THR HA H 667 3.839 3.839 3.934 -0.095 18986 383 1 1 . 1 1 667 667 THR C C 667 173.740 173.740 176.840 -3.100 18986 384 1 1 . 1 1 667 667 THR CA C 667 64.378 64.378 67.330 -2.952 18986 385 1 1 . 1 1 667 667 THR CB C 667 65.748 65.748 68.118 -2.370 18986 386 1 1 . 1 1 667 667 THR H H 667 7.662 7.662 8.144 -0.482 18986 387 1 1 . 1 1 668 668 ASP N N 668 122.862 122.862 122.807 0.055 18986 388 1 1 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.406 -0.023 18986 389 1 1 . 1 1 668 668 ASP C C 668 177.192 177.192 178.406 -1.214 18986 390 1 1 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.253 -2.122 18986 391 1 1 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.838 -2.952 18986 392 1 1 . 1 1 668 668 ASP H H 668 8.291 8.291 8.156 0.135 18986 393 1 1 . 1 1 669 669 MET N N 669 119.640 119.640 118.982 0.658 18986 394 1 1 . 1 1 669 669 MET HA H 669 3.917 3.917 4.016 -0.099 18986 395 1 1 . 1 1 669 669 MET C C 669 175.414 175.414 178.612 -3.198 18986 396 1 1 . 1 1 669 669 MET CA C 669 57.234 57.234 59.967 -2.733 18986 397 1 1 . 1 1 669 669 MET CB C 669 32.088 32.088 32.561 -0.473 18986 398 1 1 . 1 1 669 669 MET H H 669 8.809 8.809 8.454 0.355 18986 399 1 1 . 1 1 670 670 ARG N N 670 122.614 122.614 117.631 4.983 18986 400 1 1 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.631 -0.114 18986 401 1 1 . 1 1 670 670 ARG C C 670 177.928 177.928 178.958 -1.030 18986 402 1 1 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.344 -2.122 18986 403 1 1 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.822 -2.518 18986 404 1 1 . 1 1 670 670 ARG H H 670 8.450 8.450 8.535 -0.085 18986 405 1 1 . 1 1 671 671 LYS N N 671 121.976 121.976 120.073 1.903 18986 406 1 1 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.167 -0.054 18986 407 1 1 . 1 1 671 671 LYS C C 671 176.143 176.143 178.343 -2.200 18986 408 1 1 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.608 -1.522 18986 409 1 1 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.669 -3.165 18986 410 1 1 . 1 1 671 671 LYS H H 671 8.609 8.609 8.042 0.567 18986 411 1 1 . 1 1 672 672 SER N N 672 111.655 111.655 113.199 -1.544 18986 412 1 1 . 1 1 672 672 SER HA H 672 4.469 4.469 4.350 0.119 18986 413 1 1 . 1 1 672 672 SER C C 672 171.692 171.692 175.266 -3.574 18986 414 1 1 . 1 1 672 672 SER CA C 672 56.790 56.790 59.560 -2.770 18986 415 1 1 . 1 1 672 672 SER CB C 672 61.343 61.343 64.210 -2.867 18986 416 1 1 . 1 1 672 672 SER H H 672 7.884 7.884 8.348 -0.465 18986 417 1 1 . 1 1 673 673 GLY N N 673 108.029 108.029 107.775 0.254 18986 418 1 1 . 1 1 673 673 GLY C C 673 171.492 171.492 175.432 -3.940 18986 419 1 1 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.420 -2.145 18986 420 1 1 . 1 1 673 673 GLY H H 673 7.774 7.774 8.192 -0.418 18986 421 1 1 . 1 1 674 674 ILE N N 674 116.193 116.193 120.502 -4.309 18986 422 1 1 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.937 0.164 18986 423 1 1 . 1 1 674 674 ILE C C 674 173.980 173.980 176.072 -2.092 18986 424 1 1 . 1 1 674 674 ILE CA C 674 60.242 60.242 64.056 -3.814 18986 425 1 1 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.606 -1.802 18986 426 1 1 . 1 1 674 674 ILE H H 674 8.026 8.026 8.203 -0.177 18986 427 1 1 . 1 1 675 675 ILE N N 675 108.928 108.928 113.083 -4.155 18986 428 1 1 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.518 0.840 18986 429 1 1 . 1 1 675 675 ILE C C 675 170.797 170.797 173.967 -3.170 18986 430 1 1 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.805 -2.781 18986 431 1 1 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.864 -2.378 18986 432 1 1 . 1 1 675 675 ILE H H 675 7.120 7.120 7.387 -0.267 18986 433 1 1 . 1 1 676 676 TYR N N 676 118.062 118.062 116.151 1.911 18986 434 1 1 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.179 -0.184 18986 435 1 1 . 1 1 676 676 TYR C C 676 170.020 170.020 173.713 -3.693 18986 436 1 1 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.136 -3.243 18986 437 1 1 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.284 -2.768 18986 438 1 1 . 1 1 676 676 TYR H H 676 9.380 9.380 8.712 0.668 18986 439 1 1 . 1 1 677 677 GLU N N 677 123.578 123.578 122.975 0.603 18986 440 1 1 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.075 -0.249 18986 441 1 1 . 1 1 677 677 GLU C C 677 172.146 172.146 175.798 -3.652 18986 442 1 1 . 1 1 677 677 GLU CA C 677 52.476 52.476 54.728 -2.252 18986 443 1 1 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.608 -1.996 18986 444 1 1 . 1 1 677 677 GLU H H 677 8.951 8.951 8.820 0.131 18986 445 1 1 . 1 1 678 678 ALA N N 678 133.220 133.220 128.385 4.835 18986 446 1 1 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.216 -0.175 18986 447 1 1 . 1 1 678 678 ALA C C 678 175.219 175.219 177.439 -2.220 18986 448 1 1 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.965 -2.364 18986 449 1 1 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.510 -2.911 18986 450 1 1 . 1 1 678 678 ALA H H 678 7.912 7.912 8.147 -0.235 18986 451 1 1 . 1 1 679 679 LYS N N 679 115.687 115.687 114.711 0.976 18986 452 1 1 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.776 -0.341 18986 453 1 1 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.567 -1.551 18986 454 1 1 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.869 -2.874 18986 455 1 1 . 1 1 679 679 LYS H H 679 8.215 8.215 7.844 0.371 18986 456 1 1 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.139 -0.120 18986 457 1 1 . 1 1 680 680 PRO C C 680 174.504 174.504 177.405 -2.901 18986 458 1 1 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.787 -1.269 18986 459 1 1 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.795 -3.480 18986 460 1 1 . 1 1 681 681 GLU N N 681 118.851 118.851 119.176 -0.325 18986 461 1 1 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.984 -0.546 18986 462 1 1 . 1 1 681 681 GLU C C 681 172.890 172.890 174.640 -1.750 18986 463 1 1 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.744 -4.263 18986 464 1 1 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.474 -4.685 18986 465 1 1 . 1 1 681 681 GLU H H 681 10.003 10.003 9.025 0.978 18986 466 1 1 . 1 1 682 682 CYS N N 682 120.934 120.934 118.772 2.162 18986 467 1 1 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.200 -0.173 18986 468 1 1 . 1 1 682 682 CYS C C 682 171.905 171.905 173.917 -2.012 18986 469 1 1 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.649 -3.405 18986 470 1 1 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.012 17.283 18986 471 1 1 . 1 1 682 682 CYS H H 682 7.860 7.860 7.627 0.233 18986 472 1 1 . 1 1 683 683 TYR N N 683 126.183 126.183 124.174 2.009 18986 473 1 1 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.116 0.108 18986 474 1 1 . 1 1 683 683 TYR C C 683 173.008 173.008 175.025 -2.017 18986 475 1 1 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.375 -0.807 18986 476 1 1 . 1 1 683 683 TYR CB C 683 40.952 40.952 41.150 -0.198 18986 477 1 1 . 1 1 683 683 TYR H H 683 9.297 9.297 9.395 -0.098 18986 478 1 1 . 1 1 684 684 LYS N N 684 118.604 118.604 120.737 -2.133 18986 479 1 1 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.729 -0.292 18986 480 1 1 . 1 1 684 684 LYS C C 684 171.628 171.628 174.889 -3.261 18986 481 1 1 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.923 -1.620 18986 482 1 1 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.118 -1.441 18986 483 1 1 . 1 1 684 684 LYS H H 684 8.630 8.630 9.027 -0.397 18986 484 1 1 . 1 1 685 685 LYS N N 685 122.869 122.869 125.103 -2.234 18986 485 1 1 . 1 1 685 685 LYS HA H 685 4.644 4.644 3.993 0.651 18986 486 1 1 . 1 1 685 685 LYS C C 685 173.337 173.337 175.910 -2.573 18986 487 1 1 . 1 1 685 685 LYS CA C 685 54.253 54.253 55.902 -1.649 18986 488 1 1 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.487 -1.560 18986 489 1 1 . 1 1 685 685 LYS H H 685 8.969 8.969 8.430 0.539 18986 490 1 2 . 1 1 601 601 SER HA H 601 4.475 4.475 4.390 0.085 18986 491 1 2 . 1 1 601 601 SER CA C 601 55.508 55.508 59.389 -3.881 18986 492 1 2 . 1 1 601 601 SER CB C 601 61.220 61.220 63.509 -2.289 18986 493 1 2 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.736 -0.120 18986 494 1 2 . 1 1 602 602 HIS C C 602 172.320 172.320 173.485 -1.165 18986 495 1 2 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.569 -1.715 18986 496 1 2 . 1 1 602 602 HIS CB C 602 28.083 28.083 32.192 -4.109 18986 497 1 2 . 1 1 603 603 MET N N 603 121.862 121.862 119.363 2.499 18986 498 1 2 . 1 1 603 603 MET HA H 603 4.425 4.425 5.018 -0.593 18986 499 1 2 . 1 1 603 603 MET C C 603 173.948 173.948 174.243 -0.295 18986 500 1 2 . 1 1 603 603 MET CA C 603 53.108 53.108 55.075 -1.968 18986 501 1 2 . 1 1 603 603 MET CB C 603 30.049 30.049 36.980 -6.931 18986 502 1 2 . 1 1 603 603 MET H H 603 8.394 8.394 8.762 -0.368 18986 503 1 2 . 1 1 604 604 GLY N N 604 110.382 110.382 110.105 0.277 18986 504 1 2 . 1 1 604 604 GLY C C 604 171.590 171.590 172.224 -0.634 18986 505 1 2 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.679 -3.062 18986 506 1 2 . 1 1 604 604 GLY H H 604 8.411 8.411 8.512 -0.101 18986 507 1 2 . 1 1 605 605 GLU N N 605 120.709 120.709 120.436 0.273 18986 508 1 2 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.559 -0.252 18986 509 1 2 . 1 1 605 605 GLU C C 605 174.220 174.220 176.622 -2.402 18986 510 1 2 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.990 -2.024 18986 511 1 2 . 1 1 605 605 GLU CB C 605 27.611 27.611 32.429 -4.818 18986 512 1 2 . 1 1 605 605 GLU H H 605 8.282 8.282 8.419 -0.137 18986 513 1 2 . 1 1 606 606 SER N N 606 116.679 116.679 119.053 -2.374 18986 514 1 2 . 1 1 606 606 SER HA H 606 4.405 4.405 4.457 -0.052 18986 515 1 2 . 1 1 606 606 SER C C 606 172.455 172.455 173.971 -1.516 18986 516 1 2 . 1 1 606 606 SER CA C 606 56.028 56.028 58.348 -2.320 18986 517 1 2 . 1 1 606 606 SER CB C 606 61.039 61.039 62.627 -1.588 18986 518 1 2 . 1 1 606 606 SER H H 606 8.420 8.420 8.676 -0.256 18986 519 1 2 . 1 1 607 607 GLY N N 607 110.716 110.716 109.734 0.982 18986 520 1 2 . 1 1 607 607 GLY C C 607 171.173 171.173 172.779 -1.606 18986 521 1 2 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.751 -2.110 18986 522 1 2 . 1 1 607 607 GLY H H 607 8.386 8.386 7.667 0.719 18986 523 1 2 . 1 1 608 608 LYS N N 608 120.785 120.785 120.210 0.575 18986 524 1 2 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.678 -0.339 18986 525 1 2 . 1 1 608 608 LYS C C 608 173.673 173.673 175.450 -1.777 18986 526 1 2 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.720 -2.355 18986 527 1 2 . 1 1 608 608 LYS CB C 608 30.531 30.531 35.426 -4.895 18986 528 1 2 . 1 1 608 608 LYS H H 608 8.008 8.008 8.461 -0.453 18986 529 1 2 . 1 1 609 609 ILE N N 609 122.404 122.404 119.614 2.790 18986 530 1 2 . 1 1 609 609 ILE HA H 609 4.149 4.149 3.858 0.291 18986 531 1 2 . 1 1 609 609 ILE C C 609 172.675 172.675 173.879 -1.204 18986 532 1 2 . 1 1 609 609 ILE CA C 609 58.003 58.003 61.341 -3.338 18986 533 1 2 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.910 -2.706 18986 534 1 2 . 1 1 609 609 ILE H H 609 8.186 8.186 8.406 -0.220 18986 535 1 2 . 1 1 610 610 ASP N N 610 125.357 125.357 122.678 2.679 18986 536 1 2 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.876 -0.173 18986 537 1 2 . 1 1 610 610 ASP C C 610 173.668 173.668 175.677 -2.009 18986 538 1 2 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.073 -2.371 18986 539 1 2 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.203 -3.513 18986 540 1 2 . 1 1 610 610 ASP H H 610 8.369 8.369 7.977 0.392 18986 541 1 2 . 1 1 611 611 ILE N N 611 122.494 122.494 120.779 1.715 18986 542 1 2 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.046 -0.137 18986 543 1 2 . 1 1 611 611 ILE C C 611 173.618 173.618 178.187 -4.569 18986 544 1 2 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.888 -2.848 18986 545 1 2 . 1 1 611 611 ILE CB C 611 35.798 35.798 37.900 -2.102 18986 546 1 2 . 1 1 611 611 ILE H H 611 8.284 8.284 8.176 0.108 18986 547 1 2 . 1 1 612 612 ASP N N 612 121.440 121.440 119.840 1.600 18986 548 1 2 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.367 0.067 18986 549 1 2 . 1 1 612 612 ASP C C 612 175.129 175.129 177.957 -2.828 18986 550 1 2 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.889 -4.123 18986 551 1 2 . 1 1 612 612 ASP CB C 612 38.138 38.138 40.420 -2.282 18986 552 1 2 . 1 1 612 612 ASP H H 612 8.279 8.279 8.376 -0.097 18986 553 1 2 . 1 1 613 613 THR N N 613 114.422 114.422 112.059 2.363 18986 554 1 2 . 1 1 613 613 THR HA H 613 4.106 4.106 4.130 -0.024 18986 555 1 2 . 1 1 613 613 THR C C 613 173.338 173.338 175.262 -1.924 18986 556 1 2 . 1 1 613 613 THR CA C 613 61.545 61.545 64.580 -3.035 18986 557 1 2 . 1 1 613 613 THR CB C 613 66.267 66.267 68.622 -2.355 18986 558 1 2 . 1 1 613 613 THR H H 613 7.866 7.866 8.304 -0.438 18986 559 1 2 . 1 1 614 614 ILE N N 614 121.654 121.654 118.530 3.124 18986 560 1 2 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.090 -0.061 18986 561 1 2 . 1 1 614 614 ILE C C 614 174.471 174.471 177.690 -3.219 18986 562 1 2 . 1 1 614 614 ILE CA C 614 60.173 60.173 61.826 -1.653 18986 563 1 2 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.937 -2.122 18986 564 1 2 . 1 1 614 614 ILE H H 614 7.819 7.819 7.475 0.344 18986 565 1 2 . 1 1 615 615 MET N N 615 119.713 119.713 118.004 1.709 18986 566 1 2 . 1 1 615 615 MET HA H 615 4.478 4.478 4.314 0.164 18986 567 1 2 . 1 1 615 615 MET C C 615 174.075 174.075 178.456 -4.381 18986 568 1 2 . 1 1 615 615 MET CA C 615 52.764 52.764 57.998 -5.234 18986 569 1 2 . 1 1 615 615 MET CB C 615 29.337 29.337 31.897 -2.560 18986 570 1 2 . 1 1 615 615 MET H H 615 8.188 8.188 8.418 -0.230 18986 571 1 2 . 1 1 616 616 THR N N 616 114.770 114.770 115.359 -0.589 18986 572 1 2 . 1 1 616 616 THR HA H 616 4.099 4.099 4.126 -0.027 18986 573 1 2 . 1 1 616 616 THR C C 616 172.535 172.535 175.691 -3.156 18986 574 1 2 . 1 1 616 616 THR CA C 616 61.112 61.112 65.182 -4.070 18986 575 1 2 . 1 1 616 616 THR CB C 616 66.617 66.617 68.888 -2.271 18986 576 1 2 . 1 1 616 616 THR H H 616 7.722 7.722 8.659 -0.937 18986 577 1 2 . 1 1 617 617 GLY N N 617 111.384 111.384 106.811 4.573 18986 578 1 2 . 1 1 617 617 GLY C C 617 171.437 171.437 174.111 -2.674 18986 579 1 2 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.192 -2.750 18986 580 1 2 . 1 1 617 617 GLY H H 617 8.431 8.431 7.660 0.771 18986 581 1 2 . 1 1 618 618 LYS N N 618 120.996 120.996 120.506 0.490 18986 582 1 2 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.842 -0.175 18986 583 1 2 . 1 1 618 618 LYS CA C 618 50.828 50.828 53.076 -2.248 18986 584 1 2 . 1 1 618 618 LYS CB C 618 29.477 29.477 32.152 -2.675 18986 585 1 2 . 1 1 618 618 LYS H H 618 7.821 7.821 7.836 -0.015 18986 586 1 2 . 1 1 619 619 PRO HA H 619 4.469 4.469 3.998 0.471 18986 587 1 2 . 1 1 619 619 PRO C C 619 174.453 174.453 178.263 -3.810 18986 588 1 2 . 1 1 619 619 PRO CA C 619 60.192 60.192 66.121 -5.929 18986 589 1 2 . 1 1 619 619 PRO CB C 619 29.580 29.580 31.697 -2.116 18986 590 1 2 . 1 1 620 620 LYS N N 620 123.464 123.464 118.334 5.130 18986 591 1 2 . 1 1 620 620 LYS HA H 620 4.046 4.046 4.091 -0.045 18986 592 1 2 . 1 1 620 620 LYS C C 620 174.895 174.895 178.811 -3.916 18986 593 1 2 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.489 -3.200 18986 594 1 2 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.503 -1.049 18986 595 1 2 . 1 1 620 620 LYS H H 620 8.728 8.728 8.319 0.409 18986 596 1 2 . 1 1 621 621 SER N N 621 113.921 113.921 115.352 -1.431 18986 597 1 2 . 1 1 621 621 SER HA H 621 4.336 4.336 4.170 0.166 18986 598 1 2 . 1 1 621 621 SER C C 621 173.149 173.149 176.522 -3.373 18986 599 1 2 . 1 1 621 621 SER CA C 621 56.691 56.691 61.304 -4.613 18986 600 1 2 . 1 1 621 621 SER CB C 621 60.689 60.689 62.689 -2.000 18986 601 1 2 . 1 1 621 621 SER H H 621 8.531 8.531 8.241 0.290 18986 602 1 2 . 1 1 622 622 ALA N N 622 124.177 124.177 124.650 -0.473 18986 603 1 2 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.926 0.242 18986 604 1 2 . 1 1 622 622 ALA C C 622 176.804 176.804 178.706 -1.902 18986 605 1 2 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.336 -2.968 18986 606 1 2 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.289 -2.435 18986 607 1 2 . 1 1 622 622 ALA H H 622 7.835 7.835 8.478 -0.643 18986 608 1 2 . 1 1 623 623 ARG N N 623 118.263 118.263 118.113 0.150 18986 609 1 2 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.998 -0.048 18986 610 1 2 . 1 1 623 623 ARG C C 623 175.683 175.683 178.521 -2.838 18986 611 1 2 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.009 -1.846 18986 612 1 2 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.748 -2.297 18986 613 1 2 . 1 1 623 623 ARG H H 623 8.148 8.148 7.611 0.537 18986 614 1 2 . 1 1 624 624 GLU N N 624 117.953 117.953 119.741 -1.788 18986 615 1 2 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.011 -0.043 18986 616 1 2 . 1 1 624 624 GLU C C 624 177.204 177.204 178.675 -1.471 18986 617 1 2 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.633 -2.776 18986 618 1 2 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.353 -2.386 18986 619 1 2 . 1 1 624 624 GLU H H 624 8.143 8.143 8.693 -0.550 18986 620 1 2 . 1 1 625 625 LYS N N 625 119.222 119.222 118.394 0.828 18986 621 1 2 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.167 -0.310 18986 622 1 2 . 1 1 625 625 LYS C C 625 175.480 175.480 179.088 -3.608 18986 623 1 2 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.111 -1.624 18986 624 1 2 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.780 -2.117 18986 625 1 2 . 1 1 625 625 LYS H H 625 7.772 7.772 7.772 0.000 18986 626 1 2 . 1 1 626 626 MET N N 626 117.883 117.883 118.909 -1.026 18986 627 1 2 . 1 1 626 626 MET HA H 626 3.807 3.807 4.217 -0.410 18986 628 1 2 . 1 1 626 626 MET C C 626 175.278 175.278 178.813 -3.535 18986 629 1 2 . 1 1 626 626 MET CA C 626 57.782 57.782 57.039 0.743 18986 630 1 2 . 1 1 626 626 MET CB C 626 30.657 30.657 31.628 -0.971 18986 631 1 2 . 1 1 626 626 MET H H 626 8.367 8.367 8.407 -0.040 18986 632 1 2 . 1 1 627 627 MET N N 627 116.185 116.185 117.106 -0.921 18986 633 1 2 . 1 1 627 627 MET HA H 627 4.152 4.152 4.016 0.136 18986 634 1 2 . 1 1 627 627 MET C C 627 176.393 176.393 178.304 -1.911 18986 635 1 2 . 1 1 627 627 MET CA C 627 55.359 55.359 58.003 -2.644 18986 636 1 2 . 1 1 627 627 MET CB C 627 28.803 28.803 31.054 -2.251 18986 637 1 2 . 1 1 627 627 MET H H 627 8.197 8.197 8.677 -0.480 18986 638 1 2 . 1 1 628 628 LYS N N 628 119.859 119.859 120.069 -0.210 18986 639 1 2 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.192 0.008 18986 640 1 2 . 1 1 628 628 LYS C C 628 175.885 175.885 179.390 -3.505 18986 641 1 2 . 1 1 628 628 LYS CA C 628 55.077 55.077 58.957 -3.880 18986 642 1 2 . 1 1 628 628 LYS CB C 628 28.531 28.531 31.923 -3.392 18986 643 1 2 . 1 1 628 628 LYS H H 628 7.700 7.700 7.489 0.211 18986 644 1 2 . 1 1 629 629 ILE N N 629 119.001 119.001 120.048 -1.047 18986 645 1 2 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.652 -0.104 18986 646 1 2 . 1 1 629 629 ILE C C 629 174.891 174.891 177.923 -3.032 18986 647 1 2 . 1 1 629 629 ILE CA C 629 62.265 62.265 66.005 -3.740 18986 648 1 2 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.841 -3.992 18986 649 1 2 . 1 1 629 629 ILE H H 629 7.970 7.970 8.157 -0.187 18986 650 1 2 . 1 1 630 630 ILE N N 630 120.737 120.737 117.331 3.406 18986 651 1 2 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.635 -0.168 18986 652 1 2 . 1 1 630 630 ILE C C 630 173.875 173.875 177.710 -3.835 18986 653 1 2 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.693 -1.939 18986 654 1 2 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.909 -2.632 18986 655 1 2 . 1 1 630 630 ILE H H 630 8.213 8.213 7.951 0.262 18986 656 1 2 . 1 1 631 631 GLU N N 631 119.546 119.546 121.349 -1.803 18986 657 1 2 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.957 0.108 18986 658 1 2 . 1 1 631 631 GLU C C 631 177.300 177.300 179.213 -1.913 18986 659 1 2 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.765 -2.785 18986 660 1 2 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.507 -2.514 18986 661 1 2 . 1 1 631 631 GLU H H 631 7.742 7.742 8.213 -0.471 18986 662 1 2 . 1 1 632 632 ILE N N 632 121.547 121.547 120.485 1.062 18986 663 1 2 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.653 0.030 18986 664 1 2 . 1 1 632 632 ILE C C 632 175.454 175.454 178.100 -2.646 18986 665 1 2 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.629 -2.973 18986 666 1 2 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.828 -1.998 18986 667 1 2 . 1 1 632 632 ILE H H 632 8.013 8.013 7.989 0.024 18986 668 1 2 . 1 1 633 633 ILE N N 633 121.605 121.605 120.818 0.787 18986 669 1 2 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.566 -0.231 18986 670 1 2 . 1 1 633 633 ILE C C 633 174.558 174.558 178.128 -3.570 18986 671 1 2 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.752 -1.833 18986 672 1 2 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.240 -1.956 18986 673 1 2 . 1 1 633 633 ILE H H 633 8.594 8.594 8.100 0.494 18986 674 1 2 . 1 1 634 634 ASP N N 634 118.706 118.706 119.485 -0.779 18986 675 1 2 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.438 -0.003 18986 676 1 2 . 1 1 634 634 ASP C C 634 176.574 176.574 178.188 -1.614 18986 677 1 2 . 1 1 634 634 ASP CA C 634 54.571 54.571 56.953 -2.382 18986 678 1 2 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.469 -2.555 18986 679 1 2 . 1 1 634 634 ASP H H 634 8.724 8.724 8.189 0.535 18986 680 1 2 . 1 1 635 635 SER N N 635 114.064 114.064 115.601 -1.537 18986 681 1 2 . 1 1 635 635 SER HA H 635 4.232 4.232 4.215 0.017 18986 682 1 2 . 1 1 635 635 SER C C 635 174.487 174.487 177.322 -2.835 18986 683 1 2 . 1 1 635 635 SER CA C 635 58.540 58.540 61.235 -2.695 18986 684 1 2 . 1 1 635 635 SER CB C 635 60.319 60.319 63.339 -3.019 18986 685 1 2 . 1 1 635 635 SER H H 635 7.992 7.992 8.055 -0.063 18986 686 1 2 . 1 1 636 636 LEU N N 636 122.493 122.493 122.774 -0.281 18986 687 1 2 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.051 0.203 18986 688 1 2 . 1 1 636 636 LEU C C 636 176.194 176.194 178.723 -2.529 18986 689 1 2 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.926 -3.831 18986 690 1 2 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.910 -2.204 18986 691 1 2 . 1 1 636 636 LEU H H 636 8.169 8.169 8.530 -0.361 18986 692 1 2 . 1 1 637 637 ALA N N 637 121.891 121.891 119.066 2.825 18986 693 1 2 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.456 -0.367 18986 694 1 2 . 1 1 637 637 ALA C C 637 175.131 175.131 178.664 -3.533 18986 695 1 2 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.036 -2.700 18986 696 1 2 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.360 -2.872 18986 697 1 2 . 1 1 637 637 ALA H H 637 8.482 8.482 8.214 0.268 18986 698 1 2 . 1 1 638 638 VAL N N 638 117.140 117.140 117.450 -0.310 18986 699 1 2 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.886 0.049 18986 700 1 2 . 1 1 638 638 VAL C C 638 174.712 174.712 176.306 -1.594 18986 701 1 2 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.201 -2.200 18986 702 1 2 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.679 -2.328 18986 703 1 2 . 1 1 638 638 VAL H H 638 7.291 7.291 7.736 -0.445 18986 704 1 2 . 1 1 639 639 SER N N 639 114.143 114.143 112.493 1.650 18986 705 1 2 . 1 1 639 639 SER HA H 639 4.481 4.481 4.518 -0.037 18986 706 1 2 . 1 1 639 639 SER C C 639 172.122 172.122 173.825 -1.703 18986 707 1 2 . 1 1 639 639 SER CA C 639 56.002 56.002 58.197 -2.195 18986 708 1 2 . 1 1 639 639 SER CB C 639 60.921 60.921 65.621 -4.700 18986 709 1 2 . 1 1 639 639 SER H H 639 7.918 7.918 7.693 0.225 18986 710 1 2 . 1 1 640 640 SER N N 640 115.370 115.370 118.363 -2.993 18986 711 1 2 . 1 1 640 640 SER HA H 640 4.711 4.711 4.505 0.206 18986 712 1 2 . 1 1 640 640 SER C C 640 171.185 171.185 175.796 -4.611 18986 713 1 2 . 1 1 640 640 SER CA C 640 55.009 55.009 58.256 -3.247 18986 714 1 2 . 1 1 640 640 SER CB C 640 61.974 61.974 63.957 -1.983 18986 715 1 2 . 1 1 640 640 SER H H 640 7.765 7.765 8.123 -0.358 18986 716 1 2 . 1 1 641 641 GLU N N 641 119.994 119.994 120.974 -0.980 18986 717 1 2 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.084 -0.040 18986 718 1 2 . 1 1 641 641 GLU C C 641 173.167 173.167 175.426 -2.259 18986 719 1 2 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.871 -2.220 18986 720 1 2 . 1 1 641 641 GLU CB C 641 27.484 27.484 30.160 -2.676 18986 721 1 2 . 1 1 641 641 GLU H H 641 8.363 8.363 8.971 -0.608 18986 722 1 2 . 1 1 642 642 CYS N N 642 110.257 110.257 112.030 -1.773 18986 723 1 2 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.634 -0.175 18986 724 1 2 . 1 1 642 642 CYS C C 642 168.058 168.058 173.366 -5.308 18986 725 1 2 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.499 -4.553 18986 726 1 2 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.111 10.250 18986 727 1 2 . 1 1 642 642 CYS H H 642 7.881 7.881 7.206 0.675 18986 728 1 2 . 1 1 643 643 ALA N N 643 123.922 123.922 125.073 -1.151 18986 729 1 2 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.340 0.298 18986 730 1 2 . 1 1 643 643 ALA C C 643 172.517 172.517 176.580 -4.063 18986 731 1 2 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.604 -3.984 18986 732 1 2 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.953 0.491 18986 733 1 2 . 1 1 643 643 ALA H H 643 9.787 9.787 8.977 0.810 18986 734 1 2 . 1 1 644 644 LYS N N 644 128.479 128.479 126.075 2.404 18986 735 1 2 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.249 0.262 18986 736 1 2 . 1 1 644 644 LYS C C 644 176.945 176.945 177.741 -0.796 18986 737 1 2 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.777 -2.439 18986 738 1 2 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.881 -1.939 18986 739 1 2 . 1 1 644 644 LYS H H 644 9.809 9.809 8.586 1.223 18986 740 1 2 . 1 1 645 645 VAL N N 645 124.257 124.257 126.031 -1.774 18986 741 1 2 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.748 -0.100 18986 742 1 2 . 1 1 645 645 VAL C C 645 173.996 173.996 176.658 -2.662 18986 743 1 2 . 1 1 645 645 VAL CA C 645 64.862 64.862 65.610 -0.748 18986 744 1 2 . 1 1 645 645 VAL CB C 645 29.201 29.201 32.169 -2.968 18986 745 1 2 . 1 1 645 645 VAL H H 645 8.458 8.458 9.106 -0.648 18986 746 1 2 . 1 1 646 646 LYS N N 646 117.598 117.598 120.134 -2.536 18986 747 1 2 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.927 0.080 18986 748 1 2 . 1 1 646 646 LYS C C 646 176.047 176.047 178.368 -2.321 18986 749 1 2 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.250 -3.005 18986 750 1 2 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.934 -2.536 18986 751 1 2 . 1 1 646 646 LYS H H 646 8.706 8.706 8.474 0.232 18986 752 1 2 . 1 1 647 647 ASP N N 647 119.229 119.229 119.740 -0.511 18986 753 1 2 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.473 0.145 18986 754 1 2 . 1 1 647 647 ASP C C 647 175.211 175.211 178.665 -3.454 18986 755 1 2 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.779 -3.456 18986 756 1 2 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.607 -1.869 18986 757 1 2 . 1 1 647 647 ASP H H 647 7.012 7.012 7.975 -0.963 18986 758 1 2 . 1 1 648 648 ILE N N 648 121.939 121.939 120.917 1.022 18986 759 1 2 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.561 -0.180 18986 760 1 2 . 1 1 648 648 ILE C C 648 175.243 175.243 177.850 -2.607 18986 761 1 2 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.721 -2.680 18986 762 1 2 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.813 -1.851 18986 763 1 2 . 1 1 648 648 ILE H H 648 8.152 8.152 7.451 0.701 18986 764 1 2 . 1 1 649 649 LEU N N 649 117.310 117.310 120.100 -2.790 18986 765 1 2 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.782 0.091 18986 766 1 2 . 1 1 649 649 LEU C C 649 176.439 176.439 178.907 -2.468 18986 767 1 2 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.486 -2.601 18986 768 1 2 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.412 -2.106 18986 769 1 2 . 1 1 649 649 LEU H H 649 8.638 8.638 8.605 0.033 18986 770 1 2 . 1 1 650 650 LYS N N 650 118.810 118.810 119.632 -0.822 18986 771 1 2 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.836 0.210 18986 772 1 2 . 1 1 650 650 LYS C C 650 176.801 176.801 178.720 -1.919 18986 773 1 2 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.832 -2.781 18986 774 1 2 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.344 -2.280 18986 775 1 2 . 1 1 650 650 LYS H H 650 7.296 7.296 7.983 -0.687 18986 776 1 2 . 1 1 651 651 GLU N N 651 117.713 117.713 118.476 -0.763 18986 777 1 2 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.092 0.016 18986 778 1 2 . 1 1 651 651 GLU C C 651 176.903 176.903 179.197 -2.294 18986 779 1 2 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.488 -2.678 18986 780 1 2 . 1 1 651 651 GLU CB C 651 27.448 27.448 28.975 -1.527 18986 781 1 2 . 1 1 651 651 GLU H H 651 8.036 8.036 8.458 -0.422 18986 782 1 2 . 1 1 652 652 ALA N N 652 121.206 121.206 122.324 -1.118 18986 783 1 2 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.061 -0.063 18986 784 1 2 . 1 1 652 652 ALA C C 652 176.766 176.766 179.916 -3.150 18986 785 1 2 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.134 -3.400 18986 786 1 2 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.126 -2.810 18986 787 1 2 . 1 1 652 652 ALA H H 652 8.973 8.973 8.709 0.264 18986 788 1 2 . 1 1 653 653 GLN N N 653 117.768 117.768 118.456 -0.688 18986 789 1 2 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.289 0.188 18986 790 1 2 . 1 1 653 653 GLN C C 653 177.388 177.388 178.918 -1.530 18986 791 1 2 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.493 -2.433 18986 792 1 2 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.814 -2.045 18986 793 1 2 . 1 1 653 653 GLN H H 653 8.059 8.059 8.251 -0.192 18986 794 1 2 . 1 1 654 654 GLN N N 654 117.979 117.979 117.884 0.095 18986 795 1 2 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.086 0.091 18986 796 1 2 . 1 1 654 654 GLN C C 654 174.834 174.834 178.462 -3.628 18986 797 1 2 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.017 -2.599 18986 798 1 2 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.503 -2.526 18986 799 1 2 . 1 1 654 654 GLN H H 654 7.495 7.495 8.068 -0.573 18986 800 1 2 . 1 1 655 655 VAL N N 655 110.080 110.080 116.909 -6.829 18986 801 1 2 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.847 0.680 18986 802 1 2 . 1 1 655 655 VAL C C 655 173.369 173.369 176.900 -3.531 18986 803 1 2 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.236 -6.169 18986 804 1 2 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.492 -4.308 18986 805 1 2 . 1 1 655 655 VAL H H 655 7.197 7.197 8.012 -0.815 18986 806 1 2 . 1 1 656 656 GLY N N 656 107.089 107.089 106.094 0.995 18986 807 1 2 . 1 1 656 656 GLY C C 656 171.639 171.639 174.239 -2.600 18986 808 1 2 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.686 -1.375 18986 809 1 2 . 1 1 656 656 GLY H H 656 7.541 7.541 7.873 -0.332 18986 810 1 2 . 1 1 657 657 ILE N N 657 121.266 121.266 120.904 0.362 18986 811 1 2 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.357 -0.224 18986 812 1 2 . 1 1 657 657 ILE C C 657 171.885 171.885 175.344 -3.459 18986 813 1 2 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.532 -2.303 18986 814 1 2 . 1 1 657 657 ILE CB C 657 35.191 35.191 40.007 -4.816 18986 815 1 2 . 1 1 657 657 ILE H H 657 7.633 7.633 8.482 -0.849 18986 816 1 2 . 1 1 658 658 GLU N N 658 127.252 127.252 122.891 4.361 18986 817 1 2 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.461 -0.258 18986 818 1 2 . 1 1 658 658 GLU C C 658 175.316 175.316 177.426 -2.110 18986 819 1 2 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.520 -1.159 18986 820 1 2 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.242 -3.632 18986 821 1 2 . 1 1 658 658 GLU H H 658 8.690 8.690 8.530 0.160 18986 822 1 2 . 1 1 659 659 LYS N N 659 124.533 124.533 124.979 -0.446 18986 823 1 2 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.802 -0.014 18986 824 1 2 . 1 1 659 659 LYS C C 659 175.170 175.170 178.776 -3.606 18986 825 1 2 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.522 -2.351 18986 826 1 2 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.829 -1.712 18986 827 1 2 . 1 1 659 659 LYS H H 659 8.706 8.706 8.911 -0.205 18986 828 1 2 . 1 1 660 660 SER N N 660 113.137 113.137 111.807 1.330 18986 829 1 2 . 1 1 660 660 SER HA H 660 4.273 4.273 4.317 -0.044 18986 830 1 2 . 1 1 660 660 SER C C 660 173.939 173.939 176.462 -2.523 18986 831 1 2 . 1 1 660 660 SER CA C 660 58.350 58.350 60.563 -2.213 18986 832 1 2 . 1 1 660 660 SER CB C 660 59.504 59.504 62.625 -3.121 18986 833 1 2 . 1 1 660 660 SER H H 660 8.777 8.777 8.188 0.589 18986 834 1 2 . 1 1 661 661 ASN N N 661 119.986 119.986 121.426 -1.440 18986 835 1 2 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.339 0.367 18986 836 1 2 . 1 1 661 661 ASN C C 661 174.516 174.516 177.548 -3.032 18986 837 1 2 . 1 1 661 661 ASN CA C 661 52.048 52.048 57.318 -5.270 18986 838 1 2 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.502 -1.759 18986 839 1 2 . 1 1 661 661 ASN H H 661 7.486 7.486 8.694 -1.208 18986 840 1 2 . 1 1 662 662 ILE N N 662 120.639 120.639 121.270 -0.631 18986 841 1 2 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.564 -0.118 18986 842 1 2 . 1 1 662 662 ILE C C 662 174.252 174.252 177.854 -3.602 18986 843 1 2 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.986 -3.380 18986 844 1 2 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.790 -3.367 18986 845 1 2 . 1 1 662 662 ILE H H 662 7.999 7.999 8.598 -0.599 18986 846 1 2 . 1 1 663 663 GLU N N 663 117.706 117.706 118.964 -1.258 18986 847 1 2 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.897 -0.107 18986 848 1 2 . 1 1 663 663 GLU C C 663 176.509 176.509 179.161 -2.652 18986 849 1 2 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.885 -2.176 18986 850 1 2 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.295 -2.540 18986 851 1 2 . 1 1 663 663 GLU H H 663 8.190 8.190 8.204 -0.014 18986 852 1 2 . 1 1 664 664 LYS N N 664 119.586 119.586 120.705 -1.119 18986 853 1 2 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.031 0.022 18986 854 1 2 . 1 1 664 664 LYS C C 664 175.941 175.941 179.004 -3.063 18986 855 1 2 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.431 -2.850 18986 856 1 2 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.145 -2.322 18986 857 1 2 . 1 1 664 664 LYS H H 664 7.590 7.590 8.212 -0.622 18986 858 1 2 . 1 1 665 665 LEU N N 665 119.756 119.756 120.355 -0.599 18986 859 1 2 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.097 -0.017 18986 860 1 2 . 1 1 665 665 LEU C C 665 176.700 176.700 179.371 -2.671 18986 861 1 2 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.871 -2.486 18986 862 1 2 . 1 1 665 665 LEU CB C 665 39.192 39.192 42.003 -2.811 18986 863 1 2 . 1 1 665 665 LEU H H 665 8.075 8.075 8.356 -0.281 18986 864 1 2 . 1 1 666 666 LEU N N 666 118.788 118.788 116.594 2.194 18986 865 1 2 . 1 1 666 666 LEU HA H 666 3.764 3.764 4.008 -0.244 18986 866 1 2 . 1 1 666 666 LEU C C 666 176.484 176.484 178.498 -2.014 18986 867 1 2 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.186 -2.528 18986 868 1 2 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.513 -1.902 18986 869 1 2 . 1 1 666 666 LEU H H 666 8.550 8.550 8.537 0.013 18986 870 1 2 . 1 1 667 667 THR N N 667 115.244 115.244 117.533 -2.289 18986 871 1 2 . 1 1 667 667 THR HA H 667 3.839 3.839 3.836 0.003 18986 872 1 2 . 1 1 667 667 THR C C 667 173.740 173.740 176.486 -2.746 18986 873 1 2 . 1 1 667 667 THR CA C 667 64.378 64.378 67.549 -3.171 18986 874 1 2 . 1 1 667 667 THR CB C 667 65.748 65.748 68.433 -2.685 18986 875 1 2 . 1 1 667 667 THR H H 667 7.662 7.662 7.938 -0.276 18986 876 1 2 . 1 1 668 668 ASP N N 668 122.862 122.862 121.705 1.157 18986 877 1 2 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.400 -0.017 18986 878 1 2 . 1 1 668 668 ASP C C 668 177.192 177.192 178.703 -1.511 18986 879 1 2 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.153 -2.022 18986 880 1 2 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.272 -2.386 18986 881 1 2 . 1 1 668 668 ASP H H 668 8.291 8.291 8.416 -0.125 18986 882 1 2 . 1 1 669 669 MET N N 669 119.640 119.640 119.332 0.308 18986 883 1 2 . 1 1 669 669 MET HA H 669 3.917 3.917 4.140 -0.223 18986 884 1 2 . 1 1 669 669 MET C C 669 175.414 175.414 178.441 -3.027 18986 885 1 2 . 1 1 669 669 MET CA C 669 57.234 57.234 59.751 -2.517 18986 886 1 2 . 1 1 669 669 MET CB C 669 32.088 32.088 32.788 -0.700 18986 887 1 2 . 1 1 669 669 MET H H 669 8.809 8.809 8.523 0.286 18986 888 1 2 . 1 1 670 670 ARG N N 670 122.614 122.614 116.193 6.421 18986 889 1 2 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.628 -0.111 18986 890 1 2 . 1 1 670 670 ARG C C 670 177.928 177.928 178.492 -0.564 18986 891 1 2 . 1 1 670 670 ARG CA C 670 56.222 56.222 57.906 -1.684 18986 892 1 2 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.529 -2.225 18986 893 1 2 . 1 1 670 670 ARG H H 670 8.450 8.450 8.042 0.408 18986 894 1 2 . 1 1 671 671 LYS N N 671 121.976 121.976 118.862 3.114 18986 895 1 2 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.402 -0.289 18986 896 1 2 . 1 1 671 671 LYS C C 671 176.143 176.143 177.822 -1.679 18986 897 1 2 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.246 -1.160 18986 898 1 2 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.912 -3.408 18986 899 1 2 . 1 1 671 671 LYS H H 671 8.609 8.609 8.003 0.606 18986 900 1 2 . 1 1 672 672 SER N N 672 111.655 111.655 114.125 -2.470 18986 901 1 2 . 1 1 672 672 SER HA H 672 4.469 4.469 4.559 -0.090 18986 902 1 2 . 1 1 672 672 SER C C 672 171.692 171.692 175.791 -4.099 18986 903 1 2 . 1 1 672 672 SER CA C 672 56.790 56.790 60.524 -3.734 18986 904 1 2 . 1 1 672 672 SER CB C 672 61.343 61.343 64.353 -3.010 18986 905 1 2 . 1 1 672 672 SER H H 672 7.884 7.884 8.068 -0.184 18986 906 1 2 . 1 1 673 673 GLY N N 673 108.029 108.029 107.727 0.302 18986 907 1 2 . 1 1 673 673 GLY C C 673 171.492 171.492 175.047 -3.555 18986 908 1 2 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.080 -1.805 18986 909 1 2 . 1 1 673 673 GLY H H 673 7.774 7.774 8.431 -0.657 18986 910 1 2 . 1 1 674 674 ILE N N 674 116.193 116.193 120.388 -4.195 18986 911 1 2 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.883 0.218 18986 912 1 2 . 1 1 674 674 ILE C C 674 173.980 173.980 175.622 -1.642 18986 913 1 2 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.656 -3.414 18986 914 1 2 . 1 1 674 674 ILE CB C 674 36.804 36.804 37.819 -1.015 18986 915 1 2 . 1 1 674 674 ILE H H 674 8.026 8.026 7.947 0.079 18986 916 1 2 . 1 1 675 675 ILE N N 675 108.928 108.928 111.945 -3.017 18986 917 1 2 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.747 0.611 18986 918 1 2 . 1 1 675 675 ILE C C 675 170.797 170.797 173.638 -2.841 18986 919 1 2 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.994 -2.970 18986 920 1 2 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.084 -2.598 18986 921 1 2 . 1 1 675 675 ILE H H 675 7.120 7.120 7.237 -0.117 18986 922 1 2 . 1 1 676 676 TYR N N 676 118.062 118.062 118.224 -0.162 18986 923 1 2 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.207 -0.212 18986 924 1 2 . 1 1 676 676 TYR C C 676 170.020 170.020 174.137 -4.117 18986 925 1 2 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.425 -2.531 18986 926 1 2 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.566 -3.050 18986 927 1 2 . 1 1 676 676 TYR H H 676 9.380 9.380 8.656 0.724 18986 928 1 2 . 1 1 677 677 GLU N N 677 123.578 123.578 122.762 0.816 18986 929 1 2 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.021 -0.195 18986 930 1 2 . 1 1 677 677 GLU C C 677 172.146 172.146 175.818 -3.672 18986 931 1 2 . 1 1 677 677 GLU CA C 677 52.476 52.476 54.965 -2.489 18986 932 1 2 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.463 -1.851 18986 933 1 2 . 1 1 677 677 GLU H H 677 8.951 8.951 8.841 0.110 18986 934 1 2 . 1 1 678 678 ALA N N 678 133.220 133.220 128.134 5.086 18986 935 1 2 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.301 -0.260 18986 936 1 2 . 1 1 678 678 ALA C C 678 175.219 175.219 177.487 -2.268 18986 937 1 2 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.987 -2.386 18986 938 1 2 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.434 -2.835 18986 939 1 2 . 1 1 678 678 ALA H H 678 7.912 7.912 8.013 -0.101 18986 940 1 2 . 1 1 679 679 LYS N N 679 115.687 115.687 114.493 1.194 18986 941 1 2 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.786 -0.351 18986 942 1 2 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.609 -1.593 18986 943 1 2 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.910 -2.915 18986 944 1 2 . 1 1 679 679 LYS H H 679 8.215 8.215 7.842 0.373 18986 945 1 2 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.211 -0.192 18986 946 1 2 . 1 1 680 680 PRO C C 680 174.504 174.504 177.159 -2.655 18986 947 1 2 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.012 -1.494 18986 948 1 2 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.623 -3.308 18986 949 1 2 . 1 1 681 681 GLU N N 681 118.851 118.851 115.123 3.728 18986 950 1 2 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.905 -0.467 18986 951 1 2 . 1 1 681 681 GLU C C 681 172.890 172.890 174.785 -1.895 18986 952 1 2 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.175 -3.694 18986 953 1 2 . 1 1 681 681 GLU CB C 681 24.789 24.789 27.887 -3.099 18986 954 1 2 . 1 1 681 681 GLU H H 681 10.003 10.003 9.108 0.895 18986 955 1 2 . 1 1 682 682 CYS N N 682 120.934 120.934 117.070 3.864 18986 956 1 2 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.119 -0.092 18986 957 1 2 . 1 1 682 682 CYS C C 682 171.905 171.905 173.235 -1.330 18986 958 1 2 . 1 1 682 682 CYS CA C 682 54.244 54.244 58.272 -4.028 18986 959 1 2 . 1 1 682 682 CYS CB C 682 45.295 45.295 29.776 15.518 18986 960 1 2 . 1 1 682 682 CYS H H 682 7.860 7.860 7.556 0.304 18986 961 1 2 . 1 1 683 683 TYR N N 683 126.183 126.183 123.329 2.854 18986 962 1 2 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.310 -0.086 18986 963 1 2 . 1 1 683 683 TYR C C 683 173.008 173.008 174.790 -1.782 18986 964 1 2 . 1 1 683 683 TYR CA C 683 56.568 56.568 56.673 -0.105 18986 965 1 2 . 1 1 683 683 TYR CB C 683 40.952 40.952 41.981 -1.029 18986 966 1 2 . 1 1 683 683 TYR H H 683 9.297 9.297 9.348 -0.051 18986 967 1 2 . 1 1 684 684 LYS N N 684 118.604 118.604 118.908 -0.304 18986 968 1 2 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.625 -0.188 18986 969 1 2 . 1 1 684 684 LYS C C 684 171.628 171.628 174.245 -2.617 18986 970 1 2 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.238 -0.935 18986 971 1 2 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.425 -1.748 18986 972 1 2 . 1 1 684 684 LYS H H 684 8.630 8.630 8.826 -0.196 18986 973 1 2 . 1 1 685 685 LYS N N 685 122.869 122.869 125.563 -2.694 18986 974 1 2 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.197 0.447 18986 975 1 2 . 1 1 685 685 LYS C C 685 173.337 173.337 175.201 -1.864 18986 976 1 2 . 1 1 685 685 LYS CA C 685 54.253 54.253 55.944 -1.692 18986 977 1 2 . 1 1 685 685 LYS CB C 685 30.927 30.927 33.478 -2.551 18986 978 1 2 . 1 1 685 685 LYS H H 685 8.969 8.969 8.522 0.447 18986 979 1 3 . 1 1 601 601 SER HA H 601 4.475 4.475 4.292 0.183 18986 980 1 3 . 1 1 601 601 SER CA C 601 55.508 55.508 58.602 -3.095 18986 981 1 3 . 1 1 601 601 SER CB C 601 61.220 61.220 63.539 -2.319 18986 982 1 3 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.337 0.279 18986 983 1 3 . 1 1 602 602 HIS C C 602 172.320 172.320 174.461 -2.141 18986 984 1 3 . 1 1 602 602 HIS CA C 602 53.854 53.854 57.095 -3.241 18986 985 1 3 . 1 1 602 602 HIS CB C 602 28.083 28.083 28.762 -0.679 18986 986 1 3 . 1 1 603 603 MET N N 603 121.862 121.862 118.514 3.348 18986 987 1 3 . 1 1 603 603 MET HA H 603 4.425 4.425 4.600 -0.175 18986 988 1 3 . 1 1 603 603 MET C C 603 173.948 173.948 176.196 -2.248 18986 989 1 3 . 1 1 603 603 MET CA C 603 53.108 53.108 56.299 -3.191 18986 990 1 3 . 1 1 603 603 MET CB C 603 30.049 30.049 33.611 -3.562 18986 991 1 3 . 1 1 603 603 MET H H 603 8.394 8.394 7.279 1.115 18986 992 1 3 . 1 1 604 604 GLY N N 604 110.382 110.382 107.865 2.517 18986 993 1 3 . 1 1 604 604 GLY C C 604 171.590 171.590 173.911 -2.321 18986 994 1 3 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.946 -2.329 18986 995 1 3 . 1 1 604 604 GLY H H 604 8.411 8.411 8.392 0.019 18986 996 1 3 . 1 1 605 605 GLU N N 605 120.709 120.709 119.849 0.860 18986 997 1 3 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.695 -0.388 18986 998 1 3 . 1 1 605 605 GLU C C 605 174.220 174.220 175.442 -1.222 18986 999 1 3 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.292 -1.326 18986 1000 1 3 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.651 -3.040 18986 1001 1 3 . 1 1 605 605 GLU H H 605 8.282 8.282 8.037 0.245 18986 1002 1 3 . 1 1 606 606 SER N N 606 116.679 116.679 113.733 2.946 18986 1003 1 3 . 1 1 606 606 SER HA H 606 4.405 4.405 4.692 -0.287 18986 1004 1 3 . 1 1 606 606 SER C C 606 172.455 172.455 173.576 -1.121 18986 1005 1 3 . 1 1 606 606 SER CA C 606 56.028 56.028 57.498 -1.470 18986 1006 1 3 . 1 1 606 606 SER CB C 606 61.039 61.039 64.303 -3.264 18986 1007 1 3 . 1 1 606 606 SER H H 606 8.420 8.420 8.351 0.069 18986 1008 1 3 . 1 1 607 607 GLY N N 607 110.716 110.716 109.100 1.616 18986 1009 1 3 . 1 1 607 607 GLY C C 607 171.173 171.173 173.049 -1.876 18986 1010 1 3 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.557 -2.916 18986 1011 1 3 . 1 1 607 607 GLY H H 607 8.386 8.386 8.266 0.120 18986 1012 1 3 . 1 1 608 608 LYS N N 608 120.785 120.785 122.507 -1.722 18986 1013 1 3 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.716 -0.377 18986 1014 1 3 . 1 1 608 608 LYS C C 608 173.673 173.673 175.382 -1.709 18986 1015 1 3 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.387 -3.022 18986 1016 1 3 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.143 -2.612 18986 1017 1 3 . 1 1 608 608 LYS H H 608 8.008 8.008 8.325 -0.317 18986 1018 1 3 . 1 1 609 609 ILE N N 609 122.404 122.404 124.822 -2.418 18986 1019 1 3 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.476 -0.327 18986 1020 1 3 . 1 1 609 609 ILE C C 609 172.675 172.675 175.386 -2.711 18986 1021 1 3 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.294 -2.292 18986 1022 1 3 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.571 -3.367 18986 1023 1 3 . 1 1 609 609 ILE H H 609 8.186 8.186 8.215 -0.029 18986 1024 1 3 . 1 1 610 610 ASP N N 610 125.357 125.357 122.988 2.369 18986 1025 1 3 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.913 -0.210 18986 1026 1 3 . 1 1 610 610 ASP C C 610 173.668 173.668 175.647 -1.979 18986 1027 1 3 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.360 -2.658 18986 1028 1 3 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.396 -4.706 18986 1029 1 3 . 1 1 610 610 ASP H H 610 8.369 8.369 7.954 0.415 18986 1030 1 3 . 1 1 611 611 ILE N N 611 122.494 122.494 121.522 0.972 18986 1031 1 3 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.883 0.026 18986 1032 1 3 . 1 1 611 611 ILE C C 611 173.618 173.618 176.927 -3.309 18986 1033 1 3 . 1 1 611 611 ILE CA C 611 60.040 60.040 64.421 -4.380 18986 1034 1 3 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.064 -2.266 18986 1035 1 3 . 1 1 611 611 ILE H H 611 8.284 8.284 8.131 0.153 18986 1036 1 3 . 1 1 612 612 ASP N N 612 121.440 121.440 119.998 1.442 18986 1037 1 3 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.339 0.095 18986 1038 1 3 . 1 1 612 612 ASP C C 612 175.129 175.129 178.419 -3.290 18986 1039 1 3 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.108 -4.342 18986 1040 1 3 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.777 -1.639 18986 1041 1 3 . 1 1 612 612 ASP H H 612 8.279 8.279 8.467 -0.188 18986 1042 1 3 . 1 1 613 613 THR N N 613 114.422 114.422 112.068 2.354 18986 1043 1 3 . 1 1 613 613 THR HA H 613 4.106 4.106 4.081 0.025 18986 1044 1 3 . 1 1 613 613 THR C C 613 173.338 173.338 175.179 -1.841 18986 1045 1 3 . 1 1 613 613 THR CA C 613 61.545 61.545 64.524 -2.979 18986 1046 1 3 . 1 1 613 613 THR CB C 613 66.267 66.267 68.501 -2.234 18986 1047 1 3 . 1 1 613 613 THR H H 613 7.866 7.866 8.189 -0.323 18986 1048 1 3 . 1 1 614 614 ILE N N 614 121.654 121.654 118.692 2.962 18986 1049 1 3 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.126 -0.097 18986 1050 1 3 . 1 1 614 614 ILE C C 614 174.471 174.471 178.107 -3.636 18986 1051 1 3 . 1 1 614 614 ILE CA C 614 60.173 60.173 62.031 -1.858 18986 1052 1 3 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.092 -2.277 18986 1053 1 3 . 1 1 614 614 ILE H H 614 7.819 7.819 7.779 0.040 18986 1054 1 3 . 1 1 615 615 MET N N 615 119.713 119.713 117.755 1.958 18986 1055 1 3 . 1 1 615 615 MET HA H 615 4.478 4.478 4.739 -0.261 18986 1056 1 3 . 1 1 615 615 MET C C 615 174.075 174.075 177.899 -3.824 18986 1057 1 3 . 1 1 615 615 MET CA C 615 52.764 52.764 56.977 -4.213 18986 1058 1 3 . 1 1 615 615 MET CB C 615 29.337 29.337 31.694 -2.357 18986 1059 1 3 . 1 1 615 615 MET H H 615 8.188 8.188 8.409 -0.221 18986 1060 1 3 . 1 1 616 616 THR N N 616 114.770 114.770 113.968 0.802 18986 1061 1 3 . 1 1 616 616 THR HA H 616 4.099 4.099 4.203 -0.104 18986 1062 1 3 . 1 1 616 616 THR C C 616 172.535 172.535 175.613 -3.078 18986 1063 1 3 . 1 1 616 616 THR CA C 616 61.112 61.112 64.266 -3.154 18986 1064 1 3 . 1 1 616 616 THR CB C 616 66.617 66.617 69.288 -2.671 18986 1065 1 3 . 1 1 616 616 THR H H 616 7.722 7.722 8.297 -0.575 18986 1066 1 3 . 1 1 617 617 GLY N N 617 111.384 111.384 107.613 3.771 18986 1067 1 3 . 1 1 617 617 GLY C C 617 171.437 171.437 173.506 -2.069 18986 1068 1 3 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.174 -2.732 18986 1069 1 3 . 1 1 617 617 GLY H H 617 8.431 8.431 7.921 0.510 18986 1070 1 3 . 1 1 618 618 LYS N N 618 120.996 120.996 120.800 0.196 18986 1071 1 3 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.854 -0.187 18986 1072 1 3 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.907 -2.079 18986 1073 1 3 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.612 -5.135 18986 1074 1 3 . 1 1 618 618 LYS H H 618 7.821 7.821 7.891 -0.070 18986 1075 1 3 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.608 -0.139 18986 1076 1 3 . 1 1 619 619 PRO C C 619 174.453 174.453 177.996 -3.543 18986 1077 1 3 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.745 -2.553 18986 1078 1 3 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.648 -3.068 18986 1079 1 3 . 1 1 620 620 LYS N N 620 123.464 123.464 122.352 1.112 18986 1080 1 3 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.867 0.179 18986 1081 1 3 . 1 1 620 620 LYS C C 620 174.895 174.895 178.794 -3.899 18986 1082 1 3 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.411 -4.122 18986 1083 1 3 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.881 -1.427 18986 1084 1 3 . 1 1 620 620 LYS H H 620 8.728 8.728 8.661 0.067 18986 1085 1 3 . 1 1 621 621 SER N N 621 113.921 113.921 115.205 -1.284 18986 1086 1 3 . 1 1 621 621 SER HA H 621 4.336 4.336 4.031 0.305 18986 1087 1 3 . 1 1 621 621 SER C C 621 173.149 173.149 176.215 -3.066 18986 1088 1 3 . 1 1 621 621 SER CA C 621 56.691 56.691 60.874 -4.183 18986 1089 1 3 . 1 1 621 621 SER CB C 621 60.689 60.689 62.671 -1.982 18986 1090 1 3 . 1 1 621 621 SER H H 621 8.531 8.531 8.363 0.168 18986 1091 1 3 . 1 1 622 622 ALA N N 622 124.177 124.177 123.483 0.694 18986 1092 1 3 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.993 0.175 18986 1093 1 3 . 1 1 622 622 ALA C C 622 176.804 176.804 179.099 -2.295 18986 1094 1 3 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.000 -2.632 18986 1095 1 3 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.105 -2.252 18986 1096 1 3 . 1 1 622 622 ALA H H 622 7.835 7.835 8.092 -0.257 18986 1097 1 3 . 1 1 623 623 ARG N N 623 118.263 118.263 118.428 -0.165 18986 1098 1 3 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.915 0.035 18986 1099 1 3 . 1 1 623 623 ARG C C 623 175.683 175.683 178.601 -2.918 18986 1100 1 3 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.985 -1.822 18986 1101 1 3 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.336 -1.885 18986 1102 1 3 . 1 1 623 623 ARG H H 623 8.148 8.148 7.898 0.250 18986 1103 1 3 . 1 1 624 624 GLU N N 624 117.953 117.953 119.775 -1.822 18986 1104 1 3 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.187 -0.219 18986 1105 1 3 . 1 1 624 624 GLU C C 624 177.204 177.204 178.454 -1.250 18986 1106 1 3 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.447 -1.590 18986 1107 1 3 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.011 -2.044 18986 1108 1 3 . 1 1 624 624 GLU H H 624 8.143 8.143 8.374 -0.231 18986 1109 1 3 . 1 1 625 625 LYS N N 625 119.222 119.222 118.577 0.645 18986 1110 1 3 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.327 -0.470 18986 1111 1 3 . 1 1 625 625 LYS C C 625 175.480 175.480 178.626 -3.146 18986 1112 1 3 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.407 -0.920 18986 1113 1 3 . 1 1 625 625 LYS CB C 625 30.663 30.663 33.222 -2.559 18986 1114 1 3 . 1 1 625 625 LYS H H 625 7.772 7.772 7.859 -0.087 18986 1115 1 3 . 1 1 626 626 MET N N 626 117.883 117.883 120.083 -2.200 18986 1116 1 3 . 1 1 626 626 MET HA H 626 3.807 3.807 4.040 -0.233 18986 1117 1 3 . 1 1 626 626 MET C C 626 175.278 175.278 178.766 -3.488 18986 1118 1 3 . 1 1 626 626 MET CA C 626 57.782 57.782 59.424 -1.642 18986 1119 1 3 . 1 1 626 626 MET CB C 626 30.657 30.657 32.766 -2.109 18986 1120 1 3 . 1 1 626 626 MET H H 626 8.367 8.367 8.647 -0.280 18986 1121 1 3 . 1 1 627 627 MET N N 627 116.185 116.185 117.996 -1.811 18986 1122 1 3 . 1 1 627 627 MET HA H 627 4.152 4.152 4.226 -0.074 18986 1123 1 3 . 1 1 627 627 MET C C 627 176.393 176.393 178.289 -1.896 18986 1124 1 3 . 1 1 627 627 MET CA C 627 55.359 55.359 57.607 -2.248 18986 1125 1 3 . 1 1 627 627 MET CB C 627 28.803 28.803 31.287 -2.484 18986 1126 1 3 . 1 1 627 627 MET H H 627 8.197 8.197 8.640 -0.443 18986 1127 1 3 . 1 1 628 628 LYS N N 628 119.859 119.859 121.837 -1.978 18986 1128 1 3 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.260 -0.060 18986 1129 1 3 . 1 1 628 628 LYS C C 628 175.885 175.885 179.071 -3.186 18986 1130 1 3 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.502 -4.425 18986 1131 1 3 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.136 -3.604 18986 1132 1 3 . 1 1 628 628 LYS H H 628 7.700 7.700 7.687 0.013 18986 1133 1 3 . 1 1 629 629 ILE N N 629 119.001 119.001 119.557 -0.556 18986 1134 1 3 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.614 -0.066 18986 1135 1 3 . 1 1 629 629 ILE C C 629 174.891 174.891 177.943 -3.052 18986 1136 1 3 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.498 -3.233 18986 1137 1 3 . 1 1 629 629 ILE CB C 629 33.849 33.849 38.032 -4.183 18986 1138 1 3 . 1 1 629 629 ILE H H 629 7.970 7.970 8.134 -0.164 18986 1139 1 3 . 1 1 630 630 ILE N N 630 120.737 120.737 117.525 3.212 18986 1140 1 3 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.603 -0.136 18986 1141 1 3 . 1 1 630 630 ILE C C 630 173.875 173.875 177.747 -3.872 18986 1142 1 3 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.925 -2.171 18986 1143 1 3 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.898 -2.621 18986 1144 1 3 . 1 1 630 630 ILE H H 630 8.213 8.213 8.125 0.088 18986 1145 1 3 . 1 1 631 631 GLU N N 631 119.546 119.546 121.305 -1.759 18986 1146 1 3 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.989 0.076 18986 1147 1 3 . 1 1 631 631 GLU C C 631 177.300 177.300 179.409 -2.109 18986 1148 1 3 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.801 -2.821 18986 1149 1 3 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.496 -2.503 18986 1150 1 3 . 1 1 631 631 GLU H H 631 7.742 7.742 8.170 -0.428 18986 1151 1 3 . 1 1 632 632 ILE N N 632 121.547 121.547 121.918 -0.371 18986 1152 1 3 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.729 -0.046 18986 1153 1 3 . 1 1 632 632 ILE C C 632 175.454 175.454 178.385 -2.931 18986 1154 1 3 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.856 -3.200 18986 1155 1 3 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.985 -2.155 18986 1156 1 3 . 1 1 632 632 ILE H H 632 8.013 8.013 8.450 -0.437 18986 1157 1 3 . 1 1 633 633 ILE N N 633 121.605 121.605 120.377 1.228 18986 1158 1 3 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.577 -0.242 18986 1159 1 3 . 1 1 633 633 ILE C C 633 174.558 174.558 178.229 -3.671 18986 1160 1 3 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.779 -1.860 18986 1161 1 3 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.258 -1.974 18986 1162 1 3 . 1 1 633 633 ILE H H 633 8.594 8.594 8.499 0.095 18986 1163 1 3 . 1 1 634 634 ASP N N 634 118.706 118.706 119.195 -0.489 18986 1164 1 3 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.527 -0.092 18986 1165 1 3 . 1 1 634 634 ASP C C 634 176.574 176.574 178.349 -1.775 18986 1166 1 3 . 1 1 634 634 ASP CA C 634 54.571 54.571 56.569 -1.998 18986 1167 1 3 . 1 1 634 634 ASP CB C 634 37.914 37.914 41.100 -3.186 18986 1168 1 3 . 1 1 634 634 ASP H H 634 8.724 8.724 8.210 0.514 18986 1169 1 3 . 1 1 635 635 SER N N 635 114.064 114.064 115.904 -1.840 18986 1170 1 3 . 1 1 635 635 SER HA H 635 4.232 4.232 4.277 -0.045 18986 1171 1 3 . 1 1 635 635 SER C C 635 174.487 174.487 177.193 -2.706 18986 1172 1 3 . 1 1 635 635 SER CA C 635 58.540 58.540 61.483 -2.943 18986 1173 1 3 . 1 1 635 635 SER CB C 635 60.319 60.319 63.700 -3.381 18986 1174 1 3 . 1 1 635 635 SER H H 635 7.992 7.992 8.182 -0.190 18986 1175 1 3 . 1 1 636 636 LEU N N 636 122.493 122.493 124.267 -1.774 18986 1176 1 3 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.063 0.191 18986 1177 1 3 . 1 1 636 636 LEU C C 636 176.194 176.194 178.723 -2.529 18986 1178 1 3 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.890 -3.795 18986 1179 1 3 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.540 -1.834 18986 1180 1 3 . 1 1 636 636 LEU H H 636 8.169 8.169 8.675 -0.506 18986 1181 1 3 . 1 1 637 637 ALA N N 637 121.891 121.891 118.718 3.173 18986 1182 1 3 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.439 -0.350 18986 1183 1 3 . 1 1 637 637 ALA C C 637 175.131 175.131 178.185 -3.054 18986 1184 1 3 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.066 -2.730 18986 1185 1 3 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.311 -2.823 18986 1186 1 3 . 1 1 637 637 ALA H H 637 8.482 8.482 8.017 0.465 18986 1187 1 3 . 1 1 638 638 VAL N N 638 117.140 117.140 117.634 -0.494 18986 1188 1 3 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.938 -0.003 18986 1189 1 3 . 1 1 638 638 VAL C C 638 174.712 174.712 176.250 -1.538 18986 1190 1 3 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.199 -2.198 18986 1191 1 3 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.891 -2.540 18986 1192 1 3 . 1 1 638 638 VAL H H 638 7.291 7.291 7.573 -0.282 18986 1193 1 3 . 1 1 639 639 SER N N 639 114.143 114.143 113.785 0.358 18986 1194 1 3 . 1 1 639 639 SER HA H 639 4.481 4.481 4.547 -0.066 18986 1195 1 3 . 1 1 639 639 SER C C 639 172.122 172.122 175.468 -3.346 18986 1196 1 3 . 1 1 639 639 SER CA C 639 56.002 56.002 58.611 -2.609 18986 1197 1 3 . 1 1 639 639 SER CB C 639 60.921 60.921 64.924 -4.003 18986 1198 1 3 . 1 1 639 639 SER H H 639 7.918 7.918 7.697 0.221 18986 1199 1 3 . 1 1 640 640 SER N N 640 115.370 115.370 120.068 -4.698 18986 1200 1 3 . 1 1 640 640 SER HA H 640 4.711 4.711 4.485 0.226 18986 1201 1 3 . 1 1 640 640 SER C C 640 171.185 171.185 175.640 -4.455 18986 1202 1 3 . 1 1 640 640 SER CA C 640 55.009 55.009 58.578 -3.569 18986 1203 1 3 . 1 1 640 640 SER CB C 640 61.974 61.974 63.976 -2.002 18986 1204 1 3 . 1 1 640 640 SER H H 640 7.765 7.765 7.732 0.033 18986 1205 1 3 . 1 1 641 641 GLU N N 641 119.994 119.994 121.017 -1.023 18986 1206 1 3 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.143 -0.099 18986 1207 1 3 . 1 1 641 641 GLU C C 641 173.167 173.167 175.682 -2.515 18986 1208 1 3 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.746 -2.095 18986 1209 1 3 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.858 -2.373 18986 1210 1 3 . 1 1 641 641 GLU H H 641 8.363 8.363 9.042 -0.679 18986 1211 1 3 . 1 1 642 642 CYS N N 642 110.257 110.257 112.150 -1.893 18986 1212 1 3 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.613 -0.154 18986 1213 1 3 . 1 1 642 642 CYS C C 642 168.058 168.058 173.172 -5.114 18986 1214 1 3 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.355 -4.409 18986 1215 1 3 . 1 1 642 642 CYS CB C 642 41.361 41.361 30.992 10.369 18986 1216 1 3 . 1 1 642 642 CYS H H 642 7.881 7.881 7.268 0.613 18986 1217 1 3 . 1 1 643 643 ALA N N 643 123.922 123.922 122.226 1.696 18986 1218 1 3 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.453 0.185 18986 1219 1 3 . 1 1 643 643 ALA C C 643 172.517 172.517 176.533 -4.016 18986 1220 1 3 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.770 -4.149 18986 1221 1 3 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.237 -0.793 18986 1222 1 3 . 1 1 643 643 ALA H H 643 9.787 9.787 8.857 0.930 18986 1223 1 3 . 1 1 644 644 LYS N N 644 128.479 128.479 118.795 9.684 18986 1224 1 3 . 1 1 644 644 LYS HA H 644 4.511 4.511 5.093 -0.582 18986 1225 1 3 . 1 1 644 644 LYS C C 644 176.945 176.945 177.513 -0.568 18986 1226 1 3 . 1 1 644 644 LYS CA C 644 54.338 54.338 54.649 -0.311 18986 1227 1 3 . 1 1 644 644 LYS CB C 644 29.942 29.942 34.027 -4.085 18986 1228 1 3 . 1 1 644 644 LYS H H 644 9.809 9.809 8.919 0.890 18986 1229 1 3 . 1 1 645 645 VAL N N 645 124.257 124.257 124.652 -0.395 18986 1230 1 3 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.677 -0.029 18986 1231 1 3 . 1 1 645 645 VAL C C 645 173.996 173.996 176.749 -2.753 18986 1232 1 3 . 1 1 645 645 VAL CA C 645 64.862 64.862 64.822 0.040 18986 1233 1 3 . 1 1 645 645 VAL CB C 645 29.201 29.201 32.195 -2.994 18986 1234 1 3 . 1 1 645 645 VAL H H 645 8.458 8.458 8.985 -0.527 18986 1235 1 3 . 1 1 646 646 LYS N N 646 117.598 117.598 120.101 -2.503 18986 1236 1 3 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.909 0.098 18986 1237 1 3 . 1 1 646 646 LYS C C 646 176.047 176.047 178.560 -2.513 18986 1238 1 3 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.472 -3.227 18986 1239 1 3 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.860 -2.462 18986 1240 1 3 . 1 1 646 646 LYS H H 646 8.706 8.706 9.041 -0.335 18986 1241 1 3 . 1 1 647 647 ASP N N 647 119.229 119.229 120.193 -0.964 18986 1242 1 3 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.425 0.193 18986 1243 1 3 . 1 1 647 647 ASP C C 647 175.211 175.211 178.674 -3.463 18986 1244 1 3 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.225 -2.902 18986 1245 1 3 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.557 -1.819 18986 1246 1 3 . 1 1 647 647 ASP H H 647 7.012 7.012 7.816 -0.804 18986 1247 1 3 . 1 1 648 648 ILE N N 648 121.939 121.939 120.146 1.793 18986 1248 1 3 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.774 -0.393 18986 1249 1 3 . 1 1 648 648 ILE C C 648 175.243 175.243 178.031 -2.788 18986 1250 1 3 . 1 1 648 648 ILE CA C 648 63.041 63.041 64.657 -1.616 18986 1251 1 3 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.930 -1.968 18986 1252 1 3 . 1 1 648 648 ILE H H 648 8.152 8.152 7.666 0.486 18986 1253 1 3 . 1 1 649 649 LEU N N 649 117.310 117.310 121.493 -4.183 18986 1254 1 3 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.765 0.108 18986 1255 1 3 . 1 1 649 649 LEU C C 649 176.439 176.439 178.827 -2.388 18986 1256 1 3 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.844 -2.959 18986 1257 1 3 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.315 -2.009 18986 1258 1 3 . 1 1 649 649 LEU H H 649 8.638 8.638 8.702 -0.064 18986 1259 1 3 . 1 1 650 650 LYS N N 650 118.810 118.810 118.997 -0.187 18986 1260 1 3 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.873 0.173 18986 1261 1 3 . 1 1 650 650 LYS C C 650 176.801 176.801 179.116 -2.315 18986 1262 1 3 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.960 -2.909 18986 1263 1 3 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.061 -1.997 18986 1264 1 3 . 1 1 650 650 LYS H H 650 7.296 7.296 7.911 -0.615 18986 1265 1 3 . 1 1 651 651 GLU N N 651 117.713 117.713 119.083 -1.370 18986 1266 1 3 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.049 0.059 18986 1267 1 3 . 1 1 651 651 GLU C C 651 176.903 176.903 178.993 -2.090 18986 1268 1 3 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.468 -3.658 18986 1269 1 3 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.652 -2.204 18986 1270 1 3 . 1 1 651 651 GLU H H 651 8.036 8.036 7.954 0.082 18986 1271 1 3 . 1 1 652 652 ALA N N 652 121.206 121.206 121.288 -0.082 18986 1272 1 3 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.106 -0.108 18986 1273 1 3 . 1 1 652 652 ALA C C 652 176.766 176.766 180.012 -3.246 18986 1274 1 3 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.103 -3.369 18986 1275 1 3 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.297 -2.981 18986 1276 1 3 . 1 1 652 652 ALA H H 652 8.973 8.973 8.464 0.509 18986 1277 1 3 . 1 1 653 653 GLN N N 653 117.768 117.768 118.410 -0.642 18986 1278 1 3 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.330 0.147 18986 1279 1 3 . 1 1 653 653 GLN C C 653 177.388 177.388 178.878 -1.490 18986 1280 1 3 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.766 -2.706 18986 1281 1 3 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.989 -2.220 18986 1282 1 3 . 1 1 653 653 GLN H H 653 8.059 8.059 8.483 -0.424 18986 1283 1 3 . 1 1 654 654 GLN N N 654 117.979 117.979 118.663 -0.684 18986 1284 1 3 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.070 0.107 18986 1285 1 3 . 1 1 654 654 GLN C C 654 174.834 174.834 178.238 -3.404 18986 1286 1 3 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.401 -2.983 18986 1287 1 3 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.334 -2.357 18986 1288 1 3 . 1 1 654 654 GLN H H 654 7.495 7.495 7.996 -0.501 18986 1289 1 3 . 1 1 655 655 VAL N N 655 110.080 110.080 116.517 -6.437 18986 1290 1 3 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.852 0.675 18986 1291 1 3 . 1 1 655 655 VAL C C 655 173.369 173.369 176.558 -3.189 18986 1292 1 3 . 1 1 655 655 VAL CA C 655 58.067 58.067 63.513 -5.446 18986 1293 1 3 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.056 -3.873 18986 1294 1 3 . 1 1 655 655 VAL H H 655 7.197 7.197 7.909 -0.712 18986 1295 1 3 . 1 1 656 656 GLY N N 656 107.089 107.089 106.590 0.499 18986 1296 1 3 . 1 1 656 656 GLY C C 656 171.639 171.639 174.652 -3.013 18986 1297 1 3 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.441 -1.130 18986 1298 1 3 . 1 1 656 656 GLY H H 656 7.541 7.541 7.673 -0.132 18986 1299 1 3 . 1 1 657 657 ILE N N 657 121.266 121.266 121.240 0.026 18986 1300 1 3 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.109 0.025 18986 1301 1 3 . 1 1 657 657 ILE C C 657 171.885 171.885 175.178 -3.293 18986 1302 1 3 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.543 -3.313 18986 1303 1 3 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.046 -3.855 18986 1304 1 3 . 1 1 657 657 ILE H H 657 7.633 7.633 8.348 -0.715 18986 1305 1 3 . 1 1 658 658 GLU N N 658 127.252 127.252 124.144 3.108 18986 1306 1 3 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.421 -0.218 18986 1307 1 3 . 1 1 658 658 GLU C C 658 175.316 175.316 176.982 -1.666 18986 1308 1 3 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.703 -1.343 18986 1309 1 3 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.072 -3.462 18986 1310 1 3 . 1 1 658 658 GLU H H 658 8.690 8.690 8.533 0.157 18986 1311 1 3 . 1 1 659 659 LYS N N 659 124.533 124.533 126.737 -2.204 18986 1312 1 3 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.885 -0.097 18986 1313 1 3 . 1 1 659 659 LYS C C 659 175.170 175.170 177.871 -2.701 18986 1314 1 3 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.898 -1.727 18986 1315 1 3 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.651 -1.534 18986 1316 1 3 . 1 1 659 659 LYS H H 659 8.706 8.706 8.720 -0.014 18986 1317 1 3 . 1 1 660 660 SER N N 660 113.137 113.137 115.221 -2.084 18986 1318 1 3 . 1 1 660 660 SER HA H 660 4.273 4.273 4.332 -0.059 18986 1319 1 3 . 1 1 660 660 SER C C 660 173.939 173.939 176.396 -2.457 18986 1320 1 3 . 1 1 660 660 SER CA C 660 58.350 58.350 61.082 -2.732 18986 1321 1 3 . 1 1 660 660 SER CB C 660 59.504 59.504 62.759 -3.255 18986 1322 1 3 . 1 1 660 660 SER H H 660 8.777 8.777 8.405 0.372 18986 1323 1 3 . 1 1 661 661 ASN N N 661 119.986 119.986 119.188 0.798 18986 1324 1 3 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.659 0.047 18986 1325 1 3 . 1 1 661 661 ASN C C 661 174.516 174.516 176.856 -2.340 18986 1326 1 3 . 1 1 661 661 ASN CA C 661 52.048 52.048 55.231 -3.183 18986 1327 1 3 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.655 -1.912 18986 1328 1 3 . 1 1 661 661 ASN H H 661 7.486 7.486 8.178 -0.692 18986 1329 1 3 . 1 1 662 662 ILE N N 662 120.639 120.639 121.565 -0.926 18986 1330 1 3 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.801 -0.355 18986 1331 1 3 . 1 1 662 662 ILE C C 662 174.252 174.252 177.107 -2.855 18986 1332 1 3 . 1 1 662 662 ILE CA C 662 62.606 62.606 64.802 -2.196 18986 1333 1 3 . 1 1 662 662 ILE CB C 662 34.423 34.423 38.224 -3.801 18986 1334 1 3 . 1 1 662 662 ILE H H 662 7.999 7.999 8.195 -0.196 18986 1335 1 3 . 1 1 663 663 GLU N N 663 117.706 117.706 121.299 -3.593 18986 1336 1 3 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.881 -0.091 18986 1337 1 3 . 1 1 663 663 GLU C C 663 176.509 176.509 178.843 -2.334 18986 1338 1 3 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.025 -2.317 18986 1339 1 3 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.303 -2.548 18986 1340 1 3 . 1 1 663 663 GLU H H 663 8.190 8.190 8.216 -0.026 18986 1341 1 3 . 1 1 664 664 LYS N N 664 119.586 119.586 120.163 -0.577 18986 1342 1 3 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.007 0.046 18986 1343 1 3 . 1 1 664 664 LYS C C 664 175.941 175.941 178.618 -2.677 18986 1344 1 3 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.623 -3.042 18986 1345 1 3 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.238 -2.415 18986 1346 1 3 . 1 1 664 664 LYS H H 664 7.590 7.590 8.232 -0.642 18986 1347 1 3 . 1 1 665 665 LEU N N 665 119.756 119.756 119.789 -0.033 18986 1348 1 3 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.019 0.061 18986 1349 1 3 . 1 1 665 665 LEU C C 665 176.700 176.700 179.431 -2.731 18986 1350 1 3 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.019 -2.634 18986 1351 1 3 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.110 -1.918 18986 1352 1 3 . 1 1 665 665 LEU H H 665 8.075 8.075 8.027 0.048 18986 1353 1 3 . 1 1 666 666 LEU N N 666 118.788 118.788 118.538 0.250 18986 1354 1 3 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.554 0.210 18986 1355 1 3 . 1 1 666 666 LEU C C 666 176.484 176.484 178.894 -2.410 18986 1356 1 3 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.119 -2.461 18986 1357 1 3 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.869 -2.258 18986 1358 1 3 . 1 1 666 666 LEU H H 666 8.550 8.550 8.490 0.060 18986 1359 1 3 . 1 1 667 667 THR N N 667 115.244 115.244 116.477 -1.233 18986 1360 1 3 . 1 1 667 667 THR HA H 667 3.839 3.839 4.134 -0.295 18986 1361 1 3 . 1 1 667 667 THR C C 667 173.740 173.740 176.818 -3.078 18986 1362 1 3 . 1 1 667 667 THR CA C 667 64.378 64.378 67.179 -2.801 18986 1363 1 3 . 1 1 667 667 THR CB C 667 65.748 65.748 68.280 -2.532 18986 1364 1 3 . 1 1 667 667 THR H H 667 7.662 7.662 8.037 -0.375 18986 1365 1 3 . 1 1 668 668 ASP N N 668 122.862 122.862 122.298 0.564 18986 1366 1 3 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.408 -0.025 18986 1367 1 3 . 1 1 668 668 ASP C C 668 177.192 177.192 178.629 -1.437 18986 1368 1 3 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.488 -2.357 18986 1369 1 3 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.284 -2.398 18986 1370 1 3 . 1 1 668 668 ASP H H 668 8.291 8.291 8.723 -0.432 18986 1371 1 3 . 1 1 669 669 MET N N 669 119.640 119.640 118.786 0.854 18986 1372 1 3 . 1 1 669 669 MET HA H 669 3.917 3.917 4.182 -0.265 18986 1373 1 3 . 1 1 669 669 MET C C 669 175.414 175.414 178.062 -2.648 18986 1374 1 3 . 1 1 669 669 MET CA C 669 57.234 57.234 58.351 -1.117 18986 1375 1 3 . 1 1 669 669 MET CB C 669 32.088 32.088 31.904 0.184 18986 1376 1 3 . 1 1 669 669 MET H H 669 8.809 8.809 8.645 0.164 18986 1377 1 3 . 1 1 670 670 ARG N N 670 122.614 122.614 121.010 1.604 18986 1378 1 3 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.362 0.155 18986 1379 1 3 . 1 1 670 670 ARG C C 670 177.928 177.928 178.969 -1.041 18986 1380 1 3 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.866 -2.644 18986 1381 1 3 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.868 -2.564 18986 1382 1 3 . 1 1 670 670 ARG H H 670 8.450 8.450 8.387 0.063 18986 1383 1 3 . 1 1 671 671 LYS N N 671 121.976 121.976 119.060 2.916 18986 1384 1 3 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.232 -0.119 18986 1385 1 3 . 1 1 671 671 LYS C C 671 176.143 176.143 178.692 -2.549 18986 1386 1 3 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.830 -1.744 18986 1387 1 3 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.452 -2.948 18986 1388 1 3 . 1 1 671 671 LYS H H 671 8.609 8.609 8.551 0.058 18986 1389 1 3 . 1 1 672 672 SER N N 672 111.655 111.655 113.206 -1.551 18986 1390 1 3 . 1 1 672 672 SER HA H 672 4.469 4.469 4.377 0.092 18986 1391 1 3 . 1 1 672 672 SER C C 672 171.692 171.692 175.369 -3.677 18986 1392 1 3 . 1 1 672 672 SER CA C 672 56.790 56.790 60.097 -3.307 18986 1393 1 3 . 1 1 672 672 SER CB C 672 61.343 61.343 64.029 -2.686 18986 1394 1 3 . 1 1 672 672 SER H H 672 7.884 7.884 8.017 -0.133 18986 1395 1 3 . 1 1 673 673 GLY N N 673 108.029 108.029 107.365 0.664 18986 1396 1 3 . 1 1 673 673 GLY C C 673 171.492 171.492 175.000 -3.508 18986 1397 1 3 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.422 -2.147 18986 1398 1 3 . 1 1 673 673 GLY H H 673 7.774 7.774 8.164 -0.390 18986 1399 1 3 . 1 1 674 674 ILE N N 674 116.193 116.193 119.584 -3.391 18986 1400 1 3 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.040 0.061 18986 1401 1 3 . 1 1 674 674 ILE C C 674 173.980 173.980 175.824 -1.844 18986 1402 1 3 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.332 -3.090 18986 1403 1 3 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.773 -1.970 18986 1404 1 3 . 1 1 674 674 ILE H H 674 8.026 8.026 8.253 -0.227 18986 1405 1 3 . 1 1 675 675 ILE N N 675 108.928 108.928 114.019 -5.091 18986 1406 1 3 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.495 0.863 18986 1407 1 3 . 1 1 675 675 ILE C C 675 170.797 170.797 174.134 -3.337 18986 1408 1 3 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.724 -2.700 18986 1409 1 3 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.534 -2.048 18986 1410 1 3 . 1 1 675 675 ILE H H 675 7.120 7.120 7.419 -0.299 18986 1411 1 3 . 1 1 676 676 TYR N N 676 118.062 118.062 115.784 2.278 18986 1412 1 3 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.156 -0.161 18986 1413 1 3 . 1 1 676 676 TYR C C 676 170.020 170.020 174.909 -4.889 18986 1414 1 3 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.234 -2.341 18986 1415 1 3 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.259 -1.743 18986 1416 1 3 . 1 1 676 676 TYR H H 676 9.380 9.380 8.594 0.786 18986 1417 1 3 . 1 1 677 677 GLU N N 677 123.578 123.578 121.310 2.268 18986 1418 1 3 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.585 0.241 18986 1419 1 3 . 1 1 677 677 GLU C C 677 172.146 172.146 175.890 -3.744 18986 1420 1 3 . 1 1 677 677 GLU CA C 677 52.476 52.476 58.473 -5.997 18986 1421 1 3 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.809 -3.197 18986 1422 1 3 . 1 1 677 677 GLU H H 677 8.951 8.951 8.775 0.176 18986 1423 1 3 . 1 1 678 678 ALA N N 678 133.220 133.220 126.976 6.244 18986 1424 1 3 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.500 -0.459 18986 1425 1 3 . 1 1 678 678 ALA C C 678 175.219 175.219 176.746 -1.527 18986 1426 1 3 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.233 -1.632 18986 1427 1 3 . 1 1 678 678 ALA CB C 678 16.599 16.599 20.911 -4.312 18986 1428 1 3 . 1 1 678 678 ALA H H 678 7.912 7.912 8.673 -0.761 18986 1429 1 3 . 1 1 679 679 LYS N N 679 115.687 115.687 117.115 -1.428 18986 1430 1 3 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.725 -0.290 18986 1431 1 3 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.855 -1.839 18986 1432 1 3 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.703 -2.708 18986 1433 1 3 . 1 1 679 679 LYS H H 679 8.215 8.215 7.454 0.761 18986 1434 1 3 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.299 -0.280 18986 1435 1 3 . 1 1 680 680 PRO C C 680 174.504 174.504 177.488 -2.984 18986 1436 1 3 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.982 -1.464 18986 1437 1 3 . 1 1 680 680 PRO CB C 680 28.315 28.315 32.040 -3.725 18986 1438 1 3 . 1 1 681 681 GLU N N 681 118.851 118.851 118.021 0.830 18986 1439 1 3 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.038 -0.600 18986 1440 1 3 . 1 1 681 681 GLU C C 681 172.890 172.890 174.613 -1.723 18986 1441 1 3 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.125 -3.644 18986 1442 1 3 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.399 -4.610 18986 1443 1 3 . 1 1 681 681 GLU H H 681 10.003 10.003 9.052 0.951 18986 1444 1 3 . 1 1 682 682 CYS N N 682 120.934 120.934 116.188 4.746 18986 1445 1 3 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.393 -0.366 18986 1446 1 3 . 1 1 682 682 CYS C C 682 171.905 171.905 173.743 -1.838 18986 1447 1 3 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.902 -3.658 18986 1448 1 3 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.163 14.132 18986 1449 1 3 . 1 1 682 682 CYS H H 682 7.860 7.860 7.897 -0.037 18986 1450 1 3 . 1 1 683 683 TYR N N 683 126.183 126.183 121.133 5.050 18986 1451 1 3 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.364 -0.140 18986 1452 1 3 . 1 1 683 683 TYR C C 683 173.008 173.008 174.115 -1.107 18986 1453 1 3 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.042 -0.474 18986 1454 1 3 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.382 -2.430 18986 1455 1 3 . 1 1 683 683 TYR H H 683 9.297 9.297 9.430 -0.133 18986 1456 1 3 . 1 1 684 684 LYS N N 684 118.604 118.604 119.571 -0.967 18986 1457 1 3 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.814 -0.377 18986 1458 1 3 . 1 1 684 684 LYS C C 684 171.628 171.628 174.557 -2.929 18986 1459 1 3 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.997 -1.694 18986 1460 1 3 . 1 1 684 684 LYS CB C 684 34.677 34.677 37.128 -2.451 18986 1461 1 3 . 1 1 684 684 LYS H H 684 8.630 8.630 9.257 -0.627 18986 1462 1 3 . 1 1 685 685 LYS N N 685 122.869 122.869 124.908 -2.039 18986 1463 1 3 . 1 1 685 685 LYS HA H 685 4.644 4.644 3.976 0.668 18986 1464 1 3 . 1 1 685 685 LYS C C 685 173.337 173.337 175.722 -2.385 18986 1465 1 3 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.493 -2.240 18986 1466 1 3 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.615 -1.688 18986 1467 1 3 . 1 1 685 685 LYS H H 685 8.969 8.969 8.660 0.309 18986 1468 1 4 . 1 1 601 601 SER HA H 601 4.475 4.475 4.179 0.296 18986 1469 1 4 . 1 1 601 601 SER CA C 601 55.508 55.508 59.569 -4.061 18986 1470 1 4 . 1 1 601 601 SER CB C 601 61.220 61.220 62.490 -1.270 18986 1471 1 4 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.616 -0.000 18986 1472 1 4 . 1 1 602 602 HIS C C 602 172.320 172.320 175.863 -3.543 18986 1473 1 4 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.327 -1.473 18986 1474 1 4 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.041 -1.958 18986 1475 1 4 . 1 1 603 603 MET N N 603 121.862 121.862 119.382 2.480 18986 1476 1 4 . 1 1 603 603 MET HA H 603 4.425 4.425 4.421 0.004 18986 1477 1 4 . 1 1 603 603 MET C C 603 173.948 173.948 176.824 -2.876 18986 1478 1 4 . 1 1 603 603 MET CA C 603 53.108 53.108 56.661 -3.553 18986 1479 1 4 . 1 1 603 603 MET CB C 603 30.049 30.049 32.843 -2.794 18986 1480 1 4 . 1 1 603 603 MET H H 603 8.394 8.394 8.773 -0.379 18986 1481 1 4 . 1 1 604 604 GLY N N 604 110.382 110.382 106.522 3.860 18986 1482 1 4 . 1 1 604 604 GLY C C 604 171.590 171.590 172.647 -1.057 18986 1483 1 4 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.359 -1.742 18986 1484 1 4 . 1 1 604 604 GLY H H 604 8.411 8.411 7.626 0.785 18986 1485 1 4 . 1 1 605 605 GLU N N 605 120.709 120.709 119.042 1.667 18986 1486 1 4 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.753 -0.446 18986 1487 1 4 . 1 1 605 605 GLU C C 605 174.220 174.220 176.723 -2.503 18986 1488 1 4 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.304 -1.339 18986 1489 1 4 . 1 1 605 605 GLU CB C 605 27.611 27.611 32.004 -4.393 18986 1490 1 4 . 1 1 605 605 GLU H H 605 8.282 8.282 8.586 -0.304 18986 1491 1 4 . 1 1 606 606 SER N N 606 116.679 116.679 117.463 -0.784 18986 1492 1 4 . 1 1 606 606 SER HA H 606 4.405 4.405 4.337 0.068 18986 1493 1 4 . 1 1 606 606 SER C C 606 172.455 172.455 175.051 -2.596 18986 1494 1 4 . 1 1 606 606 SER CA C 606 56.028 56.028 59.012 -2.984 18986 1495 1 4 . 1 1 606 606 SER CB C 606 61.039 61.039 63.544 -2.505 18986 1496 1 4 . 1 1 606 606 SER H H 606 8.420 8.420 8.591 -0.171 18986 1497 1 4 . 1 1 607 607 GLY N N 607 110.716 110.716 110.100 0.616 18986 1498 1 4 . 1 1 607 607 GLY C C 607 171.173 171.173 173.977 -2.804 18986 1499 1 4 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.767 -2.126 18986 1500 1 4 . 1 1 607 607 GLY H H 607 8.386 8.386 8.411 -0.025 18986 1501 1 4 . 1 1 608 608 LYS N N 608 120.785 120.785 119.302 1.483 18986 1502 1 4 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.513 -0.174 18986 1503 1 4 . 1 1 608 608 LYS C C 608 173.673 173.673 176.195 -2.522 18986 1504 1 4 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.754 -2.389 18986 1505 1 4 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.446 -2.915 18986 1506 1 4 . 1 1 608 608 LYS H H 608 8.008 8.008 8.338 -0.330 18986 1507 1 4 . 1 1 609 609 ILE N N 609 122.404 122.404 121.754 0.650 18986 1508 1 4 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.267 -0.118 18986 1509 1 4 . 1 1 609 609 ILE C C 609 172.675 172.675 175.265 -2.590 18986 1510 1 4 . 1 1 609 609 ILE CA C 609 58.003 58.003 59.368 -1.365 18986 1511 1 4 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.271 -2.067 18986 1512 1 4 . 1 1 609 609 ILE H H 609 8.186 8.186 7.862 0.324 18986 1513 1 4 . 1 1 610 610 ASP N N 610 125.357 125.357 124.325 1.032 18986 1514 1 4 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.809 -0.106 18986 1515 1 4 . 1 1 610 610 ASP C C 610 173.668 173.668 175.332 -1.664 18986 1516 1 4 . 1 1 610 610 ASP CA C 610 50.702 50.702 52.922 -2.220 18986 1517 1 4 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.574 -3.884 18986 1518 1 4 . 1 1 610 610 ASP H H 610 8.369 8.369 8.089 0.280 18986 1519 1 4 . 1 1 611 611 ILE N N 611 122.494 122.494 118.267 4.227 18986 1520 1 4 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.129 -0.220 18986 1521 1 4 . 1 1 611 611 ILE C C 611 173.618 173.618 177.294 -3.676 18986 1522 1 4 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.216 -3.176 18986 1523 1 4 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.711 -2.913 18986 1524 1 4 . 1 1 611 611 ILE H H 611 8.284 8.284 8.124 0.160 18986 1525 1 4 . 1 1 612 612 ASP N N 612 121.440 121.440 121.416 0.024 18986 1526 1 4 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.405 0.029 18986 1527 1 4 . 1 1 612 612 ASP C C 612 175.129 175.129 178.542 -3.413 18986 1528 1 4 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.303 -4.537 18986 1529 1 4 . 1 1 612 612 ASP CB C 612 38.138 38.138 40.564 -2.426 18986 1530 1 4 . 1 1 612 612 ASP H H 612 8.279 8.279 8.352 -0.073 18986 1531 1 4 . 1 1 613 613 THR N N 613 114.422 114.422 114.691 -0.269 18986 1532 1 4 . 1 1 613 613 THR HA H 613 4.106 4.106 4.000 0.106 18986 1533 1 4 . 1 1 613 613 THR C C 613 173.338 173.338 175.473 -2.135 18986 1534 1 4 . 1 1 613 613 THR CA C 613 61.545 61.545 65.577 -4.032 18986 1535 1 4 . 1 1 613 613 THR CB C 613 66.267 66.267 68.900 -2.632 18986 1536 1 4 . 1 1 613 613 THR H H 613 7.866 7.866 8.894 -1.028 18986 1537 1 4 . 1 1 614 614 ILE N N 614 121.654 121.654 118.866 2.788 18986 1538 1 4 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.006 0.023 18986 1539 1 4 . 1 1 614 614 ILE C C 614 174.471 174.471 177.718 -3.247 18986 1540 1 4 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.804 -3.631 18986 1541 1 4 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.805 -2.990 18986 1542 1 4 . 1 1 614 614 ILE H H 614 7.819 7.819 7.388 0.431 18986 1543 1 4 . 1 1 615 615 MET N N 615 119.713 119.713 118.614 1.099 18986 1544 1 4 . 1 1 615 615 MET HA H 615 4.478 4.478 4.654 -0.176 18986 1545 1 4 . 1 1 615 615 MET C C 615 174.075 174.075 177.673 -3.598 18986 1546 1 4 . 1 1 615 615 MET CA C 615 52.764 52.764 57.132 -4.368 18986 1547 1 4 . 1 1 615 615 MET CB C 615 29.337 29.337 31.900 -2.563 18986 1548 1 4 . 1 1 615 615 MET H H 615 8.188 8.188 8.441 -0.253 18986 1549 1 4 . 1 1 616 616 THR N N 616 114.770 114.770 113.927 0.843 18986 1550 1 4 . 1 1 616 616 THR HA H 616 4.099 4.099 4.156 -0.057 18986 1551 1 4 . 1 1 616 616 THR C C 616 172.535 172.535 175.904 -3.369 18986 1552 1 4 . 1 1 616 616 THR CA C 616 61.112 61.112 63.779 -2.667 18986 1553 1 4 . 1 1 616 616 THR CB C 616 66.617 66.617 69.180 -2.563 18986 1554 1 4 . 1 1 616 616 THR H H 616 7.722 7.722 8.268 -0.546 18986 1555 1 4 . 1 1 617 617 GLY N N 617 111.384 111.384 106.875 4.509 18986 1556 1 4 . 1 1 617 617 GLY C C 617 171.437 171.437 173.481 -2.044 18986 1557 1 4 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.118 -2.676 18986 1558 1 4 . 1 1 617 617 GLY H H 617 8.431 8.431 7.882 0.549 18986 1559 1 4 . 1 1 618 618 LYS N N 618 120.996 120.996 120.590 0.406 18986 1560 1 4 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.830 -0.163 18986 1561 1 4 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.950 -2.122 18986 1562 1 4 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.432 -4.955 18986 1563 1 4 . 1 1 618 618 LYS H H 618 7.821 7.821 7.917 -0.096 18986 1564 1 4 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.561 -0.092 18986 1565 1 4 . 1 1 619 619 PRO C C 619 174.453 174.453 178.233 -3.780 18986 1566 1 4 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.355 -2.163 18986 1567 1 4 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.900 -3.320 18986 1568 1 4 . 1 1 620 620 LYS N N 620 123.464 123.464 121.474 1.990 18986 1569 1 4 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.914 0.132 18986 1570 1 4 . 1 1 620 620 LYS C C 620 174.895 174.895 178.588 -3.693 18986 1571 1 4 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.310 -4.021 18986 1572 1 4 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.767 -1.313 18986 1573 1 4 . 1 1 620 620 LYS H H 620 8.728 8.728 8.743 -0.015 18986 1574 1 4 . 1 1 621 621 SER N N 621 113.921 113.921 114.293 -0.372 18986 1575 1 4 . 1 1 621 621 SER HA H 621 4.336 4.336 4.363 -0.027 18986 1576 1 4 . 1 1 621 621 SER C C 621 173.149 173.149 176.113 -2.964 18986 1577 1 4 . 1 1 621 621 SER CA C 621 56.691 56.691 60.997 -4.306 18986 1578 1 4 . 1 1 621 621 SER CB C 621 60.689 60.689 62.576 -1.887 18986 1579 1 4 . 1 1 621 621 SER H H 621 8.531 8.531 8.265 0.266 18986 1580 1 4 . 1 1 622 622 ALA N N 622 124.177 124.177 123.922 0.255 18986 1581 1 4 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.983 0.185 18986 1582 1 4 . 1 1 622 622 ALA C C 622 176.804 176.804 178.867 -2.063 18986 1583 1 4 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.488 -3.120 18986 1584 1 4 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.167 -2.313 18986 1585 1 4 . 1 1 622 622 ALA H H 622 7.835 7.835 8.300 -0.465 18986 1586 1 4 . 1 1 623 623 ARG N N 623 118.263 118.263 118.576 -0.313 18986 1587 1 4 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.940 0.010 18986 1588 1 4 . 1 1 623 623 ARG C C 623 175.683 175.683 178.315 -2.632 18986 1589 1 4 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.946 -1.783 18986 1590 1 4 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.400 -1.949 18986 1591 1 4 . 1 1 623 623 ARG H H 623 8.148 8.148 8.253 -0.105 18986 1592 1 4 . 1 1 624 624 GLU N N 624 117.953 117.953 120.746 -2.793 18986 1593 1 4 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.010 -0.042 18986 1594 1 4 . 1 1 624 624 GLU C C 624 177.204 177.204 178.935 -1.731 18986 1595 1 4 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.519 -2.662 18986 1596 1 4 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.484 -2.517 18986 1597 1 4 . 1 1 624 624 GLU H H 624 8.143 8.143 8.504 -0.361 18986 1598 1 4 . 1 1 625 625 LYS N N 625 119.222 119.222 117.907 1.315 18986 1599 1 4 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.230 -0.373 18986 1600 1 4 . 1 1 625 625 LYS C C 625 175.480 175.480 179.250 -3.770 18986 1601 1 4 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.614 -1.127 18986 1602 1 4 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.952 -2.289 18986 1603 1 4 . 1 1 625 625 LYS H H 625 7.772 7.772 7.838 -0.066 18986 1604 1 4 . 1 1 626 626 MET N N 626 117.883 117.883 120.229 -2.346 18986 1605 1 4 . 1 1 626 626 MET HA H 626 3.807 3.807 4.057 -0.250 18986 1606 1 4 . 1 1 626 626 MET C C 626 175.278 175.278 178.347 -3.069 18986 1607 1 4 . 1 1 626 626 MET CA C 626 57.782 57.782 59.767 -1.985 18986 1608 1 4 . 1 1 626 626 MET CB C 626 30.657 30.657 32.802 -2.145 18986 1609 1 4 . 1 1 626 626 MET H H 626 8.367 8.367 8.695 -0.328 18986 1610 1 4 . 1 1 627 627 MET N N 627 116.185 116.185 117.246 -1.061 18986 1611 1 4 . 1 1 627 627 MET HA H 627 4.152 4.152 4.160 -0.008 18986 1612 1 4 . 1 1 627 627 MET C C 627 176.393 176.393 178.420 -2.027 18986 1613 1 4 . 1 1 627 627 MET CA C 627 55.359 55.359 57.901 -2.542 18986 1614 1 4 . 1 1 627 627 MET CB C 627 28.803 28.803 31.185 -2.382 18986 1615 1 4 . 1 1 627 627 MET H H 627 8.197 8.197 8.544 -0.347 18986 1616 1 4 . 1 1 628 628 LYS N N 628 119.859 119.859 120.593 -0.734 18986 1617 1 4 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.284 -0.084 18986 1618 1 4 . 1 1 628 628 LYS C C 628 175.885 175.885 179.425 -3.540 18986 1619 1 4 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.379 -4.302 18986 1620 1 4 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.301 -3.770 18986 1621 1 4 . 1 1 628 628 LYS H H 628 7.700 7.700 7.471 0.229 18986 1622 1 4 . 1 1 629 629 ILE N N 629 119.001 119.001 120.306 -1.305 18986 1623 1 4 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.643 -0.095 18986 1624 1 4 . 1 1 629 629 ILE C C 629 174.891 174.891 177.952 -3.061 18986 1625 1 4 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.485 -3.220 18986 1626 1 4 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.985 -4.136 18986 1627 1 4 . 1 1 629 629 ILE H H 629 7.970 7.970 8.163 -0.193 18986 1628 1 4 . 1 1 630 630 ILE N N 630 120.737 120.737 117.828 2.909 18986 1629 1 4 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.624 -0.157 18986 1630 1 4 . 1 1 630 630 ILE C C 630 173.875 173.875 177.700 -3.825 18986 1631 1 4 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.885 -2.131 18986 1632 1 4 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.894 -2.616 18986 1633 1 4 . 1 1 630 630 ILE H H 630 8.213 8.213 8.257 -0.044 18986 1634 1 4 . 1 1 631 631 GLU N N 631 119.546 119.546 121.179 -1.633 18986 1635 1 4 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.001 0.064 18986 1636 1 4 . 1 1 631 631 GLU C C 631 177.300 177.300 179.459 -2.159 18986 1637 1 4 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.780 -2.800 18986 1638 1 4 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.502 -2.509 18986 1639 1 4 . 1 1 631 631 GLU H H 631 7.742 7.742 8.161 -0.419 18986 1640 1 4 . 1 1 632 632 ILE N N 632 121.547 121.547 121.811 -0.264 18986 1641 1 4 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.772 -0.089 18986 1642 1 4 . 1 1 632 632 ILE C C 632 175.454 175.454 178.436 -2.982 18986 1643 1 4 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.581 -2.925 18986 1644 1 4 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.919 -2.089 18986 1645 1 4 . 1 1 632 632 ILE H H 632 8.013 8.013 8.151 -0.138 18986 1646 1 4 . 1 1 633 633 ILE N N 633 121.605 121.605 121.090 0.515 18986 1647 1 4 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.610 -0.275 18986 1648 1 4 . 1 1 633 633 ILE C C 633 174.558 174.558 178.440 -3.882 18986 1649 1 4 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.472 -1.552 18986 1650 1 4 . 1 1 633 633 ILE CB C 633 35.284 35.284 36.871 -1.587 18986 1651 1 4 . 1 1 633 633 ILE H H 633 8.594 8.594 8.441 0.153 18986 1652 1 4 . 1 1 634 634 ASP N N 634 118.706 118.706 119.417 -0.711 18986 1653 1 4 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.592 -0.157 18986 1654 1 4 . 1 1 634 634 ASP C C 634 176.574 176.574 179.082 -2.508 18986 1655 1 4 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.385 -2.814 18986 1656 1 4 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.896 -2.982 18986 1657 1 4 . 1 1 634 634 ASP H H 634 8.724 8.724 8.462 0.262 18986 1658 1 4 . 1 1 635 635 SER N N 635 114.064 114.064 115.877 -1.813 18986 1659 1 4 . 1 1 635 635 SER HA H 635 4.232 4.232 4.270 -0.038 18986 1660 1 4 . 1 1 635 635 SER C C 635 174.487 174.487 176.290 -1.803 18986 1661 1 4 . 1 1 635 635 SER CA C 635 58.540 58.540 61.469 -2.929 18986 1662 1 4 . 1 1 635 635 SER CB C 635 60.319 60.319 63.205 -2.886 18986 1663 1 4 . 1 1 635 635 SER H H 635 7.992 7.992 8.193 -0.201 18986 1664 1 4 . 1 1 636 636 LEU N N 636 122.493 122.493 122.398 0.095 18986 1665 1 4 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.265 -0.011 18986 1666 1 4 . 1 1 636 636 LEU C C 636 176.194 176.194 178.640 -2.446 18986 1667 1 4 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.322 -3.227 18986 1668 1 4 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.260 -1.554 18986 1669 1 4 . 1 1 636 636 LEU H H 636 8.169 8.169 8.265 -0.096 18986 1670 1 4 . 1 1 637 637 ALA N N 637 121.891 121.891 121.900 -0.009 18986 1671 1 4 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.342 -0.253 18986 1672 1 4 . 1 1 637 637 ALA C C 637 175.131 175.131 180.487 -5.356 18986 1673 1 4 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.334 -3.998 18986 1674 1 4 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.220 -2.732 18986 1675 1 4 . 1 1 637 637 ALA H H 637 8.482 8.482 8.225 0.257 18986 1676 1 4 . 1 1 638 638 VAL N N 638 117.140 117.140 118.415 -1.275 18986 1677 1 4 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.920 0.015 18986 1678 1 4 . 1 1 638 638 VAL C C 638 174.712 174.712 176.670 -1.958 18986 1679 1 4 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.402 -2.401 18986 1680 1 4 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.747 -2.396 18986 1681 1 4 . 1 1 638 638 VAL H H 638 7.291 7.291 8.073 -0.782 18986 1682 1 4 . 1 1 639 639 SER N N 639 114.143 114.143 114.255 -0.112 18986 1683 1 4 . 1 1 639 639 SER HA H 639 4.481 4.481 4.678 -0.197 18986 1684 1 4 . 1 1 639 639 SER C C 639 172.122 172.122 173.091 -0.969 18986 1685 1 4 . 1 1 639 639 SER CA C 639 56.002 56.002 58.228 -2.226 18986 1686 1 4 . 1 1 639 639 SER CB C 639 60.921 60.921 63.989 -3.067 18986 1687 1 4 . 1 1 639 639 SER H H 639 7.918 7.918 8.117 -0.199 18986 1688 1 4 . 1 1 640 640 SER N N 640 115.370 115.370 115.155 0.215 18986 1689 1 4 . 1 1 640 640 SER HA H 640 4.711 4.711 4.597 0.114 18986 1690 1 4 . 1 1 640 640 SER C C 640 171.185 171.185 174.257 -3.072 18986 1691 1 4 . 1 1 640 640 SER CA C 640 55.009 55.009 57.482 -2.473 18986 1692 1 4 . 1 1 640 640 SER CB C 640 61.974 61.974 64.844 -2.870 18986 1693 1 4 . 1 1 640 640 SER H H 640 7.765 7.765 7.420 0.345 18986 1694 1 4 . 1 1 641 641 GLU N N 641 119.994 119.994 121.595 -1.601 18986 1695 1 4 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.089 -0.045 18986 1696 1 4 . 1 1 641 641 GLU C C 641 173.167 173.167 175.721 -2.554 18986 1697 1 4 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.157 -2.506 18986 1698 1 4 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.957 -2.473 18986 1699 1 4 . 1 1 641 641 GLU H H 641 8.363 8.363 8.797 -0.434 18986 1700 1 4 . 1 1 642 642 CYS N N 642 110.257 110.257 114.158 -3.901 18986 1701 1 4 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.547 -0.088 18986 1702 1 4 . 1 1 642 642 CYS C C 642 168.058 168.058 173.206 -5.148 18986 1703 1 4 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.255 -5.309 18986 1704 1 4 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.995 9.366 18986 1705 1 4 . 1 1 642 642 CYS H H 642 7.881 7.881 7.299 0.582 18986 1706 1 4 . 1 1 643 643 ALA N N 643 123.922 123.922 123.962 -0.040 18986 1707 1 4 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.396 0.242 18986 1708 1 4 . 1 1 643 643 ALA C C 643 172.517 172.517 176.678 -4.161 18986 1709 1 4 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.617 -3.997 18986 1710 1 4 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.231 0.213 18986 1711 1 4 . 1 1 643 643 ALA H H 643 9.787 9.787 8.804 0.983 18986 1712 1 4 . 1 1 644 644 LYS N N 644 128.479 128.479 126.538 1.941 18986 1713 1 4 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.502 0.009 18986 1714 1 4 . 1 1 644 644 LYS C C 644 176.945 176.945 177.184 -0.239 18986 1715 1 4 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.297 -1.959 18986 1716 1 4 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.956 -2.014 18986 1717 1 4 . 1 1 644 644 LYS H H 644 9.809 9.809 8.697 1.112 18986 1718 1 4 . 1 1 645 645 VAL N N 645 124.257 124.257 127.247 -2.990 18986 1719 1 4 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.626 0.022 18986 1720 1 4 . 1 1 645 645 VAL C C 645 173.996 173.996 177.073 -3.077 18986 1721 1 4 . 1 1 645 645 VAL CA C 645 64.862 64.862 65.220 -0.358 18986 1722 1 4 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.592 -2.391 18986 1723 1 4 . 1 1 645 645 VAL H H 645 8.458 8.458 9.231 -0.773 18986 1724 1 4 . 1 1 646 646 LYS N N 646 117.598 117.598 119.442 -1.844 18986 1725 1 4 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.871 0.136 18986 1726 1 4 . 1 1 646 646 LYS C C 646 176.047 176.047 178.619 -2.572 18986 1727 1 4 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.511 -3.266 18986 1728 1 4 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.840 -2.442 18986 1729 1 4 . 1 1 646 646 LYS H H 646 8.706 8.706 8.451 0.255 18986 1730 1 4 . 1 1 647 647 ASP N N 647 119.229 119.229 119.302 -0.073 18986 1731 1 4 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.417 0.201 18986 1732 1 4 . 1 1 647 647 ASP C C 647 175.211 175.211 178.459 -3.248 18986 1733 1 4 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.365 -3.042 18986 1734 1 4 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.977 -2.239 18986 1735 1 4 . 1 1 647 647 ASP H H 647 7.012 7.012 7.940 -0.928 18986 1736 1 4 . 1 1 648 648 ILE N N 648 121.939 121.939 120.228 1.711 18986 1737 1 4 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.563 -0.182 18986 1738 1 4 . 1 1 648 648 ILE C C 648 175.243 175.243 177.989 -2.746 18986 1739 1 4 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.410 -2.369 18986 1740 1 4 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.686 -1.724 18986 1741 1 4 . 1 1 648 648 ILE H H 648 8.152 8.152 7.347 0.805 18986 1742 1 4 . 1 1 649 649 LEU N N 649 117.310 117.310 120.679 -3.369 18986 1743 1 4 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.808 0.065 18986 1744 1 4 . 1 1 649 649 LEU C C 649 176.439 176.439 178.805 -2.366 18986 1745 1 4 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.693 -2.808 18986 1746 1 4 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.470 -2.164 18986 1747 1 4 . 1 1 649 649 LEU H H 649 8.638 8.638 8.579 0.059 18986 1748 1 4 . 1 1 650 650 LYS N N 650 118.810 118.810 118.430 0.380 18986 1749 1 4 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.998 0.048 18986 1750 1 4 . 1 1 650 650 LYS C C 650 176.801 176.801 179.024 -2.223 18986 1751 1 4 . 1 1 650 650 LYS CA C 650 57.051 57.051 58.886 -1.835 18986 1752 1 4 . 1 1 650 650 LYS CB C 650 30.064 30.064 31.400 -1.336 18986 1753 1 4 . 1 1 650 650 LYS H H 650 7.296 7.296 8.059 -0.763 18986 1754 1 4 . 1 1 651 651 GLU N N 651 117.713 117.713 120.297 -2.584 18986 1755 1 4 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.017 0.091 18986 1756 1 4 . 1 1 651 651 GLU C C 651 176.903 176.903 178.992 -2.089 18986 1757 1 4 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.037 -3.227 18986 1758 1 4 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.136 -1.688 18986 1759 1 4 . 1 1 651 651 GLU H H 651 8.036 8.036 8.435 -0.399 18986 1760 1 4 . 1 1 652 652 ALA N N 652 121.206 121.206 121.765 -0.559 18986 1761 1 4 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.042 -0.044 18986 1762 1 4 . 1 1 652 652 ALA C C 652 176.766 176.766 180.037 -3.271 18986 1763 1 4 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.137 -3.403 18986 1764 1 4 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.175 -2.860 18986 1765 1 4 . 1 1 652 652 ALA H H 652 8.973 8.973 8.501 0.472 18986 1766 1 4 . 1 1 653 653 GLN N N 653 117.768 117.768 118.288 -0.520 18986 1767 1 4 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.307 0.170 18986 1768 1 4 . 1 1 653 653 GLN C C 653 177.388 177.388 178.940 -1.552 18986 1769 1 4 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.477 -2.417 18986 1770 1 4 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.831 -2.062 18986 1771 1 4 . 1 1 653 653 GLN H H 653 8.059 8.059 8.408 -0.349 18986 1772 1 4 . 1 1 654 654 GLN N N 654 117.979 117.979 118.150 -0.171 18986 1773 1 4 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.100 0.077 18986 1774 1 4 . 1 1 654 654 GLN C C 654 174.834 174.834 178.494 -3.660 18986 1775 1 4 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.045 -2.627 18986 1776 1 4 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.583 -2.606 18986 1777 1 4 . 1 1 654 654 GLN H H 654 7.495 7.495 8.107 -0.612 18986 1778 1 4 . 1 1 655 655 VAL N N 655 110.080 110.080 116.582 -6.502 18986 1779 1 4 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.879 0.648 18986 1780 1 4 . 1 1 655 655 VAL C C 655 173.369 173.369 176.856 -3.487 18986 1781 1 4 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.305 -6.238 18986 1782 1 4 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.124 -3.941 18986 1783 1 4 . 1 1 655 655 VAL H H 655 7.197 7.197 8.216 -1.019 18986 1784 1 4 . 1 1 656 656 GLY N N 656 107.089 107.089 106.317 0.772 18986 1785 1 4 . 1 1 656 656 GLY C C 656 171.639 171.639 174.282 -2.643 18986 1786 1 4 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.750 -1.439 18986 1787 1 4 . 1 1 656 656 GLY H H 656 7.541 7.541 7.809 -0.268 18986 1788 1 4 . 1 1 657 657 ILE N N 657 121.266 121.266 121.370 -0.104 18986 1789 1 4 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.243 -0.109 18986 1790 1 4 . 1 1 657 657 ILE C C 657 171.885 171.885 175.408 -3.523 18986 1791 1 4 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.836 -2.606 18986 1792 1 4 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.433 -4.242 18986 1793 1 4 . 1 1 657 657 ILE H H 657 7.633 7.633 8.269 -0.636 18986 1794 1 4 . 1 1 658 658 GLU N N 658 127.252 127.252 126.386 0.866 18986 1795 1 4 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.234 -0.031 18986 1796 1 4 . 1 1 658 658 GLU C C 658 175.316 175.316 176.720 -1.404 18986 1797 1 4 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.012 -1.652 18986 1798 1 4 . 1 1 658 658 GLU CB C 658 27.610 27.610 30.859 -3.249 18986 1799 1 4 . 1 1 658 658 GLU H H 658 8.690 8.690 8.416 0.274 18986 1800 1 4 . 1 1 659 659 LYS N N 659 124.533 124.533 126.692 -2.159 18986 1801 1 4 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.960 -0.172 18986 1802 1 4 . 1 1 659 659 LYS C C 659 175.170 175.170 178.166 -2.996 18986 1803 1 4 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.545 -1.374 18986 1804 1 4 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.842 -1.725 18986 1805 1 4 . 1 1 659 659 LYS H H 659 8.706 8.706 8.687 0.019 18986 1806 1 4 . 1 1 660 660 SER N N 660 113.137 113.137 113.885 -0.748 18986 1807 1 4 . 1 1 660 660 SER HA H 660 4.273 4.273 4.418 -0.145 18986 1808 1 4 . 1 1 660 660 SER C C 660 173.939 173.939 176.455 -2.516 18986 1809 1 4 . 1 1 660 660 SER CA C 660 58.350 58.350 61.152 -2.802 18986 1810 1 4 . 1 1 660 660 SER CB C 660 59.504 59.504 62.357 -2.853 18986 1811 1 4 . 1 1 660 660 SER H H 660 8.777 8.777 8.386 0.391 18986 1812 1 4 . 1 1 661 661 ASN N N 661 119.986 119.986 121.280 -1.294 18986 1813 1 4 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.545 0.161 18986 1814 1 4 . 1 1 661 661 ASN C C 661 174.516 174.516 177.488 -2.972 18986 1815 1 4 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.231 -4.183 18986 1816 1 4 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.573 -1.830 18986 1817 1 4 . 1 1 661 661 ASN H H 661 7.486 7.486 7.928 -0.442 18986 1818 1 4 . 1 1 662 662 ILE N N 662 120.639 120.639 120.836 -0.197 18986 1819 1 4 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.707 -0.261 18986 1820 1 4 . 1 1 662 662 ILE C C 662 174.252 174.252 177.365 -3.113 18986 1821 1 4 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.106 -2.500 18986 1822 1 4 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.986 -3.563 18986 1823 1 4 . 1 1 662 662 ILE H H 662 7.999 7.999 8.084 -0.085 18986 1824 1 4 . 1 1 663 663 GLU N N 663 117.706 117.706 120.669 -2.963 18986 1825 1 4 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.834 -0.044 18986 1826 1 4 . 1 1 663 663 GLU C C 663 176.509 176.509 178.929 -2.420 18986 1827 1 4 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.440 -2.732 18986 1828 1 4 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.387 -2.632 18986 1829 1 4 . 1 1 663 663 GLU H H 663 8.190 8.190 8.267 -0.077 18986 1830 1 4 . 1 1 664 664 LYS N N 664 119.586 119.586 119.867 -0.281 18986 1831 1 4 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.137 -0.084 18986 1832 1 4 . 1 1 664 664 LYS C C 664 175.941 175.941 178.816 -2.875 18986 1833 1 4 . 1 1 664 664 LYS CA C 664 56.581 56.581 58.869 -2.288 18986 1834 1 4 . 1 1 664 664 LYS CB C 664 29.823 29.823 31.783 -1.960 18986 1835 1 4 . 1 1 664 664 LYS H H 664 7.590 7.590 8.068 -0.478 18986 1836 1 4 . 1 1 665 665 LEU N N 665 119.756 119.756 121.316 -1.560 18986 1837 1 4 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.987 0.093 18986 1838 1 4 . 1 1 665 665 LEU C C 665 176.700 176.700 178.999 -2.299 18986 1839 1 4 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.984 -2.599 18986 1840 1 4 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.816 -2.624 18986 1841 1 4 . 1 1 665 665 LEU H H 665 8.075 8.075 8.116 -0.041 18986 1842 1 4 . 1 1 666 666 LEU N N 666 118.788 118.788 119.006 -0.218 18986 1843 1 4 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.729 0.035 18986 1844 1 4 . 1 1 666 666 LEU C C 666 176.484 176.484 179.162 -2.678 18986 1845 1 4 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.288 -2.630 18986 1846 1 4 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.038 -2.426 18986 1847 1 4 . 1 1 666 666 LEU H H 666 8.550 8.550 8.594 -0.044 18986 1848 1 4 . 1 1 667 667 THR N N 667 115.244 115.244 115.863 -0.619 18986 1849 1 4 . 1 1 667 667 THR HA H 667 3.839 3.839 3.999 -0.160 18986 1850 1 4 . 1 1 667 667 THR C C 667 173.740 173.740 176.511 -2.771 18986 1851 1 4 . 1 1 667 667 THR CA C 667 64.378 64.378 67.543 -3.165 18986 1852 1 4 . 1 1 667 667 THR CB C 667 65.748 65.748 68.194 -2.446 18986 1853 1 4 . 1 1 667 667 THR H H 667 7.662 7.662 7.978 -0.316 18986 1854 1 4 . 1 1 668 668 ASP N N 668 122.862 122.862 122.750 0.112 18986 1855 1 4 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.391 -0.008 18986 1856 1 4 . 1 1 668 668 ASP C C 668 177.192 177.192 178.698 -1.506 18986 1857 1 4 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.269 -2.138 18986 1858 1 4 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.733 -2.847 18986 1859 1 4 . 1 1 668 668 ASP H H 668 8.291 8.291 8.560 -0.269 18986 1860 1 4 . 1 1 669 669 MET N N 669 119.640 119.640 117.872 1.768 18986 1861 1 4 . 1 1 669 669 MET HA H 669 3.917 3.917 4.237 -0.320 18986 1862 1 4 . 1 1 669 669 MET C C 669 175.414 175.414 178.266 -2.852 18986 1863 1 4 . 1 1 669 669 MET CA C 669 57.234 57.234 59.227 -1.993 18986 1864 1 4 . 1 1 669 669 MET CB C 669 32.088 32.088 32.603 -0.515 18986 1865 1 4 . 1 1 669 669 MET H H 669 8.809 8.809 8.359 0.450 18986 1866 1 4 . 1 1 670 670 ARG N N 670 122.614 122.614 119.907 2.707 18986 1867 1 4 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.496 0.021 18986 1868 1 4 . 1 1 670 670 ARG C C 670 177.928 177.928 178.825 -0.897 18986 1869 1 4 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.736 -2.514 18986 1870 1 4 . 1 1 670 670 ARG CB C 670 27.304 27.304 30.022 -2.718 18986 1871 1 4 . 1 1 670 670 ARG H H 670 8.450 8.450 8.486 -0.036 18986 1872 1 4 . 1 1 671 671 LYS N N 671 121.976 121.976 119.750 2.226 18986 1873 1 4 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.253 -0.140 18986 1874 1 4 . 1 1 671 671 LYS C C 671 176.143 176.143 177.995 -1.852 18986 1875 1 4 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.465 -1.379 18986 1876 1 4 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.335 -2.831 18986 1877 1 4 . 1 1 671 671 LYS H H 671 8.609 8.609 8.439 0.170 18986 1878 1 4 . 1 1 672 672 SER N N 672 111.655 111.655 113.354 -1.699 18986 1879 1 4 . 1 1 672 672 SER HA H 672 4.469 4.469 4.622 -0.153 18986 1880 1 4 . 1 1 672 672 SER C C 672 171.692 171.692 174.965 -3.273 18986 1881 1 4 . 1 1 672 672 SER CA C 672 56.790 56.790 58.659 -1.869 18986 1882 1 4 . 1 1 672 672 SER CB C 672 61.343 61.343 64.750 -3.407 18986 1883 1 4 . 1 1 672 672 SER H H 672 7.884 7.884 8.097 -0.213 18986 1884 1 4 . 1 1 673 673 GLY N N 673 108.029 108.029 108.715 -0.686 18986 1885 1 4 . 1 1 673 673 GLY C C 673 171.492 171.492 174.636 -3.144 18986 1886 1 4 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.305 -2.030 18986 1887 1 4 . 1 1 673 673 GLY H H 673 7.774 7.774 8.048 -0.274 18986 1888 1 4 . 1 1 674 674 ILE N N 674 116.193 116.193 120.009 -3.816 18986 1889 1 4 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.259 -0.158 18986 1890 1 4 . 1 1 674 674 ILE C C 674 173.980 173.980 175.831 -1.851 18986 1891 1 4 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.287 -3.045 18986 1892 1 4 . 1 1 674 674 ILE CB C 674 36.804 36.804 39.318 -2.514 18986 1893 1 4 . 1 1 674 674 ILE H H 674 8.026 8.026 8.454 -0.428 18986 1894 1 4 . 1 1 675 675 ILE N N 675 108.928 108.928 114.046 -5.118 18986 1895 1 4 . 1 1 675 675 ILE HA H 675 5.358 5.358 5.158 0.200 18986 1896 1 4 . 1 1 675 675 ILE C C 675 170.797 170.797 174.357 -3.560 18986 1897 1 4 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.652 -2.628 18986 1898 1 4 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.182 -2.696 18986 1899 1 4 . 1 1 675 675 ILE H H 675 7.120 7.120 7.506 -0.386 18986 1900 1 4 . 1 1 676 676 TYR N N 676 118.062 118.062 115.407 2.655 18986 1901 1 4 . 1 1 676 676 TYR HA H 676 4.995 4.995 4.975 0.020 18986 1902 1 4 . 1 1 676 676 TYR C C 676 170.020 170.020 173.265 -3.245 18986 1903 1 4 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.047 -3.154 18986 1904 1 4 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.820 -2.304 18986 1905 1 4 . 1 1 676 676 TYR H H 676 9.380 9.380 8.825 0.555 18986 1906 1 4 . 1 1 677 677 GLU N N 677 123.578 123.578 123.481 0.097 18986 1907 1 4 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.758 0.068 18986 1908 1 4 . 1 1 677 677 GLU C C 677 172.146 172.146 175.779 -3.633 18986 1909 1 4 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.445 -2.969 18986 1910 1 4 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.587 -1.975 18986 1911 1 4 . 1 1 677 677 GLU H H 677 8.951 8.951 8.758 0.193 18986 1912 1 4 . 1 1 678 678 ALA N N 678 133.220 133.220 129.816 3.404 18986 1913 1 4 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.427 -0.386 18986 1914 1 4 . 1 1 678 678 ALA C C 678 175.219 175.219 177.245 -2.026 18986 1915 1 4 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.791 -2.190 18986 1916 1 4 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.668 -3.069 18986 1917 1 4 . 1 1 678 678 ALA H H 678 7.912 7.912 8.623 -0.711 18986 1918 1 4 . 1 1 679 679 LYS N N 679 115.687 115.687 115.807 -0.120 18986 1919 1 4 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.733 -0.298 18986 1920 1 4 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.424 -1.408 18986 1921 1 4 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.702 -2.707 18986 1922 1 4 . 1 1 679 679 LYS H H 679 8.215 8.215 7.375 0.840 18986 1923 1 4 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.394 -0.375 18986 1924 1 4 . 1 1 680 680 PRO C C 680 174.504 174.504 177.895 -3.391 18986 1925 1 4 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.907 -1.389 18986 1926 1 4 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.652 -3.337 18986 1927 1 4 . 1 1 681 681 GLU N N 681 118.851 118.851 118.247 0.604 18986 1928 1 4 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.967 -0.529 18986 1929 1 4 . 1 1 681 681 GLU C C 681 172.890 172.890 175.425 -2.535 18986 1930 1 4 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.571 -4.090 18986 1931 1 4 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.768 -3.979 18986 1932 1 4 . 1 1 681 681 GLU H H 681 10.003 10.003 9.856 0.147 18986 1933 1 4 . 1 1 682 682 CYS N N 682 120.934 120.934 118.872 2.062 18986 1934 1 4 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.137 -0.110 18986 1935 1 4 . 1 1 682 682 CYS C C 682 171.905 171.905 173.595 -1.690 18986 1936 1 4 . 1 1 682 682 CYS CA C 682 54.244 54.244 58.336 -4.092 18986 1937 1 4 . 1 1 682 682 CYS CB C 682 45.295 45.295 27.784 17.512 18986 1938 1 4 . 1 1 682 682 CYS H H 682 7.860 7.860 8.165 -0.305 18986 1939 1 4 . 1 1 683 683 TYR N N 683 126.183 126.183 124.197 1.986 18986 1940 1 4 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.241 -0.017 18986 1941 1 4 . 1 1 683 683 TYR C C 683 173.008 173.008 175.085 -2.077 18986 1942 1 4 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.205 -0.637 18986 1943 1 4 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.733 0.220 18986 1944 1 4 . 1 1 683 683 TYR H H 683 9.297 9.297 9.333 -0.036 18986 1945 1 4 . 1 1 684 684 LYS N N 684 118.604 118.604 121.096 -2.492 18986 1946 1 4 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.696 -0.259 18986 1947 1 4 . 1 1 684 684 LYS C C 684 171.628 171.628 174.796 -3.168 18986 1948 1 4 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.387 -1.084 18986 1949 1 4 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.664 -1.987 18986 1950 1 4 . 1 1 684 684 LYS H H 684 8.630 8.630 8.773 -0.143 18986 1951 1 4 . 1 1 685 685 LYS N N 685 122.869 122.869 126.321 -3.452 18986 1952 1 4 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.369 0.275 18986 1953 1 4 . 1 1 685 685 LYS C C 685 173.337 173.337 176.007 -2.670 18986 1954 1 4 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.029 -2.776 18986 1955 1 4 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.528 -1.601 18986 1956 1 4 . 1 1 685 685 LYS H H 685 8.969 8.969 8.684 0.285 18986 1957 1 5 . 1 1 601 601 SER HA H 601 4.475 4.475 4.338 0.137 18986 1958 1 5 . 1 1 601 601 SER CA C 601 55.508 55.508 59.914 -4.406 18986 1959 1 5 . 1 1 601 601 SER CB C 601 61.220 61.220 62.894 -1.673 18986 1960 1 5 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.743 -0.127 18986 1961 1 5 . 1 1 602 602 HIS C C 602 172.320 172.320 173.947 -1.627 18986 1962 1 5 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.028 -1.174 18986 1963 1 5 . 1 1 602 602 HIS CB C 602 28.083 28.083 31.701 -3.618 18986 1964 1 5 . 1 1 603 603 MET N N 603 121.862 121.862 121.459 0.403 18986 1965 1 5 . 1 1 603 603 MET HA H 603 4.425 4.425 4.990 -0.565 18986 1966 1 5 . 1 1 603 603 MET C C 603 173.948 173.948 175.240 -1.292 18986 1967 1 5 . 1 1 603 603 MET CA C 603 53.108 53.108 55.058 -1.950 18986 1968 1 5 . 1 1 603 603 MET CB C 603 30.049 30.049 35.253 -5.204 18986 1969 1 5 . 1 1 603 603 MET H H 603 8.394 8.394 8.448 -0.054 18986 1970 1 5 . 1 1 604 604 GLY N N 604 110.382 110.382 110.858 -0.476 18986 1971 1 5 . 1 1 604 604 GLY C C 604 171.590 171.590 173.495 -1.905 18986 1972 1 5 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.901 -2.284 18986 1973 1 5 . 1 1 604 604 GLY H H 604 8.411 8.411 8.776 -0.365 18986 1974 1 5 . 1 1 605 605 GLU N N 605 120.709 120.709 120.769 -0.060 18986 1975 1 5 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.284 0.023 18986 1976 1 5 . 1 1 605 605 GLU C C 605 174.220 174.220 175.431 -1.211 18986 1977 1 5 . 1 1 605 605 GLU CA C 605 53.966 53.966 57.141 -3.175 18986 1978 1 5 . 1 1 605 605 GLU CB C 605 27.611 27.611 29.388 -1.777 18986 1979 1 5 . 1 1 605 605 GLU H H 605 8.282 8.282 8.449 -0.167 18986 1980 1 5 . 1 1 606 606 SER N N 606 116.679 116.679 119.190 -2.511 18986 1981 1 5 . 1 1 606 606 SER HA H 606 4.405 4.405 4.716 -0.311 18986 1982 1 5 . 1 1 606 606 SER C C 606 172.455 172.455 174.132 -1.677 18986 1983 1 5 . 1 1 606 606 SER CA C 606 56.028 56.028 57.784 -1.756 18986 1984 1 5 . 1 1 606 606 SER CB C 606 61.039 61.039 65.695 -4.656 18986 1985 1 5 . 1 1 606 606 SER H H 606 8.420 8.420 8.470 -0.050 18986 1986 1 5 . 1 1 607 607 GLY N N 607 110.716 110.716 110.740 -0.024 18986 1987 1 5 . 1 1 607 607 GLY C C 607 171.173 171.173 173.152 -1.979 18986 1988 1 5 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.802 -2.161 18986 1989 1 5 . 1 1 607 607 GLY H H 607 8.386 8.386 8.161 0.225 18986 1990 1 5 . 1 1 608 608 LYS N N 608 120.785 120.785 119.453 1.332 18986 1991 1 5 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.678 -0.339 18986 1992 1 5 . 1 1 608 608 LYS C C 608 173.673 173.673 175.925 -2.252 18986 1993 1 5 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.686 -2.321 18986 1994 1 5 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.134 -2.603 18986 1995 1 5 . 1 1 608 608 LYS H H 608 8.008 8.008 8.191 -0.183 18986 1996 1 5 . 1 1 609 609 ILE N N 609 122.404 122.404 122.451 -0.047 18986 1997 1 5 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.440 -0.291 18986 1998 1 5 . 1 1 609 609 ILE C C 609 172.675 172.675 175.079 -2.404 18986 1999 1 5 . 1 1 609 609 ILE CA C 609 58.003 58.003 59.596 -1.593 18986 2000 1 5 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.031 -2.826 18986 2001 1 5 . 1 1 609 609 ILE H H 609 8.186 8.186 7.681 0.505 18986 2002 1 5 . 1 1 610 610 ASP N N 610 125.357 125.357 127.286 -1.929 18986 2003 1 5 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.931 -0.228 18986 2004 1 5 . 1 1 610 610 ASP C C 610 173.668 173.668 175.566 -1.898 18986 2005 1 5 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.262 -2.560 18986 2006 1 5 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.413 -4.723 18986 2007 1 5 . 1 1 610 610 ASP H H 610 8.369 8.369 7.973 0.396 18986 2008 1 5 . 1 1 611 611 ILE N N 611 122.494 122.494 120.808 1.686 18986 2009 1 5 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.997 -0.088 18986 2010 1 5 . 1 1 611 611 ILE C C 611 173.618 173.618 176.890 -3.272 18986 2011 1 5 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.207 -3.167 18986 2012 1 5 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.232 -2.434 18986 2013 1 5 . 1 1 611 611 ILE H H 611 8.284 8.284 8.142 0.142 18986 2014 1 5 . 1 1 612 612 ASP N N 612 121.440 121.440 119.677 1.763 18986 2015 1 5 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.409 0.025 18986 2016 1 5 . 1 1 612 612 ASP C C 612 175.129 175.129 178.291 -3.162 18986 2017 1 5 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.767 -4.001 18986 2018 1 5 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.279 -1.141 18986 2019 1 5 . 1 1 612 612 ASP H H 612 8.279 8.279 8.467 -0.188 18986 2020 1 5 . 1 1 613 613 THR N N 613 114.422 114.422 113.735 0.687 18986 2021 1 5 . 1 1 613 613 THR HA H 613 4.106 4.106 4.109 -0.003 18986 2022 1 5 . 1 1 613 613 THR C C 613 173.338 173.338 175.829 -2.491 18986 2023 1 5 . 1 1 613 613 THR CA C 613 61.545 61.545 65.269 -3.724 18986 2024 1 5 . 1 1 613 613 THR CB C 613 66.267 66.267 68.598 -2.331 18986 2025 1 5 . 1 1 613 613 THR H H 613 7.866 7.866 8.325 -0.459 18986 2026 1 5 . 1 1 614 614 ILE N N 614 121.654 121.654 121.275 0.379 18986 2027 1 5 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.008 0.021 18986 2028 1 5 . 1 1 614 614 ILE C C 614 174.471 174.471 176.913 -2.442 18986 2029 1 5 . 1 1 614 614 ILE CA C 614 60.173 60.173 64.763 -4.590 18986 2030 1 5 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.303 -2.488 18986 2031 1 5 . 1 1 614 614 ILE H H 614 7.819 7.819 7.399 0.420 18986 2032 1 5 . 1 1 615 615 MET N N 615 119.713 119.713 119.116 0.597 18986 2033 1 5 . 1 1 615 615 MET HA H 615 4.478 4.478 4.475 0.003 18986 2034 1 5 . 1 1 615 615 MET C C 615 174.075 174.075 178.222 -4.147 18986 2035 1 5 . 1 1 615 615 MET CA C 615 52.764 52.764 56.944 -4.180 18986 2036 1 5 . 1 1 615 615 MET CB C 615 29.337 29.337 31.489 -2.152 18986 2037 1 5 . 1 1 615 615 MET H H 615 8.188 8.188 8.551 -0.363 18986 2038 1 5 . 1 1 616 616 THR N N 616 114.770 114.770 116.376 -1.606 18986 2039 1 5 . 1 1 616 616 THR HA H 616 4.099 4.099 4.070 0.029 18986 2040 1 5 . 1 1 616 616 THR C C 616 172.535 172.535 176.249 -3.714 18986 2041 1 5 . 1 1 616 616 THR CA C 616 61.112 61.112 66.528 -5.415 18986 2042 1 5 . 1 1 616 616 THR CB C 616 66.617 66.617 68.944 -2.327 18986 2043 1 5 . 1 1 616 616 THR H H 616 7.722 7.722 8.557 -0.835 18986 2044 1 5 . 1 1 617 617 GLY N N 617 111.384 111.384 105.743 5.641 18986 2045 1 5 . 1 1 617 617 GLY C C 617 171.437 171.437 173.942 -2.505 18986 2046 1 5 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.124 -2.682 18986 2047 1 5 . 1 1 617 617 GLY H H 617 8.431 8.431 7.755 0.676 18986 2048 1 5 . 1 1 618 618 LYS N N 618 120.996 120.996 122.840 -1.844 18986 2049 1 5 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.810 -0.143 18986 2050 1 5 . 1 1 618 618 LYS CA C 618 50.828 50.828 53.101 -2.273 18986 2051 1 5 . 1 1 618 618 LYS CB C 618 29.477 29.477 32.188 -2.711 18986 2052 1 5 . 1 1 618 618 LYS H H 618 7.821 7.821 8.266 -0.445 18986 2053 1 5 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.560 -0.091 18986 2054 1 5 . 1 1 619 619 PRO C C 619 174.453 174.453 177.693 -3.240 18986 2055 1 5 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.780 -2.588 18986 2056 1 5 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.788 -3.208 18986 2057 1 5 . 1 1 620 620 LYS N N 620 123.464 123.464 123.923 -0.459 18986 2058 1 5 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.962 0.084 18986 2059 1 5 . 1 1 620 620 LYS C C 620 174.895 174.895 178.747 -3.852 18986 2060 1 5 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.753 -3.464 18986 2061 1 5 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.671 -1.217 18986 2062 1 5 . 1 1 620 620 LYS H H 620 8.728 8.728 8.753 -0.025 18986 2063 1 5 . 1 1 621 621 SER N N 621 113.921 113.921 115.381 -1.460 18986 2064 1 5 . 1 1 621 621 SER HA H 621 4.336 4.336 4.030 0.305 18986 2065 1 5 . 1 1 621 621 SER C C 621 173.149 173.149 176.297 -3.148 18986 2066 1 5 . 1 1 621 621 SER CA C 621 56.691 56.691 61.169 -4.478 18986 2067 1 5 . 1 1 621 621 SER CB C 621 60.689 60.689 62.635 -1.946 18986 2068 1 5 . 1 1 621 621 SER H H 621 8.531 8.531 8.519 0.012 18986 2069 1 5 . 1 1 622 622 ALA N N 622 124.177 124.177 123.273 0.904 18986 2070 1 5 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.036 0.132 18986 2071 1 5 . 1 1 622 622 ALA C C 622 176.804 176.804 179.010 -2.206 18986 2072 1 5 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.117 -2.749 18986 2073 1 5 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.178 -2.324 18986 2074 1 5 . 1 1 622 622 ALA H H 622 7.835 7.835 7.962 -0.127 18986 2075 1 5 . 1 1 623 623 ARG N N 623 118.263 118.263 118.657 -0.394 18986 2076 1 5 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.031 -0.081 18986 2077 1 5 . 1 1 623 623 ARG C C 623 175.683 175.683 178.686 -3.003 18986 2078 1 5 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.112 -1.949 18986 2079 1 5 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.359 -1.908 18986 2080 1 5 . 1 1 623 623 ARG H H 623 8.148 8.148 7.910 0.238 18986 2081 1 5 . 1 1 624 624 GLU N N 624 117.953 117.953 120.437 -2.484 18986 2082 1 5 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.152 -0.184 18986 2083 1 5 . 1 1 624 624 GLU C C 624 177.204 177.204 178.470 -1.266 18986 2084 1 5 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.724 -1.867 18986 2085 1 5 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.136 -2.169 18986 2086 1 5 . 1 1 624 624 GLU H H 624 8.143 8.143 8.487 -0.344 18986 2087 1 5 . 1 1 625 625 LYS N N 625 119.222 119.222 118.085 1.137 18986 2088 1 5 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.336 -0.479 18986 2089 1 5 . 1 1 625 625 LYS C C 625 175.480 175.480 178.689 -3.209 18986 2090 1 5 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.422 -0.935 18986 2091 1 5 . 1 1 625 625 LYS CB C 625 30.663 30.663 33.304 -2.641 18986 2092 1 5 . 1 1 625 625 LYS H H 625 7.772 7.772 7.747 0.025 18986 2093 1 5 . 1 1 626 626 MET N N 626 117.883 117.883 120.083 -2.200 18986 2094 1 5 . 1 1 626 626 MET HA H 626 3.807 3.807 4.057 -0.250 18986 2095 1 5 . 1 1 626 626 MET C C 626 175.278 175.278 178.058 -2.780 18986 2096 1 5 . 1 1 626 626 MET CA C 626 57.782 57.782 59.865 -2.083 18986 2097 1 5 . 1 1 626 626 MET CB C 626 30.657 30.657 32.842 -2.185 18986 2098 1 5 . 1 1 626 626 MET H H 626 8.367 8.367 8.696 -0.329 18986 2099 1 5 . 1 1 627 627 MET N N 627 116.185 116.185 116.262 -0.077 18986 2100 1 5 . 1 1 627 627 MET HA H 627 4.152 4.152 4.297 -0.145 18986 2101 1 5 . 1 1 627 627 MET C C 627 176.393 176.393 178.391 -1.998 18986 2102 1 5 . 1 1 627 627 MET CA C 627 55.359 55.359 56.707 -1.348 18986 2103 1 5 . 1 1 627 627 MET CB C 627 28.803 28.803 31.219 -2.416 18986 2104 1 5 . 1 1 627 627 MET H H 627 8.197 8.197 8.624 -0.427 18986 2105 1 5 . 1 1 628 628 LYS N N 628 119.859 119.859 121.899 -2.040 18986 2106 1 5 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.068 0.132 18986 2107 1 5 . 1 1 628 628 LYS C C 628 175.885 175.885 178.746 -2.861 18986 2108 1 5 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.625 -4.548 18986 2109 1 5 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.636 -4.105 18986 2110 1 5 . 1 1 628 628 LYS H H 628 7.700 7.700 7.257 0.443 18986 2111 1 5 . 1 1 629 629 ILE N N 629 119.001 119.001 119.930 -0.929 18986 2112 1 5 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.574 -0.026 18986 2113 1 5 . 1 1 629 629 ILE C C 629 174.891 174.891 178.060 -3.169 18986 2114 1 5 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.900 -3.635 18986 2115 1 5 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.910 -4.061 18986 2116 1 5 . 1 1 629 629 ILE H H 629 7.970 7.970 8.059 -0.089 18986 2117 1 5 . 1 1 630 630 ILE N N 630 120.737 120.737 116.634 4.103 18986 2118 1 5 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.557 -0.090 18986 2119 1 5 . 1 1 630 630 ILE C C 630 173.875 173.875 177.736 -3.861 18986 2120 1 5 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.803 -3.050 18986 2121 1 5 . 1 1 630 630 ILE CB C 630 34.277 34.277 37.053 -2.776 18986 2122 1 5 . 1 1 630 630 ILE H H 630 8.213 8.213 8.220 -0.007 18986 2123 1 5 . 1 1 631 631 GLU N N 631 119.546 119.546 121.496 -1.950 18986 2124 1 5 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.221 -0.156 18986 2125 1 5 . 1 1 631 631 GLU C C 631 177.300 177.300 179.208 -1.908 18986 2126 1 5 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.453 -2.473 18986 2127 1 5 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.430 -2.437 18986 2128 1 5 . 1 1 631 631 GLU H H 631 7.742 7.742 7.371 0.371 18986 2129 1 5 . 1 1 632 632 ILE N N 632 121.547 121.547 119.405 2.142 18986 2130 1 5 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.672 0.011 18986 2131 1 5 . 1 1 632 632 ILE C C 632 175.454 175.454 178.389 -2.935 18986 2132 1 5 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.534 -2.878 18986 2133 1 5 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.651 -1.821 18986 2134 1 5 . 1 1 632 632 ILE H H 632 8.013 8.013 8.320 -0.307 18986 2135 1 5 . 1 1 633 633 ILE N N 633 121.605 121.605 121.142 0.463 18986 2136 1 5 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.603 -0.268 18986 2137 1 5 . 1 1 633 633 ILE C C 633 174.558 174.558 177.987 -3.429 18986 2138 1 5 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.370 -1.451 18986 2139 1 5 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.045 -1.761 18986 2140 1 5 . 1 1 633 633 ILE H H 633 8.594 8.594 8.023 0.571 18986 2141 1 5 . 1 1 634 634 ASP N N 634 118.706 118.706 119.628 -0.922 18986 2142 1 5 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.342 0.093 18986 2143 1 5 . 1 1 634 634 ASP C C 634 176.574 176.574 178.469 -1.895 18986 2144 1 5 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.050 -2.478 18986 2145 1 5 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.028 -2.114 18986 2146 1 5 . 1 1 634 634 ASP H H 634 8.724 8.724 8.400 0.324 18986 2147 1 5 . 1 1 635 635 SER N N 635 114.064 114.064 115.266 -1.202 18986 2148 1 5 . 1 1 635 635 SER HA H 635 4.232 4.232 4.300 -0.068 18986 2149 1 5 . 1 1 635 635 SER C C 635 174.487 174.487 176.764 -2.277 18986 2150 1 5 . 1 1 635 635 SER CA C 635 58.540 58.540 60.949 -2.409 18986 2151 1 5 . 1 1 635 635 SER CB C 635 60.319 60.319 63.373 -3.054 18986 2152 1 5 . 1 1 635 635 SER H H 635 7.992 7.992 8.251 -0.259 18986 2153 1 5 . 1 1 636 636 LEU N N 636 122.493 122.493 122.226 0.267 18986 2154 1 5 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.156 0.098 18986 2155 1 5 . 1 1 636 636 LEU C C 636 176.194 176.194 178.343 -2.149 18986 2156 1 5 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.697 -3.602 18986 2157 1 5 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.295 -2.589 18986 2158 1 5 . 1 1 636 636 LEU H H 636 8.169 8.169 8.079 0.090 18986 2159 1 5 . 1 1 637 637 ALA N N 637 121.891 121.891 120.456 1.435 18986 2160 1 5 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.394 -0.305 18986 2161 1 5 . 1 1 637 637 ALA C C 637 175.131 175.131 178.934 -3.803 18986 2162 1 5 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.432 -3.096 18986 2163 1 5 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.219 -2.731 18986 2164 1 5 . 1 1 637 637 ALA H H 637 8.482 8.482 8.106 0.376 18986 2165 1 5 . 1 1 638 638 VAL N N 638 117.140 117.140 117.173 -0.033 18986 2166 1 5 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.832 0.103 18986 2167 1 5 . 1 1 638 638 VAL C C 638 174.712 174.712 176.402 -1.690 18986 2168 1 5 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.437 -2.436 18986 2169 1 5 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.241 -2.890 18986 2170 1 5 . 1 1 638 638 VAL H H 638 7.291 7.291 7.652 -0.361 18986 2171 1 5 . 1 1 639 639 SER N N 639 114.143 114.143 112.167 1.976 18986 2172 1 5 . 1 1 639 639 SER HA H 639 4.481 4.481 4.520 -0.039 18986 2173 1 5 . 1 1 639 639 SER C C 639 172.122 172.122 173.879 -1.757 18986 2174 1 5 . 1 1 639 639 SER CA C 639 56.002 56.002 58.173 -2.171 18986 2175 1 5 . 1 1 639 639 SER CB C 639 60.921 60.921 65.341 -4.420 18986 2176 1 5 . 1 1 639 639 SER H H 639 7.918 7.918 7.658 0.260 18986 2177 1 5 . 1 1 640 640 SER N N 640 115.370 115.370 118.400 -3.030 18986 2178 1 5 . 1 1 640 640 SER HA H 640 4.711 4.711 4.481 0.230 18986 2179 1 5 . 1 1 640 640 SER C C 640 171.185 171.185 175.982 -4.797 18986 2180 1 5 . 1 1 640 640 SER CA C 640 55.009 55.009 58.391 -3.382 18986 2181 1 5 . 1 1 640 640 SER CB C 640 61.974 61.974 63.925 -1.951 18986 2182 1 5 . 1 1 640 640 SER H H 640 7.765 7.765 7.910 -0.145 18986 2183 1 5 . 1 1 641 641 GLU N N 641 119.994 119.994 121.303 -1.309 18986 2184 1 5 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.106 -0.062 18986 2185 1 5 . 1 1 641 641 GLU C C 641 173.167 173.167 175.545 -2.378 18986 2186 1 5 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.820 -2.169 18986 2187 1 5 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.841 -2.357 18986 2188 1 5 . 1 1 641 641 GLU H H 641 8.363 8.363 9.010 -0.647 18986 2189 1 5 . 1 1 642 642 CYS N N 642 110.257 110.257 112.208 -1.951 18986 2190 1 5 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.569 -0.110 18986 2191 1 5 . 1 1 642 642 CYS C C 642 168.058 168.058 173.257 -5.199 18986 2192 1 5 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.571 -4.625 18986 2193 1 5 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.223 10.138 18986 2194 1 5 . 1 1 642 642 CYS H H 642 7.881 7.881 7.246 0.635 18986 2195 1 5 . 1 1 643 643 ALA N N 643 123.922 123.922 124.476 -0.554 18986 2196 1 5 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.362 0.276 18986 2197 1 5 . 1 1 643 643 ALA C C 643 172.517 172.517 176.508 -3.991 18986 2198 1 5 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.950 -4.330 18986 2199 1 5 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.370 0.074 18986 2200 1 5 . 1 1 643 643 ALA H H 643 9.787 9.787 8.892 0.895 18986 2201 1 5 . 1 1 644 644 LYS N N 644 128.479 128.479 125.633 2.846 18986 2202 1 5 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.271 0.240 18986 2203 1 5 . 1 1 644 644 LYS C C 644 176.945 176.945 177.262 -0.317 18986 2204 1 5 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.339 -2.001 18986 2205 1 5 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.555 -1.613 18986 2206 1 5 . 1 1 644 644 LYS H H 644 9.809 9.809 8.666 1.143 18986 2207 1 5 . 1 1 645 645 VAL N N 645 124.257 124.257 126.191 -1.934 18986 2208 1 5 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.720 -0.072 18986 2209 1 5 . 1 1 645 645 VAL C C 645 173.996 173.996 176.612 -2.616 18986 2210 1 5 . 1 1 645 645 VAL CA C 645 64.862 64.862 65.862 -1.000 18986 2211 1 5 . 1 1 645 645 VAL CB C 645 29.201 29.201 32.254 -3.053 18986 2212 1 5 . 1 1 645 645 VAL H H 645 8.458 8.458 9.090 -0.632 18986 2213 1 5 . 1 1 646 646 LYS N N 646 117.598 117.598 119.618 -2.020 18986 2214 1 5 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.949 0.058 18986 2215 1 5 . 1 1 646 646 LYS C C 646 176.047 176.047 178.520 -2.473 18986 2216 1 5 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.613 -3.368 18986 2217 1 5 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.852 -2.454 18986 2218 1 5 . 1 1 646 646 LYS H H 646 8.706 8.706 8.568 0.138 18986 2219 1 5 . 1 1 647 647 ASP N N 647 119.229 119.229 120.472 -1.243 18986 2220 1 5 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.426 0.192 18986 2221 1 5 . 1 1 647 647 ASP C C 647 175.211 175.211 178.549 -3.338 18986 2222 1 5 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.697 -3.374 18986 2223 1 5 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.397 -1.659 18986 2224 1 5 . 1 1 647 647 ASP H H 647 7.012 7.012 7.803 -0.791 18986 2225 1 5 . 1 1 648 648 ILE N N 648 121.939 121.939 120.279 1.660 18986 2226 1 5 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.603 -0.222 18986 2227 1 5 . 1 1 648 648 ILE C C 648 175.243 175.243 177.977 -2.734 18986 2228 1 5 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.165 -2.124 18986 2229 1 5 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.730 -1.768 18986 2230 1 5 . 1 1 648 648 ILE H H 648 8.152 8.152 7.357 0.795 18986 2231 1 5 . 1 1 649 649 LEU N N 649 117.310 117.310 120.462 -3.152 18986 2232 1 5 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.844 0.029 18986 2233 1 5 . 1 1 649 649 LEU C C 649 176.439 176.439 179.199 -2.760 18986 2234 1 5 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.627 -2.742 18986 2235 1 5 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.334 -2.028 18986 2236 1 5 . 1 1 649 649 LEU H H 649 8.638 8.638 8.708 -0.070 18986 2237 1 5 . 1 1 650 650 LYS N N 650 118.810 118.810 119.115 -0.305 18986 2238 1 5 . 1 1 650 650 LYS HA H 650 4.046 4.046 4.200 -0.154 18986 2239 1 5 . 1 1 650 650 LYS C C 650 176.801 176.801 179.609 -2.808 18986 2240 1 5 . 1 1 650 650 LYS CA C 650 57.051 57.051 58.290 -1.239 18986 2241 1 5 . 1 1 650 650 LYS CB C 650 30.064 30.064 31.269 -1.205 18986 2242 1 5 . 1 1 650 650 LYS H H 650 7.296 7.296 7.897 -0.601 18986 2243 1 5 . 1 1 651 651 GLU N N 651 117.713 117.713 119.828 -2.115 18986 2244 1 5 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.033 0.075 18986 2245 1 5 . 1 1 651 651 GLU C C 651 176.903 176.903 178.881 -1.978 18986 2246 1 5 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.427 -3.617 18986 2247 1 5 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.596 -2.147 18986 2248 1 5 . 1 1 651 651 GLU H H 651 8.036 8.036 8.047 -0.011 18986 2249 1 5 . 1 1 652 652 ALA N N 652 121.206 121.206 121.234 -0.028 18986 2250 1 5 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.004 -0.006 18986 2251 1 5 . 1 1 652 652 ALA C C 652 176.766 176.766 180.011 -3.245 18986 2252 1 5 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.153 -3.419 18986 2253 1 5 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.204 -2.888 18986 2254 1 5 . 1 1 652 652 ALA H H 652 8.973 8.973 8.401 0.572 18986 2255 1 5 . 1 1 653 653 GLN N N 653 117.768 117.768 118.224 -0.456 18986 2256 1 5 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.262 0.215 18986 2257 1 5 . 1 1 653 653 GLN C C 653 177.388 177.388 179.357 -1.969 18986 2258 1 5 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.596 -2.535 18986 2259 1 5 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.689 -1.920 18986 2260 1 5 . 1 1 653 653 GLN H H 653 8.059 8.059 8.347 -0.288 18986 2261 1 5 . 1 1 654 654 GLN N N 654 117.979 117.979 118.352 -0.373 18986 2262 1 5 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.112 0.065 18986 2263 1 5 . 1 1 654 654 GLN C C 654 174.834 174.834 178.145 -3.311 18986 2264 1 5 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.087 -2.669 18986 2265 1 5 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.728 -2.751 18986 2266 1 5 . 1 1 654 654 GLN H H 654 7.495 7.495 7.932 -0.437 18986 2267 1 5 . 1 1 655 655 VAL N N 655 110.080 110.080 117.333 -7.253 18986 2268 1 5 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.806 0.721 18986 2269 1 5 . 1 1 655 655 VAL C C 655 173.369 173.369 176.571 -3.202 18986 2270 1 5 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.303 -6.236 18986 2271 1 5 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.334 -4.151 18986 2272 1 5 . 1 1 655 655 VAL H H 655 7.197 7.197 8.202 -1.005 18986 2273 1 5 . 1 1 656 656 GLY N N 656 107.089 107.089 108.073 -0.984 18986 2274 1 5 . 1 1 656 656 GLY C C 656 171.639 171.639 172.900 -1.261 18986 2275 1 5 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.775 -1.464 18986 2276 1 5 . 1 1 656 656 GLY H H 656 7.541 7.541 7.966 -0.425 18986 2277 1 5 . 1 1 657 657 ILE N N 657 121.266 121.266 120.007 1.259 18986 2278 1 5 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.410 -0.276 18986 2279 1 5 . 1 1 657 657 ILE C C 657 171.885 171.885 174.254 -2.369 18986 2280 1 5 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.943 -1.713 18986 2281 1 5 . 1 1 657 657 ILE CB C 657 35.191 35.191 42.581 -7.390 18986 2282 1 5 . 1 1 657 657 ILE H H 657 7.633 7.633 7.728 -0.095 18986 2283 1 5 . 1 1 658 658 GLU N N 658 127.252 127.252 125.160 2.092 18986 2284 1 5 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.338 -0.135 18986 2285 1 5 . 1 1 658 658 GLU C C 658 175.316 175.316 177.359 -2.043 18986 2286 1 5 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.392 -2.032 18986 2287 1 5 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.664 -4.054 18986 2288 1 5 . 1 1 658 658 GLU H H 658 8.690 8.690 8.677 0.013 18986 2289 1 5 . 1 1 659 659 LYS N N 659 124.533 124.533 125.826 -1.293 18986 2290 1 5 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.865 -0.077 18986 2291 1 5 . 1 1 659 659 LYS C C 659 175.170 175.170 178.134 -2.964 18986 2292 1 5 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.926 -1.755 18986 2293 1 5 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.489 -1.372 18986 2294 1 5 . 1 1 659 659 LYS H H 659 8.706 8.706 8.890 -0.184 18986 2295 1 5 . 1 1 660 660 SER N N 660 113.137 113.137 114.308 -1.171 18986 2296 1 5 . 1 1 660 660 SER HA H 660 4.273 4.273 4.348 -0.075 18986 2297 1 5 . 1 1 660 660 SER C C 660 173.939 173.939 176.650 -2.711 18986 2298 1 5 . 1 1 660 660 SER CA C 660 58.350 58.350 61.558 -3.208 18986 2299 1 5 . 1 1 660 660 SER CB C 660 59.504 59.504 62.755 -3.251 18986 2300 1 5 . 1 1 660 660 SER H H 660 8.777 8.777 8.245 0.532 18986 2301 1 5 . 1 1 661 661 ASN N N 661 119.986 119.986 120.779 -0.793 18986 2302 1 5 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.502 0.204 18986 2303 1 5 . 1 1 661 661 ASN C C 661 174.516 174.516 177.302 -2.786 18986 2304 1 5 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.366 -4.318 18986 2305 1 5 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.530 -1.787 18986 2306 1 5 . 1 1 661 661 ASN H H 661 7.486 7.486 7.660 -0.174 18986 2307 1 5 . 1 1 662 662 ILE N N 662 120.639 120.639 121.250 -0.611 18986 2308 1 5 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.646 -0.200 18986 2309 1 5 . 1 1 662 662 ILE C C 662 174.252 174.252 177.610 -3.358 18986 2310 1 5 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.499 -2.893 18986 2311 1 5 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.985 -3.562 18986 2312 1 5 . 1 1 662 662 ILE H H 662 7.999 7.999 8.080 -0.081 18986 2313 1 5 . 1 1 663 663 GLU N N 663 117.706 117.706 119.669 -1.963 18986 2314 1 5 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.878 -0.088 18986 2315 1 5 . 1 1 663 663 GLU C C 663 176.509 176.509 178.865 -2.356 18986 2316 1 5 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.246 -2.538 18986 2317 1 5 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.469 -2.714 18986 2318 1 5 . 1 1 663 663 GLU H H 663 8.190 8.190 8.614 -0.424 18986 2319 1 5 . 1 1 664 664 LYS N N 664 119.586 119.586 120.569 -0.983 18986 2320 1 5 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.053 0.000 18986 2321 1 5 . 1 1 664 664 LYS C C 664 175.941 175.941 178.690 -2.749 18986 2322 1 5 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.420 -2.839 18986 2323 1 5 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.227 -2.404 18986 2324 1 5 . 1 1 664 664 LYS H H 664 7.590 7.590 8.218 -0.628 18986 2325 1 5 . 1 1 665 665 LEU N N 665 119.756 119.756 121.523 -1.767 18986 2326 1 5 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.953 0.127 18986 2327 1 5 . 1 1 665 665 LEU C C 665 176.700 176.700 179.248 -2.548 18986 2328 1 5 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.111 -2.726 18986 2329 1 5 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.726 -2.534 18986 2330 1 5 . 1 1 665 665 LEU H H 665 8.075 8.075 8.170 -0.095 18986 2331 1 5 . 1 1 666 666 LEU N N 666 118.788 118.788 118.649 0.139 18986 2332 1 5 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.634 0.130 18986 2333 1 5 . 1 1 666 666 LEU C C 666 176.484 176.484 178.971 -2.487 18986 2334 1 5 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.192 -2.534 18986 2335 1 5 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.053 -2.442 18986 2336 1 5 . 1 1 666 666 LEU H H 666 8.550 8.550 8.611 -0.061 18986 2337 1 5 . 1 1 667 667 THR N N 667 115.244 115.244 115.626 -0.382 18986 2338 1 5 . 1 1 667 667 THR HA H 667 3.839 3.839 3.935 -0.096 18986 2339 1 5 . 1 1 667 667 THR C C 667 173.740 173.740 176.718 -2.978 18986 2340 1 5 . 1 1 667 667 THR CA C 667 64.378 64.378 67.409 -3.031 18986 2341 1 5 . 1 1 667 667 THR CB C 667 65.748 65.748 68.230 -2.482 18986 2342 1 5 . 1 1 667 667 THR H H 667 7.662 7.662 7.899 -0.237 18986 2343 1 5 . 1 1 668 668 ASP N N 668 122.862 122.862 122.580 0.282 18986 2344 1 5 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.487 -0.104 18986 2345 1 5 . 1 1 668 668 ASP C C 668 177.192 177.192 178.503 -1.311 18986 2346 1 5 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.472 -2.341 18986 2347 1 5 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.878 -2.992 18986 2348 1 5 . 1 1 668 668 ASP H H 668 8.291 8.291 8.539 -0.248 18986 2349 1 5 . 1 1 669 669 MET N N 669 119.640 119.640 117.695 1.945 18986 2350 1 5 . 1 1 669 669 MET HA H 669 3.917 3.917 4.292 -0.375 18986 2351 1 5 . 1 1 669 669 MET C C 669 175.414 175.414 177.772 -2.358 18986 2352 1 5 . 1 1 669 669 MET CA C 669 57.234 57.234 59.172 -1.938 18986 2353 1 5 . 1 1 669 669 MET CB C 669 32.088 32.088 32.420 -0.332 18986 2354 1 5 . 1 1 669 669 MET H H 669 8.809 8.809 8.511 0.298 18986 2355 1 5 . 1 1 670 670 ARG N N 670 122.614 122.614 120.817 1.797 18986 2356 1 5 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.515 0.002 18986 2357 1 5 . 1 1 670 670 ARG C C 670 177.928 177.928 178.742 -0.814 18986 2358 1 5 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.510 -2.288 18986 2359 1 5 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.724 -2.420 18986 2360 1 5 . 1 1 670 670 ARG H H 670 8.450 8.450 8.544 -0.094 18986 2361 1 5 . 1 1 671 671 LYS N N 671 121.976 121.976 120.288 1.688 18986 2362 1 5 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.156 -0.043 18986 2363 1 5 . 1 1 671 671 LYS C C 671 176.143 176.143 178.406 -2.263 18986 2364 1 5 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.828 -1.742 18986 2365 1 5 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.439 -2.935 18986 2366 1 5 . 1 1 671 671 LYS H H 671 8.609 8.609 8.387 0.222 18986 2367 1 5 . 1 1 672 672 SER N N 672 111.655 111.655 113.142 -1.487 18986 2368 1 5 . 1 1 672 672 SER HA H 672 4.469 4.469 4.376 0.093 18986 2369 1 5 . 1 1 672 672 SER C C 672 171.692 171.692 175.326 -3.634 18986 2370 1 5 . 1 1 672 672 SER CA C 672 56.790 56.790 59.970 -3.180 18986 2371 1 5 . 1 1 672 672 SER CB C 672 61.343 61.343 64.000 -2.657 18986 2372 1 5 . 1 1 672 672 SER H H 672 7.884 7.884 7.818 0.066 18986 2373 1 5 . 1 1 673 673 GLY N N 673 108.029 108.029 107.525 0.504 18986 2374 1 5 . 1 1 673 673 GLY C C 673 171.492 171.492 175.465 -3.973 18986 2375 1 5 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.602 -2.328 18986 2376 1 5 . 1 1 673 673 GLY H H 673 7.774 7.774 7.962 -0.188 18986 2377 1 5 . 1 1 674 674 ILE N N 674 116.193 116.193 120.477 -4.284 18986 2378 1 5 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.927 0.174 18986 2379 1 5 . 1 1 674 674 ILE C C 674 173.980 173.980 176.140 -2.160 18986 2380 1 5 . 1 1 674 674 ILE CA C 674 60.242 60.242 64.004 -3.762 18986 2381 1 5 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.596 -1.792 18986 2382 1 5 . 1 1 674 674 ILE H H 674 8.026 8.026 8.145 -0.119 18986 2383 1 5 . 1 1 675 675 ILE N N 675 108.928 108.928 113.024 -4.096 18986 2384 1 5 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.713 0.645 18986 2385 1 5 . 1 1 675 675 ILE C C 675 170.797 170.797 174.197 -3.400 18986 2386 1 5 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.625 -2.601 18986 2387 1 5 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.852 -2.366 18986 2388 1 5 . 1 1 675 675 ILE H H 675 7.120 7.120 7.396 -0.276 18986 2389 1 5 . 1 1 676 676 TYR N N 676 118.062 118.062 115.755 2.307 18986 2390 1 5 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.189 -0.194 18986 2391 1 5 . 1 1 676 676 TYR C C 676 170.020 170.020 174.158 -4.138 18986 2392 1 5 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.609 -2.716 18986 2393 1 5 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.153 -2.637 18986 2394 1 5 . 1 1 676 676 TYR H H 676 9.380 9.380 8.656 0.724 18986 2395 1 5 . 1 1 677 677 GLU N N 677 123.578 123.578 123.733 -0.155 18986 2396 1 5 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.973 -0.147 18986 2397 1 5 . 1 1 677 677 GLU C C 677 172.146 172.146 176.003 -3.857 18986 2398 1 5 . 1 1 677 677 GLU CA C 677 52.476 52.476 56.414 -3.938 18986 2399 1 5 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.921 -2.309 18986 2400 1 5 . 1 1 677 677 GLU H H 677 8.951 8.951 8.865 0.086 18986 2401 1 5 . 1 1 678 678 ALA N N 678 133.220 133.220 131.044 2.176 18986 2402 1 5 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.365 -0.324 18986 2403 1 5 . 1 1 678 678 ALA C C 678 175.219 175.219 177.045 -1.826 18986 2404 1 5 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.937 -2.336 18986 2405 1 5 . 1 1 678 678 ALA CB C 678 16.599 16.599 20.022 -3.423 18986 2406 1 5 . 1 1 678 678 ALA H H 678 7.912 7.912 8.675 -0.763 18986 2407 1 5 . 1 1 679 679 LYS N N 679 115.687 115.687 115.321 0.366 18986 2408 1 5 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.719 -0.284 18986 2409 1 5 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.642 -1.626 18986 2410 1 5 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.685 -2.690 18986 2411 1 5 . 1 1 679 679 LYS H H 679 8.215 8.215 7.865 0.350 18986 2412 1 5 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.229 -0.210 18986 2413 1 5 . 1 1 680 680 PRO C C 680 174.504 174.504 177.294 -2.790 18986 2414 1 5 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.970 -1.452 18986 2415 1 5 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.452 -3.137 18986 2416 1 5 . 1 1 681 681 GLU N N 681 118.851 118.851 115.493 3.358 18986 2417 1 5 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.892 -0.454 18986 2418 1 5 . 1 1 681 681 GLU C C 681 172.890 172.890 174.860 -1.970 18986 2419 1 5 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.264 -3.783 18986 2420 1 5 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.677 -3.888 18986 2421 1 5 . 1 1 681 681 GLU H H 681 10.003 10.003 8.930 1.073 18986 2422 1 5 . 1 1 682 682 CYS N N 682 120.934 120.934 116.684 4.250 18986 2423 1 5 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.356 -0.329 18986 2424 1 5 . 1 1 682 682 CYS C C 682 171.905 171.905 173.650 -1.745 18986 2425 1 5 . 1 1 682 682 CYS CA C 682 54.244 54.244 58.349 -4.105 18986 2426 1 5 . 1 1 682 682 CYS CB C 682 45.295 45.295 30.444 14.851 18986 2427 1 5 . 1 1 682 682 CYS H H 682 7.860 7.860 7.850 0.010 18986 2428 1 5 . 1 1 683 683 TYR N N 683 126.183 126.183 122.814 3.369 18986 2429 1 5 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.434 -0.210 18986 2430 1 5 . 1 1 683 683 TYR C C 683 173.008 173.008 174.605 -1.597 18986 2431 1 5 . 1 1 683 683 TYR CA C 683 56.568 56.568 56.720 -0.152 18986 2432 1 5 . 1 1 683 683 TYR CB C 683 40.952 40.952 42.551 -1.599 18986 2433 1 5 . 1 1 683 683 TYR H H 683 9.297 9.297 9.485 -0.188 18986 2434 1 5 . 1 1 684 684 LYS N N 684 118.604 118.604 119.025 -0.421 18986 2435 1 5 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.689 -0.252 18986 2436 1 5 . 1 1 684 684 LYS C C 684 171.628 171.628 174.206 -2.578 18986 2437 1 5 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.755 -1.452 18986 2438 1 5 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.851 -2.174 18986 2439 1 5 . 1 1 684 684 LYS H H 684 8.630 8.630 9.111 -0.481 18986 2440 1 5 . 1 1 685 685 LYS N N 685 122.869 122.869 125.970 -3.101 18986 2441 1 5 . 1 1 685 685 LYS HA H 685 4.644 4.644 3.968 0.676 18986 2442 1 5 . 1 1 685 685 LYS C C 685 173.337 173.337 176.384 -3.047 18986 2443 1 5 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.527 -2.274 18986 2444 1 5 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.352 -1.425 18986 2445 1 5 . 1 1 685 685 LYS H H 685 8.969 8.969 8.458 0.511 18986 2446 1 6 . 1 1 601 601 SER HA H 601 4.475 4.475 4.469 0.006 18986 2447 1 6 . 1 1 601 601 SER CA C 601 55.508 55.508 57.526 -2.018 18986 2448 1 6 . 1 1 601 601 SER CB C 601 61.220 61.220 65.030 -3.810 18986 2449 1 6 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.988 -0.372 18986 2450 1 6 . 1 1 602 602 HIS C C 602 172.320 172.320 174.496 -2.176 18986 2451 1 6 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.825 -1.972 18986 2452 1 6 . 1 1 602 602 HIS CB C 602 28.083 28.083 32.592 -4.509 18986 2453 1 6 . 1 1 603 603 MET N N 603 121.862 121.862 122.903 -1.041 18986 2454 1 6 . 1 1 603 603 MET HA H 603 4.425 4.425 4.713 -0.288 18986 2455 1 6 . 1 1 603 603 MET C C 603 173.948 173.948 174.548 -0.600 18986 2456 1 6 . 1 1 603 603 MET CA C 603 53.108 53.108 55.667 -2.559 18986 2457 1 6 . 1 1 603 603 MET CB C 603 30.049 30.049 33.294 -3.245 18986 2458 1 6 . 1 1 603 603 MET H H 603 8.394 8.394 9.716 -1.322 18986 2459 1 6 . 1 1 604 604 GLY N N 604 110.382 110.382 110.263 0.119 18986 2460 1 6 . 1 1 604 604 GLY C C 604 171.590 171.590 172.779 -1.189 18986 2461 1 6 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.968 -2.351 18986 2462 1 6 . 1 1 604 604 GLY H H 604 8.411 8.411 8.290 0.121 18986 2463 1 6 . 1 1 605 605 GLU N N 605 120.709 120.709 118.643 2.066 18986 2464 1 6 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.556 -0.249 18986 2465 1 6 . 1 1 605 605 GLU C C 605 174.220 174.220 176.671 -2.451 18986 2466 1 6 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.918 -1.952 18986 2467 1 6 . 1 1 605 605 GLU CB C 605 27.611 27.611 31.797 -4.186 18986 2468 1 6 . 1 1 605 605 GLU H H 605 8.282 8.282 8.611 -0.329 18986 2469 1 6 . 1 1 606 606 SER N N 606 116.679 116.679 117.926 -1.247 18986 2470 1 6 . 1 1 606 606 SER HA H 606 4.405 4.405 4.467 -0.062 18986 2471 1 6 . 1 1 606 606 SER C C 606 172.455 172.455 174.259 -1.804 18986 2472 1 6 . 1 1 606 606 SER CA C 606 56.028 56.028 58.115 -2.087 18986 2473 1 6 . 1 1 606 606 SER CB C 606 61.039 61.039 61.775 -0.736 18986 2474 1 6 . 1 1 606 606 SER H H 606 8.420 8.420 8.724 -0.304 18986 2475 1 6 . 1 1 607 607 GLY N N 607 110.716 110.716 110.024 0.692 18986 2476 1 6 . 1 1 607 607 GLY C C 607 171.173 171.173 173.935 -2.762 18986 2477 1 6 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.137 -2.496 18986 2478 1 6 . 1 1 607 607 GLY H H 607 8.386 8.386 8.046 0.340 18986 2479 1 6 . 1 1 608 608 LYS N N 608 120.785 120.785 126.240 -5.455 18986 2480 1 6 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.280 0.059 18986 2481 1 6 . 1 1 608 608 LYS C C 608 173.673 173.673 175.445 -1.772 18986 2482 1 6 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.249 -2.884 18986 2483 1 6 . 1 1 608 608 LYS CB C 608 30.531 30.531 31.643 -1.112 18986 2484 1 6 . 1 1 608 608 LYS H H 608 8.008 8.008 8.255 -0.247 18986 2485 1 6 . 1 1 609 609 ILE N N 609 122.404 122.404 126.514 -4.110 18986 2486 1 6 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.229 -0.080 18986 2487 1 6 . 1 1 609 609 ILE C C 609 172.675 172.675 174.712 -2.037 18986 2488 1 6 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.126 -2.123 18986 2489 1 6 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.821 -3.617 18986 2490 1 6 . 1 1 609 609 ILE H H 609 8.186 8.186 7.898 0.288 18986 2491 1 6 . 1 1 610 610 ASP N N 610 125.357 125.357 127.836 -2.479 18986 2492 1 6 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.720 -0.017 18986 2493 1 6 . 1 1 610 610 ASP C C 610 173.668 173.668 175.335 -1.667 18986 2494 1 6 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.798 -3.096 18986 2495 1 6 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.468 -2.777 18986 2496 1 6 . 1 1 610 610 ASP H H 610 8.369 8.369 8.218 0.151 18986 2497 1 6 . 1 1 611 611 ILE N N 611 122.494 122.494 119.319 3.175 18986 2498 1 6 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.045 -0.136 18986 2499 1 6 . 1 1 611 611 ILE C C 611 173.618 173.618 176.635 -3.017 18986 2500 1 6 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.023 -2.983 18986 2501 1 6 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.314 -2.516 18986 2502 1 6 . 1 1 611 611 ILE H H 611 8.284 8.284 8.064 0.220 18986 2503 1 6 . 1 1 612 612 ASP N N 612 121.440 121.440 120.088 1.352 18986 2504 1 6 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.418 0.016 18986 2505 1 6 . 1 1 612 612 ASP C C 612 175.129 175.129 178.402 -3.273 18986 2506 1 6 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.610 -3.844 18986 2507 1 6 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.339 -1.201 18986 2508 1 6 . 1 1 612 612 ASP H H 612 8.279 8.279 8.573 -0.294 18986 2509 1 6 . 1 1 613 613 THR N N 613 114.422 114.422 112.969 1.453 18986 2510 1 6 . 1 1 613 613 THR HA H 613 4.106 4.106 4.091 0.015 18986 2511 1 6 . 1 1 613 613 THR C C 613 173.338 173.338 175.541 -2.203 18986 2512 1 6 . 1 1 613 613 THR CA C 613 61.545 61.545 64.625 -3.080 18986 2513 1 6 . 1 1 613 613 THR CB C 613 66.267 66.267 68.644 -2.377 18986 2514 1 6 . 1 1 613 613 THR H H 613 7.866 7.866 8.166 -0.300 18986 2515 1 6 . 1 1 614 614 ILE N N 614 121.654 121.654 118.879 2.775 18986 2516 1 6 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.037 -0.008 18986 2517 1 6 . 1 1 614 614 ILE C C 614 174.471 174.471 178.112 -3.641 18986 2518 1 6 . 1 1 614 614 ILE CA C 614 60.173 60.173 62.222 -2.049 18986 2519 1 6 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.973 -2.158 18986 2520 1 6 . 1 1 614 614 ILE H H 614 7.819 7.819 7.379 0.440 18986 2521 1 6 . 1 1 615 615 MET N N 615 119.713 119.713 117.907 1.806 18986 2522 1 6 . 1 1 615 615 MET HA H 615 4.478 4.478 4.692 -0.214 18986 2523 1 6 . 1 1 615 615 MET C C 615 174.075 174.075 178.064 -3.989 18986 2524 1 6 . 1 1 615 615 MET CA C 615 52.764 52.764 57.579 -4.815 18986 2525 1 6 . 1 1 615 615 MET CB C 615 29.337 29.337 31.961 -2.624 18986 2526 1 6 . 1 1 615 615 MET H H 615 8.188 8.188 8.421 -0.233 18986 2527 1 6 . 1 1 616 616 THR N N 616 114.770 114.770 114.710 0.060 18986 2528 1 6 . 1 1 616 616 THR HA H 616 4.099 4.099 4.199 -0.100 18986 2529 1 6 . 1 1 616 616 THR C C 616 172.535 172.535 175.794 -3.259 18986 2530 1 6 . 1 1 616 616 THR CA C 616 61.112 61.112 65.161 -4.049 18986 2531 1 6 . 1 1 616 616 THR CB C 616 66.617 66.617 69.219 -2.602 18986 2532 1 6 . 1 1 616 616 THR H H 616 7.722 7.722 8.379 -0.657 18986 2533 1 6 . 1 1 617 617 GLY N N 617 111.384 111.384 107.443 3.941 18986 2534 1 6 . 1 1 617 617 GLY C C 617 171.437 171.437 173.700 -2.263 18986 2535 1 6 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.084 -2.642 18986 2536 1 6 . 1 1 617 617 GLY H H 617 8.431 8.431 7.838 0.593 18986 2537 1 6 . 1 1 618 618 LYS N N 618 120.996 120.996 120.925 0.071 18986 2538 1 6 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.848 -0.181 18986 2539 1 6 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.907 -2.079 18986 2540 1 6 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.649 -5.172 18986 2541 1 6 . 1 1 618 618 LYS H H 618 7.821 7.821 8.020 -0.199 18986 2542 1 6 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.575 -0.106 18986 2543 1 6 . 1 1 619 619 PRO C C 619 174.453 174.453 177.790 -3.337 18986 2544 1 6 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.630 -2.438 18986 2545 1 6 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.724 -3.144 18986 2546 1 6 . 1 1 620 620 LYS N N 620 123.464 123.464 121.448 2.016 18986 2547 1 6 . 1 1 620 620 LYS HA H 620 4.046 4.046 4.011 0.035 18986 2548 1 6 . 1 1 620 620 LYS C C 620 174.895 174.895 178.848 -3.953 18986 2549 1 6 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.284 -2.995 18986 2550 1 6 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.622 -1.168 18986 2551 1 6 . 1 1 620 620 LYS H H 620 8.728 8.728 8.720 0.007 18986 2552 1 6 . 1 1 621 621 SER N N 621 113.921 113.921 115.553 -1.632 18986 2553 1 6 . 1 1 621 621 SER HA H 621 4.336 4.336 4.174 0.162 18986 2554 1 6 . 1 1 621 621 SER C C 621 173.149 173.149 175.958 -2.809 18986 2555 1 6 . 1 1 621 621 SER CA C 621 56.691 56.691 60.697 -4.006 18986 2556 1 6 . 1 1 621 621 SER CB C 621 60.689 60.689 62.782 -2.093 18986 2557 1 6 . 1 1 621 621 SER H H 621 8.531 8.531 8.319 0.212 18986 2558 1 6 . 1 1 622 622 ALA N N 622 124.177 124.177 123.890 0.287 18986 2559 1 6 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.007 0.161 18986 2560 1 6 . 1 1 622 622 ALA C C 622 176.804 176.804 179.051 -2.247 18986 2561 1 6 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.126 -2.757 18986 2562 1 6 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.234 -2.380 18986 2563 1 6 . 1 1 622 622 ALA H H 622 7.835 7.835 8.168 -0.333 18986 2564 1 6 . 1 1 623 623 ARG N N 623 118.263 118.263 118.554 -0.291 18986 2565 1 6 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.953 -0.003 18986 2566 1 6 . 1 1 623 623 ARG C C 623 175.683 175.683 178.533 -2.850 18986 2567 1 6 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.125 -1.962 18986 2568 1 6 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.456 -2.005 18986 2569 1 6 . 1 1 623 623 ARG H H 623 8.148 8.148 8.199 -0.051 18986 2570 1 6 . 1 1 624 624 GLU N N 624 117.953 117.953 120.163 -2.210 18986 2571 1 6 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.077 -0.109 18986 2572 1 6 . 1 1 624 624 GLU C C 624 177.204 177.204 178.601 -1.397 18986 2573 1 6 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.119 -2.262 18986 2574 1 6 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.089 -2.122 18986 2575 1 6 . 1 1 624 624 GLU H H 624 8.143 8.143 8.298 -0.155 18986 2576 1 6 . 1 1 625 625 LYS N N 625 119.222 119.222 119.621 -0.399 18986 2577 1 6 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.223 -0.366 18986 2578 1 6 . 1 1 625 625 LYS C C 625 175.480 175.480 179.267 -3.787 18986 2579 1 6 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.306 -1.819 18986 2580 1 6 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.660 -1.996 18986 2581 1 6 . 1 1 625 625 LYS H H 625 7.772 7.772 7.958 -0.186 18986 2582 1 6 . 1 1 626 626 MET N N 626 117.883 117.883 119.502 -1.619 18986 2583 1 6 . 1 1 626 626 MET HA H 626 3.807 3.807 4.024 -0.217 18986 2584 1 6 . 1 1 626 626 MET C C 626 175.278 175.278 178.376 -3.098 18986 2585 1 6 . 1 1 626 626 MET CA C 626 57.782 57.782 59.700 -1.918 18986 2586 1 6 . 1 1 626 626 MET CB C 626 30.657 30.657 32.775 -2.118 18986 2587 1 6 . 1 1 626 626 MET H H 626 8.367 8.367 8.538 -0.171 18986 2588 1 6 . 1 1 627 627 MET N N 627 116.185 116.185 117.434 -1.249 18986 2589 1 6 . 1 1 627 627 MET HA H 627 4.152 4.152 4.150 0.002 18986 2590 1 6 . 1 1 627 627 MET C C 627 176.393 176.393 178.282 -1.889 18986 2591 1 6 . 1 1 627 627 MET CA C 627 55.359 55.359 58.012 -2.653 18986 2592 1 6 . 1 1 627 627 MET CB C 627 28.803 28.803 31.256 -2.453 18986 2593 1 6 . 1 1 627 627 MET H H 627 8.197 8.197 8.543 -0.346 18986 2594 1 6 . 1 1 628 628 LYS N N 628 119.859 119.859 120.484 -0.625 18986 2595 1 6 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.200 -0.000 18986 2596 1 6 . 1 1 628 628 LYS C C 628 175.885 175.885 179.485 -3.600 18986 2597 1 6 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.382 -4.305 18986 2598 1 6 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.282 -3.751 18986 2599 1 6 . 1 1 628 628 LYS H H 628 7.700 7.700 7.424 0.276 18986 2600 1 6 . 1 1 629 629 ILE N N 629 119.001 119.001 119.720 -0.719 18986 2601 1 6 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.636 -0.088 18986 2602 1 6 . 1 1 629 629 ILE C C 629 174.891 174.891 178.353 -3.462 18986 2603 1 6 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.582 -3.317 18986 2604 1 6 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.941 -4.092 18986 2605 1 6 . 1 1 629 629 ILE H H 629 7.970 7.970 7.951 0.019 18986 2606 1 6 . 1 1 630 630 ILE N N 630 120.737 120.737 116.835 3.902 18986 2607 1 6 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.675 -0.208 18986 2608 1 6 . 1 1 630 630 ILE C C 630 173.875 173.875 177.724 -3.849 18986 2609 1 6 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.670 -1.916 18986 2610 1 6 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.967 -2.690 18986 2611 1 6 . 1 1 630 630 ILE H H 630 8.213 8.213 8.020 0.193 18986 2612 1 6 . 1 1 631 631 GLU N N 631 119.546 119.546 121.187 -1.641 18986 2613 1 6 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.035 0.030 18986 2614 1 6 . 1 1 631 631 GLU C C 631 177.300 177.300 178.989 -1.689 18986 2615 1 6 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.826 -2.846 18986 2616 1 6 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.654 -2.661 18986 2617 1 6 . 1 1 631 631 GLU H H 631 7.742 7.742 7.843 -0.101 18986 2618 1 6 . 1 1 632 632 ILE N N 632 121.547 121.547 120.180 1.367 18986 2619 1 6 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.800 -0.117 18986 2620 1 6 . 1 1 632 632 ILE C C 632 175.454 175.454 177.946 -2.492 18986 2621 1 6 . 1 1 632 632 ILE CA C 632 62.656 62.656 63.497 -0.841 18986 2622 1 6 . 1 1 632 632 ILE CB C 632 35.830 35.830 36.333 -0.503 18986 2623 1 6 . 1 1 632 632 ILE H H 632 8.013 8.013 8.196 -0.183 18986 2624 1 6 . 1 1 633 633 ILE N N 633 121.605 121.605 121.046 0.559 18986 2625 1 6 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.551 -0.216 18986 2626 1 6 . 1 1 633 633 ILE C C 633 174.558 174.558 177.993 -3.435 18986 2627 1 6 . 1 1 633 633 ILE CA C 633 63.919 63.919 66.065 -2.146 18986 2628 1 6 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.303 -2.019 18986 2629 1 6 . 1 1 633 633 ILE H H 633 8.594 8.594 8.062 0.532 18986 2630 1 6 . 1 1 634 634 ASP N N 634 118.706 118.706 121.104 -2.398 18986 2631 1 6 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.363 0.072 18986 2632 1 6 . 1 1 634 634 ASP C C 634 176.574 176.574 178.479 -1.905 18986 2633 1 6 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.574 -3.003 18986 2634 1 6 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.913 -2.998 18986 2635 1 6 . 1 1 634 634 ASP H H 634 8.724 8.724 8.501 0.223 18986 2636 1 6 . 1 1 635 635 SER N N 635 114.064 114.064 114.816 -0.752 18986 2637 1 6 . 1 1 635 635 SER HA H 635 4.232 4.232 4.312 -0.080 18986 2638 1 6 . 1 1 635 635 SER C C 635 174.487 174.487 175.995 -1.508 18986 2639 1 6 . 1 1 635 635 SER CA C 635 58.540 58.540 61.726 -3.186 18986 2640 1 6 . 1 1 635 635 SER CB C 635 60.319 60.319 63.343 -3.025 18986 2641 1 6 . 1 1 635 635 SER H H 635 7.992 7.992 8.056 -0.064 18986 2642 1 6 . 1 1 636 636 LEU N N 636 122.493 122.493 121.116 1.377 18986 2643 1 6 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.266 -0.012 18986 2644 1 6 . 1 1 636 636 LEU C C 636 176.194 176.194 178.314 -2.120 18986 2645 1 6 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.397 -3.302 18986 2646 1 6 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.099 -2.393 18986 2647 1 6 . 1 1 636 636 LEU H H 636 8.169 8.169 8.079 0.090 18986 2648 1 6 . 1 1 637 637 ALA N N 637 121.891 121.891 122.710 -0.819 18986 2649 1 6 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.360 -0.271 18986 2650 1 6 . 1 1 637 637 ALA C C 637 175.131 175.131 180.365 -5.234 18986 2651 1 6 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.594 -4.258 18986 2652 1 6 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.481 -2.993 18986 2653 1 6 . 1 1 637 637 ALA H H 637 8.482 8.482 8.582 -0.100 18986 2654 1 6 . 1 1 638 638 VAL N N 638 117.140 117.140 118.009 -0.869 18986 2655 1 6 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.892 0.043 18986 2656 1 6 . 1 1 638 638 VAL C C 638 174.712 174.712 176.275 -1.563 18986 2657 1 6 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.358 -2.357 18986 2658 1 6 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.256 -1.905 18986 2659 1 6 . 1 1 638 638 VAL H H 638 7.291 7.291 8.509 -1.218 18986 2660 1 6 . 1 1 639 639 SER N N 639 114.143 114.143 113.600 0.543 18986 2661 1 6 . 1 1 639 639 SER HA H 639 4.481 4.481 4.574 -0.093 18986 2662 1 6 . 1 1 639 639 SER C C 639 172.122 172.122 173.416 -1.294 18986 2663 1 6 . 1 1 639 639 SER CA C 639 56.002 56.002 57.772 -1.770 18986 2664 1 6 . 1 1 639 639 SER CB C 639 60.921 60.921 63.793 -2.872 18986 2665 1 6 . 1 1 639 639 SER H H 639 7.918 7.918 8.081 -0.163 18986 2666 1 6 . 1 1 640 640 SER N N 640 115.370 115.370 115.741 -0.371 18986 2667 1 6 . 1 1 640 640 SER HA H 640 4.711 4.711 4.609 0.102 18986 2668 1 6 . 1 1 640 640 SER C C 640 171.185 171.185 174.124 -2.939 18986 2669 1 6 . 1 1 640 640 SER CA C 640 55.009 55.009 57.560 -2.551 18986 2670 1 6 . 1 1 640 640 SER CB C 640 61.974 61.974 65.205 -3.231 18986 2671 1 6 . 1 1 640 640 SER H H 640 7.765 7.765 7.383 0.382 18986 2672 1 6 . 1 1 641 641 GLU N N 641 119.994 119.994 122.424 -2.430 18986 2673 1 6 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.107 -0.063 18986 2674 1 6 . 1 1 641 641 GLU C C 641 173.167 173.167 175.727 -2.560 18986 2675 1 6 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.664 -3.013 18986 2676 1 6 . 1 1 641 641 GLU CB C 641 27.484 27.484 30.270 -2.785 18986 2677 1 6 . 1 1 641 641 GLU H H 641 8.363 8.363 8.861 -0.498 18986 2678 1 6 . 1 1 642 642 CYS N N 642 110.257 110.257 113.870 -3.613 18986 2679 1 6 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.756 -0.297 18986 2680 1 6 . 1 1 642 642 CYS C C 642 168.058 168.058 173.263 -5.205 18986 2681 1 6 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.847 -4.901 18986 2682 1 6 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.546 9.815 18986 2683 1 6 . 1 1 642 642 CYS H H 642 7.881 7.881 7.782 0.099 18986 2684 1 6 . 1 1 643 643 ALA N N 643 123.922 123.922 123.964 -0.042 18986 2685 1 6 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.416 0.222 18986 2686 1 6 . 1 1 643 643 ALA C C 643 172.517 172.517 176.663 -4.146 18986 2687 1 6 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.092 -3.471 18986 2688 1 6 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.785 -0.341 18986 2689 1 6 . 1 1 643 643 ALA H H 643 9.787 9.787 8.987 0.800 18986 2690 1 6 . 1 1 644 644 LYS N N 644 128.479 128.479 126.451 2.028 18986 2691 1 6 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.479 0.032 18986 2692 1 6 . 1 1 644 644 LYS C C 644 176.945 176.945 177.521 -0.576 18986 2693 1 6 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.106 -1.768 18986 2694 1 6 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.224 -1.282 18986 2695 1 6 . 1 1 644 644 LYS H H 644 9.809 9.809 8.904 0.905 18986 2696 1 6 . 1 1 645 645 VAL N N 645 124.257 124.257 127.231 -2.974 18986 2697 1 6 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.643 0.005 18986 2698 1 6 . 1 1 645 645 VAL C C 645 173.996 173.996 176.724 -2.728 18986 2699 1 6 . 1 1 645 645 VAL CA C 645 64.862 64.862 64.901 -0.039 18986 2700 1 6 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.747 -2.546 18986 2701 1 6 . 1 1 645 645 VAL H H 645 8.458 8.458 9.235 -0.777 18986 2702 1 6 . 1 1 646 646 LYS N N 646 117.598 117.598 120.102 -2.504 18986 2703 1 6 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.928 0.079 18986 2704 1 6 . 1 1 646 646 LYS C C 646 176.047 176.047 178.485 -2.438 18986 2705 1 6 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.383 -3.138 18986 2706 1 6 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.910 -2.512 18986 2707 1 6 . 1 1 646 646 LYS H H 646 8.706 8.706 8.367 0.339 18986 2708 1 6 . 1 1 647 647 ASP N N 647 119.229 119.229 120.173 -0.944 18986 2709 1 6 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.462 0.156 18986 2710 1 6 . 1 1 647 647 ASP C C 647 175.211 175.211 178.266 -3.055 18986 2711 1 6 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.265 -2.942 18986 2712 1 6 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.829 -2.091 18986 2713 1 6 . 1 1 647 647 ASP H H 647 7.012 7.012 7.933 -0.921 18986 2714 1 6 . 1 1 648 648 ILE N N 648 121.939 121.939 120.566 1.373 18986 2715 1 6 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.624 -0.243 18986 2716 1 6 . 1 1 648 648 ILE C C 648 175.243 175.243 177.986 -2.743 18986 2717 1 6 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.296 -2.255 18986 2718 1 6 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.899 -1.937 18986 2719 1 6 . 1 1 648 648 ILE H H 648 8.152 8.152 7.859 0.293 18986 2720 1 6 . 1 1 649 649 LEU N N 649 117.310 117.310 120.129 -2.819 18986 2721 1 6 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.757 0.116 18986 2722 1 6 . 1 1 649 649 LEU C C 649 176.439 176.439 178.815 -2.376 18986 2723 1 6 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.641 -2.756 18986 2724 1 6 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.338 -2.032 18986 2725 1 6 . 1 1 649 649 LEU H H 649 8.638 8.638 8.666 -0.028 18986 2726 1 6 . 1 1 650 650 LYS N N 650 118.810 118.810 119.621 -0.811 18986 2727 1 6 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.877 0.169 18986 2728 1 6 . 1 1 650 650 LYS C C 650 176.801 176.801 178.573 -1.772 18986 2729 1 6 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.965 -2.914 18986 2730 1 6 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.417 -2.353 18986 2731 1 6 . 1 1 650 650 LYS H H 650 7.296 7.296 7.896 -0.600 18986 2732 1 6 . 1 1 651 651 GLU N N 651 117.713 117.713 118.902 -1.189 18986 2733 1 6 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.027 0.081 18986 2734 1 6 . 1 1 651 651 GLU C C 651 176.903 176.903 178.979 -2.076 18986 2735 1 6 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.120 -3.310 18986 2736 1 6 . 1 1 651 651 GLU CB C 651 27.448 27.448 28.776 -1.329 18986 2737 1 6 . 1 1 651 651 GLU H H 651 8.036 8.036 8.431 -0.395 18986 2738 1 6 . 1 1 652 652 ALA N N 652 121.206 121.206 121.733 -0.527 18986 2739 1 6 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.074 -0.076 18986 2740 1 6 . 1 1 652 652 ALA C C 652 176.766 176.766 179.998 -3.232 18986 2741 1 6 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.032 -3.298 18986 2742 1 6 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.156 -2.840 18986 2743 1 6 . 1 1 652 652 ALA H H 652 8.973 8.973 8.537 0.436 18986 2744 1 6 . 1 1 653 653 GLN N N 653 117.768 117.768 117.752 0.016 18986 2745 1 6 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.309 0.168 18986 2746 1 6 . 1 1 653 653 GLN C C 653 177.388 177.388 178.809 -1.421 18986 2747 1 6 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.275 -2.215 18986 2748 1 6 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.762 -1.993 18986 2749 1 6 . 1 1 653 653 GLN H H 653 8.059 8.059 8.011 0.048 18986 2750 1 6 . 1 1 654 654 GLN N N 654 117.979 117.979 118.472 -0.493 18986 2751 1 6 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.113 0.064 18986 2752 1 6 . 1 1 654 654 GLN C C 654 174.834 174.834 178.117 -3.283 18986 2753 1 6 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.075 -2.657 18986 2754 1 6 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.475 -2.498 18986 2755 1 6 . 1 1 654 654 GLN H H 654 7.495 7.495 7.825 -0.330 18986 2756 1 6 . 1 1 655 655 VAL N N 655 110.080 110.080 117.577 -7.497 18986 2757 1 6 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.891 0.636 18986 2758 1 6 . 1 1 655 655 VAL C C 655 173.369 173.369 177.298 -3.929 18986 2759 1 6 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.270 -6.203 18986 2760 1 6 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.231 -4.047 18986 2761 1 6 . 1 1 655 655 VAL H H 655 7.197 7.197 8.040 -0.843 18986 2762 1 6 . 1 1 656 656 GLY N N 656 107.089 107.089 106.017 1.072 18986 2763 1 6 . 1 1 656 656 GLY C C 656 171.639 171.639 174.898 -3.259 18986 2764 1 6 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.760 -1.449 18986 2765 1 6 . 1 1 656 656 GLY H H 656 7.541 7.541 7.818 -0.277 18986 2766 1 6 . 1 1 657 657 ILE N N 657 121.266 121.266 120.383 0.883 18986 2767 1 6 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.134 -0.000 18986 2768 1 6 . 1 1 657 657 ILE C C 657 171.885 171.885 175.310 -3.425 18986 2769 1 6 . 1 1 657 657 ILE CA C 657 58.230 58.230 58.908 -0.678 18986 2770 1 6 . 1 1 657 657 ILE CB C 657 35.191 35.191 38.212 -3.021 18986 2771 1 6 . 1 1 657 657 ILE H H 657 7.633 7.633 8.088 -0.455 18986 2772 1 6 . 1 1 658 658 GLU N N 658 127.252 127.252 120.732 6.520 18986 2773 1 6 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.542 -0.339 18986 2774 1 6 . 1 1 658 658 GLU C C 658 175.316 175.316 177.000 -1.684 18986 2775 1 6 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.611 -0.251 18986 2776 1 6 . 1 1 658 658 GLU CB C 658 27.610 27.610 32.718 -5.108 18986 2777 1 6 . 1 1 658 658 GLU H H 658 8.690 8.690 8.191 0.499 18986 2778 1 6 . 1 1 659 659 LYS N N 659 124.533 124.533 125.927 -1.394 18986 2779 1 6 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.754 0.034 18986 2780 1 6 . 1 1 659 659 LYS C C 659 175.170 175.170 177.876 -2.706 18986 2781 1 6 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.525 -2.354 18986 2782 1 6 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.377 -2.260 18986 2783 1 6 . 1 1 659 659 LYS H H 659 8.706 8.706 8.707 -0.001 18986 2784 1 6 . 1 1 660 660 SER N N 660 113.137 113.137 113.137 0.000 18986 2785 1 6 . 1 1 660 660 SER HA H 660 4.273 4.273 4.473 -0.200 18986 2786 1 6 . 1 1 660 660 SER C C 660 173.939 173.939 176.699 -2.760 18986 2787 1 6 . 1 1 660 660 SER CA C 660 58.350 58.350 61.503 -3.153 18986 2788 1 6 . 1 1 660 660 SER CB C 660 59.504 59.504 63.177 -3.673 18986 2789 1 6 . 1 1 660 660 SER H H 660 8.777 8.777 8.656 0.121 18986 2790 1 6 . 1 1 661 661 ASN N N 661 119.986 119.986 121.162 -1.176 18986 2791 1 6 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.425 0.281 18986 2792 1 6 . 1 1 661 661 ASN C C 661 174.516 174.516 177.242 -2.726 18986 2793 1 6 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.512 -4.464 18986 2794 1 6 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.573 -1.830 18986 2795 1 6 . 1 1 661 661 ASN H H 661 7.486 7.486 8.652 -1.166 18986 2796 1 6 . 1 1 662 662 ILE N N 662 120.639 120.639 119.898 0.741 18986 2797 1 6 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.755 -0.309 18986 2798 1 6 . 1 1 662 662 ILE C C 662 174.252 174.252 177.977 -3.725 18986 2799 1 6 . 1 1 662 662 ILE CA C 662 62.606 62.606 63.732 -1.126 18986 2800 1 6 . 1 1 662 662 ILE CB C 662 34.423 34.423 36.830 -2.407 18986 2801 1 6 . 1 1 662 662 ILE H H 662 7.999 7.999 8.143 -0.144 18986 2802 1 6 . 1 1 663 663 GLU N N 663 117.706 117.706 120.674 -2.968 18986 2803 1 6 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.885 -0.095 18986 2804 1 6 . 1 1 663 663 GLU C C 663 176.509 176.509 179.179 -2.670 18986 2805 1 6 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.401 -2.693 18986 2806 1 6 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.377 -2.622 18986 2807 1 6 . 1 1 663 663 GLU H H 663 8.190 8.190 8.251 -0.061 18986 2808 1 6 . 1 1 664 664 LYS N N 664 119.586 119.586 120.113 -0.527 18986 2809 1 6 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.069 -0.016 18986 2810 1 6 . 1 1 664 664 LYS C C 664 175.941 175.941 178.940 -2.999 18986 2811 1 6 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.224 -2.643 18986 2812 1 6 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.193 -2.370 18986 2813 1 6 . 1 1 664 664 LYS H H 664 7.590 7.590 8.249 -0.659 18986 2814 1 6 . 1 1 665 665 LEU N N 665 119.756 119.756 122.013 -2.257 18986 2815 1 6 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.916 0.164 18986 2816 1 6 . 1 1 665 665 LEU C C 665 176.700 176.700 179.103 -2.403 18986 2817 1 6 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.107 -2.722 18986 2818 1 6 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.781 -2.589 18986 2819 1 6 . 1 1 665 665 LEU H H 665 8.075 8.075 8.419 -0.344 18986 2820 1 6 . 1 1 666 666 LEU N N 666 118.788 118.788 118.328 0.460 18986 2821 1 6 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.803 -0.039 18986 2822 1 6 . 1 1 666 666 LEU C C 666 176.484 176.484 179.309 -2.825 18986 2823 1 6 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.347 -2.689 18986 2824 1 6 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.467 -1.856 18986 2825 1 6 . 1 1 666 666 LEU H H 666 8.550 8.550 8.472 0.078 18986 2826 1 6 . 1 1 667 667 THR N N 667 115.244 115.244 116.338 -1.094 18986 2827 1 6 . 1 1 667 667 THR HA H 667 3.839 3.839 4.004 -0.165 18986 2828 1 6 . 1 1 667 667 THR C C 667 173.740 173.740 176.102 -2.362 18986 2829 1 6 . 1 1 667 667 THR CA C 667 64.378 64.378 67.947 -3.569 18986 2830 1 6 . 1 1 667 667 THR CB C 667 65.748 65.748 68.209 -2.461 18986 2831 1 6 . 1 1 667 667 THR H H 667 7.662 7.662 8.209 -0.547 18986 2832 1 6 . 1 1 668 668 ASP N N 668 122.862 122.862 122.257 0.605 18986 2833 1 6 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.362 0.021 18986 2834 1 6 . 1 1 668 668 ASP C C 668 177.192 177.192 178.383 -1.191 18986 2835 1 6 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.371 -2.240 18986 2836 1 6 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.920 -3.034 18986 2837 1 6 . 1 1 668 668 ASP H H 668 8.291 8.291 8.341 -0.050 18986 2838 1 6 . 1 1 669 669 MET N N 669 119.640 119.640 118.416 1.224 18986 2839 1 6 . 1 1 669 669 MET HA H 669 3.917 3.917 4.033 -0.116 18986 2840 1 6 . 1 1 669 669 MET C C 669 175.414 175.414 178.711 -3.297 18986 2841 1 6 . 1 1 669 669 MET CA C 669 57.234 57.234 59.579 -2.345 18986 2842 1 6 . 1 1 669 669 MET CB C 669 32.088 32.088 32.531 -0.443 18986 2843 1 6 . 1 1 669 669 MET H H 669 8.809 8.809 8.512 0.297 18986 2844 1 6 . 1 1 670 670 ARG N N 670 122.614 122.614 118.053 4.561 18986 2845 1 6 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.544 -0.027 18986 2846 1 6 . 1 1 670 670 ARG C C 670 177.928 177.928 179.225 -1.297 18986 2847 1 6 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.613 -2.391 18986 2848 1 6 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.963 -2.659 18986 2849 1 6 . 1 1 670 670 ARG H H 670 8.450 8.450 8.551 -0.101 18986 2850 1 6 . 1 1 671 671 LYS N N 671 121.976 121.976 119.523 2.453 18986 2851 1 6 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.231 -0.118 18986 2852 1 6 . 1 1 671 671 LYS C C 671 176.143 176.143 178.435 -2.292 18986 2853 1 6 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.400 -1.314 18986 2854 1 6 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.726 -3.222 18986 2855 1 6 . 1 1 671 671 LYS H H 671 8.609 8.609 8.282 0.327 18986 2856 1 6 . 1 1 672 672 SER N N 672 111.655 111.655 114.073 -2.418 18986 2857 1 6 . 1 1 672 672 SER HA H 672 4.469 4.469 4.435 0.034 18986 2858 1 6 . 1 1 672 672 SER C C 672 171.692 171.692 175.667 -3.975 18986 2859 1 6 . 1 1 672 672 SER CA C 672 56.790 56.790 59.602 -2.812 18986 2860 1 6 . 1 1 672 672 SER CB C 672 61.343 61.343 64.305 -2.962 18986 2861 1 6 . 1 1 672 672 SER H H 672 7.884 7.884 8.228 -0.344 18986 2862 1 6 . 1 1 673 673 GLY N N 673 108.029 108.029 107.995 0.034 18986 2863 1 6 . 1 1 673 673 GLY C C 673 171.492 171.492 175.076 -3.584 18986 2864 1 6 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.249 -1.974 18986 2865 1 6 . 1 1 673 673 GLY H H 673 7.774 7.774 8.190 -0.416 18986 2866 1 6 . 1 1 674 674 ILE N N 674 116.193 116.193 119.475 -3.282 18986 2867 1 6 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.984 0.117 18986 2868 1 6 . 1 1 674 674 ILE C C 674 173.980 173.980 175.606 -1.626 18986 2869 1 6 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.603 -3.361 18986 2870 1 6 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.603 -1.800 18986 2871 1 6 . 1 1 674 674 ILE H H 674 8.026 8.026 8.304 -0.278 18986 2872 1 6 . 1 1 675 675 ILE N N 675 108.928 108.928 113.265 -4.337 18986 2873 1 6 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.909 0.449 18986 2874 1 6 . 1 1 675 675 ILE C C 675 170.797 170.797 174.109 -3.312 18986 2875 1 6 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.506 -2.482 18986 2876 1 6 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.104 -2.618 18986 2877 1 6 . 1 1 675 675 ILE H H 675 7.120 7.120 7.445 -0.325 18986 2878 1 6 . 1 1 676 676 TYR N N 676 118.062 118.062 115.285 2.777 18986 2879 1 6 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.004 -0.009 18986 2880 1 6 . 1 1 676 676 TYR C C 676 170.020 170.020 173.805 -3.785 18986 2881 1 6 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.864 -2.971 18986 2882 1 6 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.976 -2.460 18986 2883 1 6 . 1 1 676 676 TYR H H 676 9.380 9.380 8.545 0.835 18986 2884 1 6 . 1 1 677 677 GLU N N 677 123.578 123.578 122.758 0.820 18986 2885 1 6 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.911 -0.085 18986 2886 1 6 . 1 1 677 677 GLU C C 677 172.146 172.146 175.805 -3.659 18986 2887 1 6 . 1 1 677 677 GLU CA C 677 52.476 52.476 54.639 -2.163 18986 2888 1 6 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.272 -1.660 18986 2889 1 6 . 1 1 677 677 GLU H H 677 8.951 8.951 8.985 -0.034 18986 2890 1 6 . 1 1 678 678 ALA N N 678 133.220 133.220 128.505 4.715 18986 2891 1 6 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.213 -0.172 18986 2892 1 6 . 1 1 678 678 ALA C C 678 175.219 175.219 177.591 -2.372 18986 2893 1 6 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.899 -2.298 18986 2894 1 6 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.522 -2.923 18986 2895 1 6 . 1 1 678 678 ALA H H 678 7.912 7.912 8.169 -0.257 18986 2896 1 6 . 1 1 679 679 LYS N N 679 115.687 115.687 115.108 0.579 18986 2897 1 6 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.777 -0.342 18986 2898 1 6 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.991 -1.975 18986 2899 1 6 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.727 -3.732 18986 2900 1 6 . 1 1 679 679 LYS H H 679 8.215 8.215 7.759 0.456 18986 2901 1 6 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.202 -0.183 18986 2902 1 6 . 1 1 680 680 PRO C C 680 174.504 174.504 177.005 -2.501 18986 2903 1 6 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.149 -1.631 18986 2904 1 6 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.728 -3.413 18986 2905 1 6 . 1 1 681 681 GLU N N 681 118.851 118.851 117.435 1.416 18986 2906 1 6 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.034 -0.596 18986 2907 1 6 . 1 1 681 681 GLU C C 681 172.890 172.890 175.454 -2.564 18986 2908 1 6 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.617 -4.136 18986 2909 1 6 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.977 -4.188 18986 2910 1 6 . 1 1 681 681 GLU H H 681 10.003 10.003 8.739 1.264 18986 2911 1 6 . 1 1 682 682 CYS N N 682 120.934 120.934 118.784 2.150 18986 2912 1 6 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.169 -0.142 18986 2913 1 6 . 1 1 682 682 CYS C C 682 171.905 171.905 173.284 -1.379 18986 2914 1 6 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.862 -3.618 18986 2915 1 6 . 1 1 682 682 CYS CB C 682 45.295 45.295 29.339 15.956 18986 2916 1 6 . 1 1 682 682 CYS H H 682 7.860 7.860 7.942 -0.082 18986 2917 1 6 . 1 1 683 683 TYR N N 683 126.183 126.183 124.902 1.281 18986 2918 1 6 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.342 -0.118 18986 2919 1 6 . 1 1 683 683 TYR C C 683 173.008 173.008 174.811 -1.803 18986 2920 1 6 . 1 1 683 683 TYR CA C 683 56.568 56.568 56.213 0.355 18986 2921 1 6 . 1 1 683 683 TYR CB C 683 40.952 40.952 41.771 -0.819 18986 2922 1 6 . 1 1 683 683 TYR H H 683 9.297 9.297 9.385 -0.088 18986 2923 1 6 . 1 1 684 684 LYS N N 684 118.604 118.604 119.579 -0.975 18986 2924 1 6 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.707 -0.270 18986 2925 1 6 . 1 1 684 684 LYS C C 684 171.628 171.628 174.952 -3.324 18986 2926 1 6 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.345 -2.042 18986 2927 1 6 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.337 -1.660 18986 2928 1 6 . 1 1 684 684 LYS H H 684 8.630 8.630 8.925 -0.295 18986 2929 1 6 . 1 1 685 685 LYS N N 685 122.869 122.869 124.305 -1.436 18986 2930 1 6 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.370 0.274 18986 2931 1 6 . 1 1 685 685 LYS C C 685 173.337 173.337 175.323 -1.986 18986 2932 1 6 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.188 -1.935 18986 2933 1 6 . 1 1 685 685 LYS CB C 685 30.927 30.927 33.576 -2.649 18986 2934 1 6 . 1 1 685 685 LYS H H 685 8.969 8.969 8.448 0.521 18986 2935 1 7 . 1 1 601 601 SER HA H 601 4.475 4.475 4.444 0.031 18986 2936 1 7 . 1 1 601 601 SER CA C 601 55.508 55.508 58.308 -2.800 18986 2937 1 7 . 1 1 601 601 SER CB C 601 61.220 61.220 64.117 -2.897 18986 2938 1 7 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.741 -0.125 18986 2939 1 7 . 1 1 602 602 HIS C C 602 172.320 172.320 174.359 -2.039 18986 2940 1 7 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.482 -2.628 18986 2941 1 7 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.776 -2.693 18986 2942 1 7 . 1 1 603 603 MET N N 603 121.862 121.862 117.436 4.426 18986 2943 1 7 . 1 1 603 603 MET HA H 603 4.425 4.425 4.871 -0.446 18986 2944 1 7 . 1 1 603 603 MET C C 603 173.948 173.948 176.052 -2.104 18986 2945 1 7 . 1 1 603 603 MET CA C 603 53.108 53.108 55.094 -1.986 18986 2946 1 7 . 1 1 603 603 MET CB C 603 30.049 30.049 36.293 -6.244 18986 2947 1 7 . 1 1 603 603 MET H H 603 8.394 8.394 8.033 0.361 18986 2948 1 7 . 1 1 604 604 GLY N N 604 110.382 110.382 107.062 3.320 18986 2949 1 7 . 1 1 604 604 GLY C C 604 171.590 171.590 174.306 -2.716 18986 2950 1 7 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.590 -2.973 18986 2951 1 7 . 1 1 604 604 GLY H H 604 8.411 8.411 8.588 -0.177 18986 2952 1 7 . 1 1 605 605 GLU N N 605 120.709 120.709 118.833 1.876 18986 2953 1 7 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.718 -0.411 18986 2954 1 7 . 1 1 605 605 GLU C C 605 174.220 174.220 175.290 -1.070 18986 2955 1 7 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.843 -1.877 18986 2956 1 7 . 1 1 605 605 GLU CB C 605 27.611 27.611 31.765 -4.154 18986 2957 1 7 . 1 1 605 605 GLU H H 605 8.282 8.282 8.156 0.126 18986 2958 1 7 . 1 1 606 606 SER N N 606 116.679 116.679 114.755 1.924 18986 2959 1 7 . 1 1 606 606 SER HA H 606 4.405 4.405 4.649 -0.244 18986 2960 1 7 . 1 1 606 606 SER C C 606 172.455 172.455 174.088 -1.633 18986 2961 1 7 . 1 1 606 606 SER CA C 606 56.028 56.028 58.232 -2.204 18986 2962 1 7 . 1 1 606 606 SER CB C 606 61.039 61.039 64.983 -3.944 18986 2963 1 7 . 1 1 606 606 SER H H 606 8.420 8.420 8.404 0.016 18986 2964 1 7 . 1 1 607 607 GLY N N 607 110.716 110.716 111.885 -1.169 18986 2965 1 7 . 1 1 607 607 GLY C C 607 171.173 171.173 173.350 -2.177 18986 2966 1 7 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.121 -2.480 18986 2967 1 7 . 1 1 607 607 GLY H H 607 8.386 8.386 8.702 -0.316 18986 2968 1 7 . 1 1 608 608 LYS N N 608 120.785 120.785 118.292 2.493 18986 2969 1 7 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.430 -0.091 18986 2970 1 7 . 1 1 608 608 LYS C C 608 173.673 173.673 176.301 -2.628 18986 2971 1 7 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.334 -2.969 18986 2972 1 7 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.773 -2.242 18986 2973 1 7 . 1 1 608 608 LYS H H 608 8.008 8.008 8.315 -0.307 18986 2974 1 7 . 1 1 609 609 ILE N N 609 122.404 122.404 123.412 -1.008 18986 2975 1 7 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.146 0.003 18986 2976 1 7 . 1 1 609 609 ILE C C 609 172.675 172.675 176.109 -3.434 18986 2977 1 7 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.340 -2.337 18986 2978 1 7 . 1 1 609 609 ILE CB C 609 36.204 36.204 37.311 -1.107 18986 2979 1 7 . 1 1 609 609 ILE H H 609 8.186 8.186 7.813 0.373 18986 2980 1 7 . 1 1 610 610 ASP N N 610 125.357 125.357 128.440 -3.083 18986 2981 1 7 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.649 0.054 18986 2982 1 7 . 1 1 610 610 ASP C C 610 173.668 173.668 176.209 -2.541 18986 2983 1 7 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.839 -3.137 18986 2984 1 7 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.425 -2.736 18986 2985 1 7 . 1 1 610 610 ASP H H 610 8.369 8.369 8.244 0.125 18986 2986 1 7 . 1 1 611 611 ILE N N 611 122.494 122.494 120.108 2.386 18986 2987 1 7 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.898 0.011 18986 2988 1 7 . 1 1 611 611 ILE C C 611 173.618 173.618 176.817 -3.199 18986 2989 1 7 . 1 1 611 611 ILE CA C 611 60.040 60.040 64.078 -4.038 18986 2990 1 7 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.070 -2.272 18986 2991 1 7 . 1 1 611 611 ILE H H 611 8.284 8.284 7.997 0.287 18986 2992 1 7 . 1 1 612 612 ASP N N 612 121.440 121.440 120.410 1.030 18986 2993 1 7 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.387 0.047 18986 2994 1 7 . 1 1 612 612 ASP C C 612 175.129 175.129 178.198 -3.069 18986 2995 1 7 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.070 -4.304 18986 2996 1 7 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.644 -1.506 18986 2997 1 7 . 1 1 612 612 ASP H H 612 8.279 8.279 8.423 -0.144 18986 2998 1 7 . 1 1 613 613 THR N N 613 114.422 114.422 113.006 1.416 18986 2999 1 7 . 1 1 613 613 THR HA H 613 4.106 4.106 4.122 -0.016 18986 3000 1 7 . 1 1 613 613 THR C C 613 173.338 173.338 175.381 -2.043 18986 3001 1 7 . 1 1 613 613 THR CA C 613 61.545 61.545 64.929 -3.384 18986 3002 1 7 . 1 1 613 613 THR CB C 613 66.267 66.267 68.535 -2.268 18986 3003 1 7 . 1 1 613 613 THR H H 613 7.866 7.866 8.271 -0.405 18986 3004 1 7 . 1 1 614 614 ILE N N 614 121.654 121.654 120.820 0.834 18986 3005 1 7 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.072 -0.043 18986 3006 1 7 . 1 1 614 614 ILE C C 614 174.471 174.471 177.748 -3.277 18986 3007 1 7 . 1 1 614 614 ILE CA C 614 60.173 60.173 62.732 -2.559 18986 3008 1 7 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.414 -1.599 18986 3009 1 7 . 1 1 614 614 ILE H H 614 7.819 7.819 7.714 0.105 18986 3010 1 7 . 1 1 615 615 MET N N 615 119.713 119.713 117.639 2.074 18986 3011 1 7 . 1 1 615 615 MET HA H 615 4.478 4.478 4.707 -0.229 18986 3012 1 7 . 1 1 615 615 MET C C 615 174.075 174.075 177.994 -3.919 18986 3013 1 7 . 1 1 615 615 MET CA C 615 52.764 52.764 56.676 -3.913 18986 3014 1 7 . 1 1 615 615 MET CB C 615 29.337 29.337 31.657 -2.320 18986 3015 1 7 . 1 1 615 615 MET H H 615 8.188 8.188 8.258 -0.070 18986 3016 1 7 . 1 1 616 616 THR N N 616 114.770 114.770 114.525 0.245 18986 3017 1 7 . 1 1 616 616 THR HA H 616 4.099 4.099 4.226 -0.127 18986 3018 1 7 . 1 1 616 616 THR C C 616 172.535 172.535 175.805 -3.270 18986 3019 1 7 . 1 1 616 616 THR CA C 616 61.112 61.112 64.148 -3.036 18986 3020 1 7 . 1 1 616 616 THR CB C 616 66.617 66.617 69.303 -2.686 18986 3021 1 7 . 1 1 616 616 THR H H 616 7.722 7.722 8.278 -0.556 18986 3022 1 7 . 1 1 617 617 GLY N N 617 111.384 111.384 106.477 4.907 18986 3023 1 7 . 1 1 617 617 GLY C C 617 171.437 171.437 173.640 -2.203 18986 3024 1 7 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.239 -2.797 18986 3025 1 7 . 1 1 617 617 GLY H H 617 8.431 8.431 7.856 0.575 18986 3026 1 7 . 1 1 618 618 LYS N N 618 120.996 120.996 121.258 -0.262 18986 3027 1 7 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.869 -0.202 18986 3028 1 7 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.867 -2.039 18986 3029 1 7 . 1 1 618 618 LYS CB C 618 29.477 29.477 33.801 -4.324 18986 3030 1 7 . 1 1 618 618 LYS H H 618 7.821 7.821 7.944 -0.123 18986 3031 1 7 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.631 -0.162 18986 3032 1 7 . 1 1 619 619 PRO C C 619 174.453 174.453 177.907 -3.454 18986 3033 1 7 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.534 -2.342 18986 3034 1 7 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.838 -3.258 18986 3035 1 7 . 1 1 620 620 LYS N N 620 123.464 123.464 121.100 2.364 18986 3036 1 7 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.914 0.132 18986 3037 1 7 . 1 1 620 620 LYS C C 620 174.895 174.895 178.759 -3.864 18986 3038 1 7 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.298 -4.009 18986 3039 1 7 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.835 -1.381 18986 3040 1 7 . 1 1 620 620 LYS H H 620 8.728 8.728 8.779 -0.051 18986 3041 1 7 . 1 1 621 621 SER N N 621 113.921 113.921 114.935 -1.014 18986 3042 1 7 . 1 1 621 621 SER HA H 621 4.336 4.336 4.178 0.158 18986 3043 1 7 . 1 1 621 621 SER C C 621 173.149 173.149 176.057 -2.908 18986 3044 1 7 . 1 1 621 621 SER CA C 621 56.691 56.691 61.502 -4.811 18986 3045 1 7 . 1 1 621 621 SER CB C 621 60.689 60.689 62.378 -1.689 18986 3046 1 7 . 1 1 621 621 SER H H 621 8.531 8.531 8.236 0.295 18986 3047 1 7 . 1 1 622 622 ALA N N 622 124.177 124.177 123.744 0.433 18986 3048 1 7 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.076 0.092 18986 3049 1 7 . 1 1 622 622 ALA C C 622 176.804 176.804 178.968 -2.164 18986 3050 1 7 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.308 -2.940 18986 3051 1 7 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.319 -2.465 18986 3052 1 7 . 1 1 622 622 ALA H H 622 7.835 7.835 8.301 -0.466 18986 3053 1 7 . 1 1 623 623 ARG N N 623 118.263 118.263 118.621 -0.358 18986 3054 1 7 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.010 -0.060 18986 3055 1 7 . 1 1 623 623 ARG C C 623 175.683 175.683 178.323 -2.640 18986 3056 1 7 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.903 -1.740 18986 3057 1 7 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.672 -2.221 18986 3058 1 7 . 1 1 623 623 ARG H H 623 8.148 8.148 7.963 0.185 18986 3059 1 7 . 1 1 624 624 GLU N N 624 117.953 117.953 120.990 -3.037 18986 3060 1 7 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.041 -0.073 18986 3061 1 7 . 1 1 624 624 GLU C C 624 177.204 177.204 178.725 -1.521 18986 3062 1 7 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.316 -2.458 18986 3063 1 7 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.064 -2.097 18986 3064 1 7 . 1 1 624 624 GLU H H 624 8.143 8.143 8.687 -0.544 18986 3065 1 7 . 1 1 625 625 LYS N N 625 119.222 119.222 119.241 -0.019 18986 3066 1 7 . 1 1 625 625 LYS HA H 625 3.857 3.857 3.983 -0.126 18986 3067 1 7 . 1 1 625 625 LYS C C 625 175.480 175.480 179.423 -3.943 18986 3068 1 7 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.517 -2.030 18986 3069 1 7 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.444 -1.781 18986 3070 1 7 . 1 1 625 625 LYS H H 625 7.772 7.772 7.957 -0.185 18986 3071 1 7 . 1 1 626 626 MET N N 626 117.883 117.883 118.826 -0.943 18986 3072 1 7 . 1 1 626 626 MET HA H 626 3.807 3.807 4.068 -0.261 18986 3073 1 7 . 1 1 626 626 MET C C 626 175.278 175.278 178.468 -3.190 18986 3074 1 7 . 1 1 626 626 MET CA C 626 57.782 57.782 59.653 -1.871 18986 3075 1 7 . 1 1 626 626 MET CB C 626 30.657 30.657 32.784 -2.127 18986 3076 1 7 . 1 1 626 626 MET H H 626 8.367 8.367 8.560 -0.193 18986 3077 1 7 . 1 1 627 627 MET N N 627 116.185 116.185 118.497 -2.312 18986 3078 1 7 . 1 1 627 627 MET HA H 627 4.152 4.152 4.128 0.024 18986 3079 1 7 . 1 1 627 627 MET C C 627 176.393 176.393 178.789 -2.396 18986 3080 1 7 . 1 1 627 627 MET CA C 627 55.359 55.359 58.011 -2.652 18986 3081 1 7 . 1 1 627 627 MET CB C 627 28.803 28.803 31.315 -2.512 18986 3082 1 7 . 1 1 627 627 MET H H 627 8.197 8.197 8.669 -0.472 18986 3083 1 7 . 1 1 628 628 LYS N N 628 119.859 119.859 119.822 0.037 18986 3084 1 7 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.053 0.147 18986 3085 1 7 . 1 1 628 628 LYS C C 628 175.885 175.885 179.301 -3.416 18986 3086 1 7 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.054 -3.978 18986 3087 1 7 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.293 -3.762 18986 3088 1 7 . 1 1 628 628 LYS H H 628 7.700 7.700 7.922 -0.222 18986 3089 1 7 . 1 1 629 629 ILE N N 629 119.001 119.001 119.898 -0.897 18986 3090 1 7 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.649 -0.101 18986 3091 1 7 . 1 1 629 629 ILE C C 629 174.891 174.891 178.046 -3.155 18986 3092 1 7 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.494 -3.229 18986 3093 1 7 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.971 -4.122 18986 3094 1 7 . 1 1 629 629 ILE H H 629 7.970 7.970 8.311 -0.341 18986 3095 1 7 . 1 1 630 630 ILE N N 630 120.737 120.737 115.462 5.275 18986 3096 1 7 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.725 -0.258 18986 3097 1 7 . 1 1 630 630 ILE C C 630 173.875 173.875 177.462 -3.587 18986 3098 1 7 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.821 -2.067 18986 3099 1 7 . 1 1 630 630 ILE CB C 630 34.277 34.277 37.025 -2.748 18986 3100 1 7 . 1 1 630 630 ILE H H 630 8.213 8.213 8.329 -0.116 18986 3101 1 7 . 1 1 631 631 GLU N N 631 119.546 119.546 120.842 -1.296 18986 3102 1 7 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.246 -0.181 18986 3103 1 7 . 1 1 631 631 GLU C C 631 177.300 177.300 178.911 -1.611 18986 3104 1 7 . 1 1 631 631 GLU CA C 631 56.980 56.980 58.848 -1.868 18986 3105 1 7 . 1 1 631 631 GLU CB C 631 26.993 26.993 30.454 -3.461 18986 3106 1 7 . 1 1 631 631 GLU H H 631 7.742 7.742 7.679 0.063 18986 3107 1 7 . 1 1 632 632 ILE N N 632 121.547 121.547 120.927 0.620 18986 3108 1 7 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.781 -0.098 18986 3109 1 7 . 1 1 632 632 ILE C C 632 175.454 175.454 178.303 -2.849 18986 3110 1 7 . 1 1 632 632 ILE CA C 632 62.656 62.656 64.188 -1.532 18986 3111 1 7 . 1 1 632 632 ILE CB C 632 35.830 35.830 36.674 -0.844 18986 3112 1 7 . 1 1 632 632 ILE H H 632 8.013 8.013 8.282 -0.269 18986 3113 1 7 . 1 1 633 633 ILE N N 633 121.605 121.605 120.397 1.208 18986 3114 1 7 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.612 -0.277 18986 3115 1 7 . 1 1 633 633 ILE C C 633 174.558 174.558 177.998 -3.440 18986 3116 1 7 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.827 -1.908 18986 3117 1 7 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.522 -2.238 18986 3118 1 7 . 1 1 633 633 ILE H H 633 8.594 8.594 8.336 0.258 18986 3119 1 7 . 1 1 634 634 ASP N N 634 118.706 118.706 120.613 -1.907 18986 3120 1 7 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.319 0.116 18986 3121 1 7 . 1 1 634 634 ASP C C 634 176.574 176.574 178.688 -2.114 18986 3122 1 7 . 1 1 634 634 ASP CA C 634 54.571 54.571 58.171 -3.600 18986 3123 1 7 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.826 -2.912 18986 3124 1 7 . 1 1 634 634 ASP H H 634 8.724 8.724 7.927 0.797 18986 3125 1 7 . 1 1 635 635 SER N N 635 114.064 114.064 115.612 -1.548 18986 3126 1 7 . 1 1 635 635 SER HA H 635 4.232 4.232 4.271 -0.039 18986 3127 1 7 . 1 1 635 635 SER C C 635 174.487 174.487 177.069 -2.582 18986 3128 1 7 . 1 1 635 635 SER CA C 635 58.540 58.540 61.422 -2.882 18986 3129 1 7 . 1 1 635 635 SER CB C 635 60.319 60.319 63.154 -2.835 18986 3130 1 7 . 1 1 635 635 SER H H 635 7.992 7.992 8.096 -0.104 18986 3131 1 7 . 1 1 636 636 LEU N N 636 122.493 122.493 121.928 0.565 18986 3132 1 7 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.047 0.207 18986 3133 1 7 . 1 1 636 636 LEU C C 636 176.194 176.194 178.626 -2.432 18986 3134 1 7 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.956 -3.861 18986 3135 1 7 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.252 -1.546 18986 3136 1 7 . 1 1 636 636 LEU H H 636 8.169 8.169 8.565 -0.396 18986 3137 1 7 . 1 1 637 637 ALA N N 637 121.891 121.891 120.477 1.414 18986 3138 1 7 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.305 -0.216 18986 3139 1 7 . 1 1 637 637 ALA C C 637 175.131 175.131 179.095 -3.964 18986 3140 1 7 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.152 -3.816 18986 3141 1 7 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.489 -3.001 18986 3142 1 7 . 1 1 637 637 ALA H H 637 8.482 8.482 7.969 0.513 18986 3143 1 7 . 1 1 638 638 VAL N N 638 117.140 117.140 117.143 -0.003 18986 3144 1 7 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.832 0.103 18986 3145 1 7 . 1 1 638 638 VAL C C 638 174.712 174.712 177.613 -2.901 18986 3146 1 7 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.792 -2.791 18986 3147 1 7 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.167 -2.816 18986 3148 1 7 . 1 1 638 638 VAL H H 638 7.291 7.291 8.049 -0.758 18986 3149 1 7 . 1 1 639 639 SER N N 639 114.143 114.143 114.657 -0.514 18986 3150 1 7 . 1 1 639 639 SER HA H 639 4.481 4.481 4.415 0.066 18986 3151 1 7 . 1 1 639 639 SER C C 639 172.122 172.122 174.206 -2.084 18986 3152 1 7 . 1 1 639 639 SER CA C 639 56.002 56.002 60.882 -4.880 18986 3153 1 7 . 1 1 639 639 SER CB C 639 60.921 60.921 63.752 -2.831 18986 3154 1 7 . 1 1 639 639 SER H H 639 7.918 7.918 8.023 -0.105 18986 3155 1 7 . 1 1 640 640 SER N N 640 115.370 115.370 113.606 1.764 18986 3156 1 7 . 1 1 640 640 SER HA H 640 4.711 4.711 4.690 0.021 18986 3157 1 7 . 1 1 640 640 SER C C 640 171.185 171.185 173.797 -2.612 18986 3158 1 7 . 1 1 640 640 SER CA C 640 55.009 55.009 57.081 -2.072 18986 3159 1 7 . 1 1 640 640 SER CB C 640 61.974 61.974 63.982 -2.008 18986 3160 1 7 . 1 1 640 640 SER H H 640 7.765 7.765 7.792 -0.027 18986 3161 1 7 . 1 1 641 641 GLU N N 641 119.994 119.994 120.360 -0.366 18986 3162 1 7 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.161 -0.117 18986 3163 1 7 . 1 1 641 641 GLU C C 641 173.167 173.167 175.774 -2.607 18986 3164 1 7 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.042 -2.391 18986 3165 1 7 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.915 -2.431 18986 3166 1 7 . 1 1 641 641 GLU H H 641 8.363 8.363 8.644 -0.281 18986 3167 1 7 . 1 1 642 642 CYS N N 642 110.257 110.257 111.421 -1.164 18986 3168 1 7 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.572 -0.113 18986 3169 1 7 . 1 1 642 642 CYS C C 642 168.058 168.058 173.054 -4.996 18986 3170 1 7 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.721 -4.775 18986 3171 1 7 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.302 10.059 18986 3172 1 7 . 1 1 642 642 CYS H H 642 7.881 7.881 7.285 0.596 18986 3173 1 7 . 1 1 643 643 ALA N N 643 123.922 123.922 123.880 0.042 18986 3174 1 7 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.445 0.193 18986 3175 1 7 . 1 1 643 643 ALA C C 643 172.517 172.517 176.984 -4.467 18986 3176 1 7 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.178 -3.558 18986 3177 1 7 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.560 0.884 18986 3178 1 7 . 1 1 643 643 ALA H H 643 9.787 9.787 8.841 0.946 18986 3179 1 7 . 1 1 644 644 LYS N N 644 128.479 128.479 126.731 1.748 18986 3180 1 7 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.302 0.209 18986 3181 1 7 . 1 1 644 644 LYS C C 644 176.945 176.945 177.419 -0.474 18986 3182 1 7 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.705 -2.367 18986 3183 1 7 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.626 -1.684 18986 3184 1 7 . 1 1 644 644 LYS H H 644 9.809 9.809 8.408 1.401 18986 3185 1 7 . 1 1 645 645 VAL N N 645 124.257 124.257 126.173 -1.916 18986 3186 1 7 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.569 0.079 18986 3187 1 7 . 1 1 645 645 VAL C C 645 173.996 173.996 177.407 -3.411 18986 3188 1 7 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.127 -1.265 18986 3189 1 7 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.017 -1.816 18986 3190 1 7 . 1 1 645 645 VAL H H 645 8.458 8.458 9.097 -0.639 18986 3191 1 7 . 1 1 646 646 LYS N N 646 117.598 117.598 120.083 -2.485 18986 3192 1 7 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.915 0.092 18986 3193 1 7 . 1 1 646 646 LYS C C 646 176.047 176.047 179.010 -2.963 18986 3194 1 7 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.022 -2.777 18986 3195 1 7 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.755 -2.357 18986 3196 1 7 . 1 1 646 646 LYS H H 646 8.706 8.706 8.414 0.292 18986 3197 1 7 . 1 1 647 647 ASP N N 647 119.229 119.229 119.842 -0.613 18986 3198 1 7 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.508 0.110 18986 3199 1 7 . 1 1 647 647 ASP C C 647 175.211 175.211 178.381 -3.170 18986 3200 1 7 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.035 -2.712 18986 3201 1 7 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.703 -1.965 18986 3202 1 7 . 1 1 647 647 ASP H H 647 7.012 7.012 7.964 -0.952 18986 3203 1 7 . 1 1 648 648 ILE N N 648 121.939 121.939 120.949 0.990 18986 3204 1 7 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.587 -0.206 18986 3205 1 7 . 1 1 648 648 ILE C C 648 175.243 175.243 177.995 -2.752 18986 3206 1 7 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.395 -2.354 18986 3207 1 7 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.816 -1.854 18986 3208 1 7 . 1 1 648 648 ILE H H 648 8.152 8.152 7.613 0.539 18986 3209 1 7 . 1 1 649 649 LEU N N 649 117.310 117.310 119.623 -2.313 18986 3210 1 7 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.767 0.106 18986 3211 1 7 . 1 1 649 649 LEU C C 649 176.439 176.439 178.832 -2.393 18986 3212 1 7 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.420 -2.535 18986 3213 1 7 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.301 -1.995 18986 3214 1 7 . 1 1 649 649 LEU H H 649 8.638 8.638 8.615 0.023 18986 3215 1 7 . 1 1 650 650 LYS N N 650 118.810 118.810 119.623 -0.813 18986 3216 1 7 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.870 0.176 18986 3217 1 7 . 1 1 650 650 LYS C C 650 176.801 176.801 178.774 -1.973 18986 3218 1 7 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.789 -2.738 18986 3219 1 7 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.223 -2.159 18986 3220 1 7 . 1 1 650 650 LYS H H 650 7.296 7.296 7.878 -0.582 18986 3221 1 7 . 1 1 651 651 GLU N N 651 117.713 117.713 118.615 -0.902 18986 3222 1 7 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.030 0.078 18986 3223 1 7 . 1 1 651 651 GLU C C 651 176.903 176.903 179.136 -2.233 18986 3224 1 7 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.848 -3.038 18986 3225 1 7 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.019 -1.571 18986 3226 1 7 . 1 1 651 651 GLU H H 651 8.036 8.036 8.303 -0.267 18986 3227 1 7 . 1 1 652 652 ALA N N 652 121.206 121.206 123.110 -1.904 18986 3228 1 7 . 1 1 652 652 ALA HA H 652 3.998 3.998 3.892 0.106 18986 3229 1 7 . 1 1 652 652 ALA C C 652 176.766 176.766 179.537 -2.771 18986 3230 1 7 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.381 -3.647 18986 3231 1 7 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.084 -2.768 18986 3232 1 7 . 1 1 652 652 ALA H H 652 8.973 8.973 8.704 0.269 18986 3233 1 7 . 1 1 653 653 GLN N N 653 117.768 117.768 117.896 -0.128 18986 3234 1 7 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.284 0.193 18986 3235 1 7 . 1 1 653 653 GLN C C 653 177.388 177.388 179.024 -1.636 18986 3236 1 7 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.635 -2.575 18986 3237 1 7 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.482 -1.713 18986 3238 1 7 . 1 1 653 653 GLN H H 653 8.059 8.059 8.255 -0.196 18986 3239 1 7 . 1 1 654 654 GLN N N 654 117.979 117.979 118.275 -0.296 18986 3240 1 7 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.097 0.080 18986 3241 1 7 . 1 1 654 654 GLN C C 654 174.834 174.834 178.521 -3.687 18986 3242 1 7 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.045 -2.627 18986 3243 1 7 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.585 -2.608 18986 3244 1 7 . 1 1 654 654 GLN H H 654 7.495 7.495 8.107 -0.612 18986 3245 1 7 . 1 1 655 655 VAL N N 655 110.080 110.080 117.247 -7.167 18986 3246 1 7 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.862 0.665 18986 3247 1 7 . 1 1 655 655 VAL C C 655 173.369 173.369 176.433 -3.064 18986 3248 1 7 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.272 -6.205 18986 3249 1 7 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.456 -4.271 18986 3250 1 7 . 1 1 655 655 VAL H H 655 7.197 7.197 8.146 -0.949 18986 3251 1 7 . 1 1 656 656 GLY N N 656 107.089 107.089 107.831 -0.742 18986 3252 1 7 . 1 1 656 656 GLY C C 656 171.639 171.639 173.124 -1.485 18986 3253 1 7 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.724 -1.413 18986 3254 1 7 . 1 1 656 656 GLY H H 656 7.541 7.541 7.776 -0.235 18986 3255 1 7 . 1 1 657 657 ILE N N 657 121.266 121.266 118.676 2.590 18986 3256 1 7 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.397 -0.263 18986 3257 1 7 . 1 1 657 657 ILE C C 657 171.885 171.885 173.977 -2.092 18986 3258 1 7 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.432 -1.202 18986 3259 1 7 . 1 1 657 657 ILE CB C 657 35.191 35.191 41.857 -6.666 18986 3260 1 7 . 1 1 657 657 ILE H H 657 7.633 7.633 7.686 -0.053 18986 3261 1 7 . 1 1 658 658 GLU N N 658 127.252 127.252 124.386 2.866 18986 3262 1 7 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.555 -0.352 18986 3263 1 7 . 1 1 658 658 GLU C C 658 175.316 175.316 177.983 -2.667 18986 3264 1 7 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.310 -0.950 18986 3265 1 7 . 1 1 658 658 GLU CB C 658 27.610 27.610 30.647 -3.037 18986 3266 1 7 . 1 1 658 658 GLU H H 658 8.690 8.690 8.681 0.009 18986 3267 1 7 . 1 1 659 659 LYS N N 659 124.533 124.533 128.024 -3.491 18986 3268 1 7 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.829 -0.041 18986 3269 1 7 . 1 1 659 659 LYS C C 659 175.170 175.170 178.240 -3.070 18986 3270 1 7 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.966 -1.795 18986 3271 1 7 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.870 -1.753 18986 3272 1 7 . 1 1 659 659 LYS H H 659 8.706 8.706 9.235 -0.529 18986 3273 1 7 . 1 1 660 660 SER N N 660 113.137 113.137 115.907 -2.770 18986 3274 1 7 . 1 1 660 660 SER HA H 660 4.273 4.273 4.134 0.139 18986 3275 1 7 . 1 1 660 660 SER C C 660 173.939 173.939 176.653 -2.714 18986 3276 1 7 . 1 1 660 660 SER CA C 660 58.350 58.350 61.716 -3.366 18986 3277 1 7 . 1 1 660 660 SER CB C 660 59.504 59.504 62.685 -3.181 18986 3278 1 7 . 1 1 660 660 SER H H 660 8.777 8.777 8.538 0.239 18986 3279 1 7 . 1 1 661 661 ASN N N 661 119.986 119.986 120.911 -0.925 18986 3280 1 7 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.470 0.236 18986 3281 1 7 . 1 1 661 661 ASN C C 661 174.516 174.516 177.511 -2.995 18986 3282 1 7 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.329 -4.281 18986 3283 1 7 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.614 -1.871 18986 3284 1 7 . 1 1 661 661 ASN H H 661 7.486 7.486 8.045 -0.559 18986 3285 1 7 . 1 1 662 662 ILE N N 662 120.639 120.639 120.873 -0.234 18986 3286 1 7 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.637 -0.191 18986 3287 1 7 . 1 1 662 662 ILE C C 662 174.252 174.252 177.788 -3.536 18986 3288 1 7 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.574 -2.968 18986 3289 1 7 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.821 -3.398 18986 3290 1 7 . 1 1 662 662 ILE H H 662 7.999 7.999 7.761 0.238 18986 3291 1 7 . 1 1 663 663 GLU N N 663 117.706 117.706 119.782 -2.076 18986 3292 1 7 . 1 1 663 663 GLU HA H 663 3.790 3.790 4.008 -0.218 18986 3293 1 7 . 1 1 663 663 GLU C C 663 176.509 176.509 178.984 -2.475 18986 3294 1 7 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.808 -2.100 18986 3295 1 7 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.246 -2.491 18986 3296 1 7 . 1 1 663 663 GLU H H 663 8.190 8.190 8.648 -0.458 18986 3297 1 7 . 1 1 664 664 LYS N N 664 119.586 119.586 120.433 -0.847 18986 3298 1 7 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.115 -0.062 18986 3299 1 7 . 1 1 664 664 LYS C C 664 175.941 175.941 179.012 -3.071 18986 3300 1 7 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.375 -2.794 18986 3301 1 7 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.192 -2.369 18986 3302 1 7 . 1 1 664 664 LYS H H 664 7.590 7.590 8.112 -0.522 18986 3303 1 7 . 1 1 665 665 LEU N N 665 119.756 119.756 121.171 -1.415 18986 3304 1 7 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.029 0.051 18986 3305 1 7 . 1 1 665 665 LEU C C 665 176.700 176.700 179.062 -2.362 18986 3306 1 7 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.677 -2.292 18986 3307 1 7 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.916 -2.724 18986 3308 1 7 . 1 1 665 665 LEU H H 665 8.075 8.075 8.190 -0.115 18986 3309 1 7 . 1 1 666 666 LEU N N 666 118.788 118.788 119.820 -1.032 18986 3310 1 7 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.784 -0.020 18986 3311 1 7 . 1 1 666 666 LEU C C 666 176.484 176.484 178.960 -2.476 18986 3312 1 7 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.422 -2.764 18986 3313 1 7 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.127 -2.516 18986 3314 1 7 . 1 1 666 666 LEU H H 666 8.550 8.550 8.758 -0.208 18986 3315 1 7 . 1 1 667 667 THR N N 667 115.244 115.244 115.760 -0.516 18986 3316 1 7 . 1 1 667 667 THR HA H 667 3.839 3.839 3.984 -0.145 18986 3317 1 7 . 1 1 667 667 THR C C 667 173.740 173.740 176.274 -2.534 18986 3318 1 7 . 1 1 667 667 THR CA C 667 64.378 64.378 67.642 -3.264 18986 3319 1 7 . 1 1 667 667 THR CB C 667 65.748 65.748 68.095 -2.347 18986 3320 1 7 . 1 1 667 667 THR H H 667 7.662 7.662 8.107 -0.445 18986 3321 1 7 . 1 1 668 668 ASP N N 668 122.862 122.862 122.804 0.058 18986 3322 1 7 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.341 0.042 18986 3323 1 7 . 1 1 668 668 ASP C C 668 177.192 177.192 178.703 -1.511 18986 3324 1 7 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.373 -2.242 18986 3325 1 7 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.920 -3.034 18986 3326 1 7 . 1 1 668 668 ASP H H 668 8.291 8.291 8.375 -0.084 18986 3327 1 7 . 1 1 669 669 MET N N 669 119.640 119.640 118.643 0.997 18986 3328 1 7 . 1 1 669 669 MET HA H 669 3.917 3.917 4.131 -0.214 18986 3329 1 7 . 1 1 669 669 MET C C 669 175.414 175.414 178.672 -3.258 18986 3330 1 7 . 1 1 669 669 MET CA C 669 57.234 57.234 59.528 -2.293 18986 3331 1 7 . 1 1 669 669 MET CB C 669 32.088 32.088 32.645 -0.557 18986 3332 1 7 . 1 1 669 669 MET H H 669 8.809 8.809 8.514 0.295 18986 3333 1 7 . 1 1 670 670 ARG N N 670 122.614 122.614 118.505 4.109 18986 3334 1 7 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.474 0.043 18986 3335 1 7 . 1 1 670 670 ARG C C 670 177.928 177.928 179.016 -1.088 18986 3336 1 7 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.563 -2.341 18986 3337 1 7 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.925 -2.621 18986 3338 1 7 . 1 1 670 670 ARG H H 670 8.450 8.450 8.546 -0.096 18986 3339 1 7 . 1 1 671 671 LYS N N 671 121.976 121.976 119.838 2.138 18986 3340 1 7 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.222 -0.109 18986 3341 1 7 . 1 1 671 671 LYS C C 671 176.143 176.143 178.346 -2.203 18986 3342 1 7 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.492 -1.406 18986 3343 1 7 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.763 -3.259 18986 3344 1 7 . 1 1 671 671 LYS H H 671 8.609 8.609 8.397 0.212 18986 3345 1 7 . 1 1 672 672 SER N N 672 111.655 111.655 112.968 -1.313 18986 3346 1 7 . 1 1 672 672 SER HA H 672 4.469 4.469 4.444 0.025 18986 3347 1 7 . 1 1 672 672 SER C C 672 171.692 171.692 175.168 -3.476 18986 3348 1 7 . 1 1 672 672 SER CA C 672 56.790 56.790 59.789 -2.999 18986 3349 1 7 . 1 1 672 672 SER CB C 672 61.343 61.343 64.260 -2.917 18986 3350 1 7 . 1 1 672 672 SER H H 672 7.884 7.884 8.225 -0.341 18986 3351 1 7 . 1 1 673 673 GLY N N 673 108.029 108.029 107.843 0.186 18986 3352 1 7 . 1 1 673 673 GLY C C 673 171.492 171.492 174.970 -3.478 18986 3353 1 7 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.286 -2.011 18986 3354 1 7 . 1 1 673 673 GLY H H 673 7.774 7.774 8.076 -0.302 18986 3355 1 7 . 1 1 674 674 ILE N N 674 116.193 116.193 119.780 -3.587 18986 3356 1 7 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.122 -0.021 18986 3357 1 7 . 1 1 674 674 ILE C C 674 173.980 173.980 175.820 -1.840 18986 3358 1 7 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.536 -3.294 18986 3359 1 7 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.922 -2.118 18986 3360 1 7 . 1 1 674 674 ILE H H 674 8.026 8.026 8.284 -0.258 18986 3361 1 7 . 1 1 675 675 ILE N N 675 108.928 108.928 113.618 -4.690 18986 3362 1 7 . 1 1 675 675 ILE HA H 675 5.358 5.358 5.120 0.238 18986 3363 1 7 . 1 1 675 675 ILE C C 675 170.797 170.797 174.234 -3.437 18986 3364 1 7 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.800 -2.776 18986 3365 1 7 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.186 -2.700 18986 3366 1 7 . 1 1 675 675 ILE H H 675 7.120 7.120 7.528 -0.408 18986 3367 1 7 . 1 1 676 676 TYR N N 676 118.062 118.062 116.436 1.626 18986 3368 1 7 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.071 -0.076 18986 3369 1 7 . 1 1 676 676 TYR C C 676 170.020 170.020 173.447 -3.427 18986 3370 1 7 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.907 -3.014 18986 3371 1 7 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.151 -2.635 18986 3372 1 7 . 1 1 676 676 TYR H H 676 9.380 9.380 8.911 0.469 18986 3373 1 7 . 1 1 677 677 GLU N N 677 123.578 123.578 122.031 1.547 18986 3374 1 7 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.325 0.501 18986 3375 1 7 . 1 1 677 677 GLU C C 677 172.146 172.146 175.211 -3.065 18986 3376 1 7 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.580 -3.104 18986 3377 1 7 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.170 -1.558 18986 3378 1 7 . 1 1 677 677 GLU H H 677 8.951 8.951 8.476 0.475 18986 3379 1 7 . 1 1 678 678 ALA N N 678 133.220 133.220 129.693 3.527 18986 3380 1 7 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.222 -0.181 18986 3381 1 7 . 1 1 678 678 ALA C C 678 175.219 175.219 177.654 -2.435 18986 3382 1 7 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.738 -2.137 18986 3383 1 7 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.160 -2.561 18986 3384 1 7 . 1 1 678 678 ALA H H 678 7.912 7.912 7.683 0.229 18986 3385 1 7 . 1 1 679 679 LYS N N 679 115.687 115.687 116.537 -0.850 18986 3386 1 7 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.700 -0.265 18986 3387 1 7 . 1 1 679 679 LYS CA C 679 51.016 51.016 53.040 -2.024 18986 3388 1 7 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.704 -2.709 18986 3389 1 7 . 1 1 679 679 LYS H H 679 8.215 8.215 7.622 0.593 18986 3390 1 7 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.448 -0.429 18986 3391 1 7 . 1 1 680 680 PRO C C 680 174.504 174.504 178.037 -3.533 18986 3392 1 7 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.665 -1.147 18986 3393 1 7 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.478 -3.163 18986 3394 1 7 . 1 1 681 681 GLU N N 681 118.851 118.851 119.735 -0.884 18986 3395 1 7 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.965 -0.527 18986 3396 1 7 . 1 1 681 681 GLU C C 681 172.890 172.890 174.927 -2.037 18986 3397 1 7 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.532 -4.051 18986 3398 1 7 . 1 1 681 681 GLU CB C 681 24.789 24.789 27.831 -3.042 18986 3399 1 7 . 1 1 681 681 GLU H H 681 10.003 10.003 9.818 0.185 18986 3400 1 7 . 1 1 682 682 CYS N N 682 120.934 120.934 117.921 3.013 18986 3401 1 7 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.122 -0.095 18986 3402 1 7 . 1 1 682 682 CYS C C 682 171.905 171.905 174.091 -2.186 18986 3403 1 7 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.978 -3.734 18986 3404 1 7 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.509 16.786 18986 3405 1 7 . 1 1 682 682 CYS H H 682 7.860 7.860 8.104 -0.244 18986 3406 1 7 . 1 1 683 683 TYR N N 683 126.183 126.183 124.806 1.377 18986 3407 1 7 . 1 1 683 683 TYR HA H 683 5.224 5.224 4.855 0.369 18986 3408 1 7 . 1 1 683 683 TYR C C 683 173.008 173.008 174.752 -1.744 18986 3409 1 7 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.727 -1.159 18986 3410 1 7 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.791 0.161 18986 3411 1 7 . 1 1 683 683 TYR H H 683 9.297 9.297 9.328 -0.031 18986 3412 1 7 . 1 1 684 684 LYS N N 684 118.604 118.604 118.958 -0.354 18986 3413 1 7 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.707 -0.270 18986 3414 1 7 . 1 1 684 684 LYS C C 684 171.628 171.628 175.228 -3.600 18986 3415 1 7 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.605 -1.302 18986 3416 1 7 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.525 -1.848 18986 3417 1 7 . 1 1 684 684 LYS H H 684 8.630 8.630 8.749 -0.119 18986 3418 1 7 . 1 1 685 685 LYS N N 685 122.869 122.869 124.661 -1.792 18986 3419 1 7 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.269 0.375 18986 3420 1 7 . 1 1 685 685 LYS C C 685 173.337 173.337 177.168 -3.831 18986 3421 1 7 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.062 -2.809 18986 3422 1 7 . 1 1 685 685 LYS CB C 685 30.927 30.927 33.087 -2.160 18986 3423 1 7 . 1 1 685 685 LYS H H 685 8.969 8.969 8.571 0.398 18986 3424 1 8 . 1 1 601 601 SER HA H 601 4.475 4.475 4.341 0.134 18986 3425 1 8 . 1 1 601 601 SER CA C 601 55.508 55.508 58.515 -3.007 18986 3426 1 8 . 1 1 601 601 SER CB C 601 61.220 61.220 62.354 -1.134 18986 3427 1 8 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.569 0.047 18986 3428 1 8 . 1 1 602 602 HIS C C 602 172.320 172.320 176.433 -4.113 18986 3429 1 8 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.339 -1.484 18986 3430 1 8 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.588 -2.505 18986 3431 1 8 . 1 1 603 603 MET N N 603 121.862 121.862 120.469 1.393 18986 3432 1 8 . 1 1 603 603 MET HA H 603 4.425 4.425 4.484 -0.059 18986 3433 1 8 . 1 1 603 603 MET C C 603 173.948 173.948 176.367 -2.419 18986 3434 1 8 . 1 1 603 603 MET CA C 603 53.108 53.108 56.308 -3.200 18986 3435 1 8 . 1 1 603 603 MET CB C 603 30.049 30.049 32.592 -2.543 18986 3436 1 8 . 1 1 603 603 MET H H 603 8.394 8.394 8.607 -0.213 18986 3437 1 8 . 1 1 604 604 GLY N N 604 110.382 110.382 108.378 2.004 18986 3438 1 8 . 1 1 604 604 GLY C C 604 171.590 171.590 174.804 -3.214 18986 3439 1 8 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.013 -2.396 18986 3440 1 8 . 1 1 604 604 GLY H H 604 8.411 8.411 8.028 0.383 18986 3441 1 8 . 1 1 605 605 GLU N N 605 120.709 120.709 121.143 -0.434 18986 3442 1 8 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.116 0.191 18986 3443 1 8 . 1 1 605 605 GLU C C 605 174.220 174.220 177.792 -3.572 18986 3444 1 8 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.867 -2.901 18986 3445 1 8 . 1 1 605 605 GLU CB C 605 27.611 27.611 29.413 -1.802 18986 3446 1 8 . 1 1 605 605 GLU H H 605 8.282 8.282 8.833 -0.551 18986 3447 1 8 . 1 1 606 606 SER N N 606 116.679 116.679 117.306 -0.627 18986 3448 1 8 . 1 1 606 606 SER HA H 606 4.405 4.405 4.298 0.107 18986 3449 1 8 . 1 1 606 606 SER C C 606 172.455 172.455 174.612 -2.157 18986 3450 1 8 . 1 1 606 606 SER CA C 606 56.028 56.028 57.826 -1.798 18986 3451 1 8 . 1 1 606 606 SER CB C 606 61.039 61.039 61.808 -0.769 18986 3452 1 8 . 1 1 606 606 SER H H 606 8.420 8.420 8.165 0.255 18986 3453 1 8 . 1 1 607 607 GLY N N 607 110.716 110.716 110.273 0.443 18986 3454 1 8 . 1 1 607 607 GLY C C 607 171.173 171.173 175.183 -4.010 18986 3455 1 8 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.770 -2.129 18986 3456 1 8 . 1 1 607 607 GLY H H 607 8.386 8.386 7.824 0.562 18986 3457 1 8 . 1 1 608 608 LYS N N 608 120.785 120.785 125.592 -4.807 18986 3458 1 8 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.216 0.123 18986 3459 1 8 . 1 1 608 608 LYS C C 608 173.673 173.673 175.609 -1.936 18986 3460 1 8 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.921 -2.556 18986 3461 1 8 . 1 1 608 608 LYS CB C 608 30.531 30.531 30.422 0.109 18986 3462 1 8 . 1 1 608 608 LYS H H 608 8.008 8.008 8.670 -0.662 18986 3463 1 8 . 1 1 609 609 ILE N N 609 122.404 122.404 121.933 0.471 18986 3464 1 8 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.200 -0.051 18986 3465 1 8 . 1 1 609 609 ILE C C 609 172.675 172.675 174.903 -2.228 18986 3466 1 8 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.513 -2.510 18986 3467 1 8 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.707 -3.503 18986 3468 1 8 . 1 1 609 609 ILE H H 609 8.186 8.186 7.765 0.421 18986 3469 1 8 . 1 1 610 610 ASP N N 610 125.357 125.357 127.582 -2.225 18986 3470 1 8 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.621 0.082 18986 3471 1 8 . 1 1 610 610 ASP C C 610 173.668 173.668 176.069 -2.401 18986 3472 1 8 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.883 -3.181 18986 3473 1 8 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.466 -2.776 18986 3474 1 8 . 1 1 610 610 ASP H H 610 8.369 8.369 8.240 0.129 18986 3475 1 8 . 1 1 611 611 ILE N N 611 122.494 122.494 120.886 1.608 18986 3476 1 8 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.971 -0.062 18986 3477 1 8 . 1 1 611 611 ILE C C 611 173.618 173.618 177.642 -4.024 18986 3478 1 8 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.941 -3.901 18986 3479 1 8 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.271 -2.473 18986 3480 1 8 . 1 1 611 611 ILE H H 611 8.284 8.284 8.065 0.219 18986 3481 1 8 . 1 1 612 612 ASP N N 612 121.440 121.440 120.407 1.033 18986 3482 1 8 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.402 0.032 18986 3483 1 8 . 1 1 612 612 ASP C C 612 175.129 175.129 178.448 -3.319 18986 3484 1 8 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.939 -4.173 18986 3485 1 8 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.975 -1.837 18986 3486 1 8 . 1 1 612 612 ASP H H 612 8.279 8.279 8.491 -0.212 18986 3487 1 8 . 1 1 613 613 THR N N 613 114.422 114.422 113.235 1.187 18986 3488 1 8 . 1 1 613 613 THR HA H 613 4.106 4.106 4.089 0.017 18986 3489 1 8 . 1 1 613 613 THR C C 613 173.338 173.338 175.585 -2.247 18986 3490 1 8 . 1 1 613 613 THR CA C 613 61.545 61.545 64.773 -3.228 18986 3491 1 8 . 1 1 613 613 THR CB C 613 66.267 66.267 68.400 -2.133 18986 3492 1 8 . 1 1 613 613 THR H H 613 7.866 7.866 8.240 -0.374 18986 3493 1 8 . 1 1 614 614 ILE N N 614 121.654 121.654 121.209 0.445 18986 3494 1 8 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.094 -0.065 18986 3495 1 8 . 1 1 614 614 ILE C C 614 174.471 174.471 177.798 -3.327 18986 3496 1 8 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.007 -2.834 18986 3497 1 8 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.542 -1.727 18986 3498 1 8 . 1 1 614 614 ILE H H 614 7.819 7.819 7.750 0.069 18986 3499 1 8 . 1 1 615 615 MET N N 615 119.713 119.713 118.019 1.694 18986 3500 1 8 . 1 1 615 615 MET HA H 615 4.478 4.478 4.660 -0.182 18986 3501 1 8 . 1 1 615 615 MET C C 615 174.075 174.075 177.901 -3.826 18986 3502 1 8 . 1 1 615 615 MET CA C 615 52.764 52.764 57.440 -4.676 18986 3503 1 8 . 1 1 615 615 MET CB C 615 29.337 29.337 31.983 -2.646 18986 3504 1 8 . 1 1 615 615 MET H H 615 8.188 8.188 8.501 -0.313 18986 3505 1 8 . 1 1 616 616 THR N N 616 114.770 114.770 113.493 1.277 18986 3506 1 8 . 1 1 616 616 THR HA H 616 4.099 4.099 4.162 -0.063 18986 3507 1 8 . 1 1 616 616 THR C C 616 172.535 172.535 175.764 -3.229 18986 3508 1 8 . 1 1 616 616 THR CA C 616 61.112 61.112 63.394 -2.282 18986 3509 1 8 . 1 1 616 616 THR CB C 616 66.617 66.617 69.190 -2.573 18986 3510 1 8 . 1 1 616 616 THR H H 616 7.722 7.722 8.216 -0.494 18986 3511 1 8 . 1 1 617 617 GLY N N 617 111.384 111.384 107.245 4.139 18986 3512 1 8 . 1 1 617 617 GLY C C 617 171.437 171.437 173.382 -1.945 18986 3513 1 8 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.225 -2.783 18986 3514 1 8 . 1 1 617 617 GLY H H 617 8.431 8.431 7.970 0.461 18986 3515 1 8 . 1 1 618 618 LYS N N 618 120.996 120.996 121.102 -0.106 18986 3516 1 8 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.870 -0.203 18986 3517 1 8 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.846 -2.018 18986 3518 1 8 . 1 1 618 618 LYS CB C 618 29.477 29.477 33.736 -4.259 18986 3519 1 8 . 1 1 618 618 LYS H H 618 7.821 7.821 7.955 -0.134 18986 3520 1 8 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.549 -0.080 18986 3521 1 8 . 1 1 619 619 PRO C C 619 174.453 174.453 178.286 -3.833 18986 3522 1 8 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.323 -2.131 18986 3523 1 8 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.874 -3.294 18986 3524 1 8 . 1 1 620 620 LYS N N 620 123.464 123.464 121.966 1.498 18986 3525 1 8 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.862 0.184 18986 3526 1 8 . 1 1 620 620 LYS C C 620 174.895 174.895 178.605 -3.710 18986 3527 1 8 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.372 -4.083 18986 3528 1 8 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.788 -1.333 18986 3529 1 8 . 1 1 620 620 LYS H H 620 8.728 8.728 8.724 0.004 18986 3530 1 8 . 1 1 621 621 SER N N 621 113.921 113.921 115.006 -1.085 18986 3531 1 8 . 1 1 621 621 SER HA H 621 4.336 4.336 4.123 0.213 18986 3532 1 8 . 1 1 621 621 SER C C 621 173.149 173.149 176.133 -2.984 18986 3533 1 8 . 1 1 621 621 SER CA C 621 56.691 56.691 60.664 -3.973 18986 3534 1 8 . 1 1 621 621 SER CB C 621 60.689 60.689 62.653 -1.964 18986 3535 1 8 . 1 1 621 621 SER H H 621 8.531 8.531 8.395 0.136 18986 3536 1 8 . 1 1 622 622 ALA N N 622 124.177 124.177 123.798 0.379 18986 3537 1 8 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.014 0.154 18986 3538 1 8 . 1 1 622 622 ALA C C 622 176.804 176.804 178.990 -2.186 18986 3539 1 8 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.222 -2.854 18986 3540 1 8 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.141 -2.287 18986 3541 1 8 . 1 1 622 622 ALA H H 622 7.835 7.835 8.070 -0.235 18986 3542 1 8 . 1 1 623 623 ARG N N 623 118.263 118.263 118.856 -0.593 18986 3543 1 8 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.021 -0.071 18986 3544 1 8 . 1 1 623 623 ARG C C 623 175.683 175.683 178.576 -2.893 18986 3545 1 8 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.012 -1.849 18986 3546 1 8 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.419 -1.968 18986 3547 1 8 . 1 1 623 623 ARG H H 623 8.148 8.148 7.967 0.181 18986 3548 1 8 . 1 1 624 624 GLU N N 624 117.953 117.953 119.167 -1.214 18986 3549 1 8 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.094 -0.126 18986 3550 1 8 . 1 1 624 624 GLU C C 624 177.204 177.204 178.245 -1.041 18986 3551 1 8 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.062 -2.204 18986 3552 1 8 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.371 -2.404 18986 3553 1 8 . 1 1 624 624 GLU H H 624 8.143 8.143 8.432 -0.289 18986 3554 1 8 . 1 1 625 625 LYS N N 625 119.222 119.222 118.013 1.209 18986 3555 1 8 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.278 -0.421 18986 3556 1 8 . 1 1 625 625 LYS C C 625 175.480 175.480 178.944 -3.464 18986 3557 1 8 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.857 -1.370 18986 3558 1 8 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.972 -2.309 18986 3559 1 8 . 1 1 625 625 LYS H H 625 7.772 7.772 7.857 -0.085 18986 3560 1 8 . 1 1 626 626 MET N N 626 117.883 117.883 119.875 -1.992 18986 3561 1 8 . 1 1 626 626 MET HA H 626 3.807 3.807 4.137 -0.330 18986 3562 1 8 . 1 1 626 626 MET C C 626 175.278 175.278 178.507 -3.229 18986 3563 1 8 . 1 1 626 626 MET CA C 626 57.782 57.782 59.247 -1.465 18986 3564 1 8 . 1 1 626 626 MET CB C 626 30.657 30.657 32.904 -2.247 18986 3565 1 8 . 1 1 626 626 MET H H 626 8.367 8.367 8.596 -0.229 18986 3566 1 8 . 1 1 627 627 MET N N 627 116.185 116.185 117.576 -1.391 18986 3567 1 8 . 1 1 627 627 MET HA H 627 4.152 4.152 4.072 0.080 18986 3568 1 8 . 1 1 627 627 MET C C 627 176.393 176.393 178.196 -1.803 18986 3569 1 8 . 1 1 627 627 MET CA C 627 55.359 55.359 57.783 -2.424 18986 3570 1 8 . 1 1 627 627 MET CB C 627 28.803 28.803 31.420 -2.617 18986 3571 1 8 . 1 1 627 627 MET H H 627 8.197 8.197 8.693 -0.496 18986 3572 1 8 . 1 1 628 628 LYS N N 628 119.859 119.859 120.470 -0.611 18986 3573 1 8 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.072 0.128 18986 3574 1 8 . 1 1 628 628 LYS C C 628 175.885 175.885 179.382 -3.497 18986 3575 1 8 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.156 -4.079 18986 3576 1 8 . 1 1 628 628 LYS CB C 628 28.531 28.531 31.793 -3.262 18986 3577 1 8 . 1 1 628 628 LYS H H 628 7.700 7.700 7.890 -0.190 18986 3578 1 8 . 1 1 629 629 ILE N N 629 119.001 119.001 119.686 -0.685 18986 3579 1 8 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.661 -0.113 18986 3580 1 8 . 1 1 629 629 ILE C C 629 174.891 174.891 177.988 -3.097 18986 3581 1 8 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.533 -3.268 18986 3582 1 8 . 1 1 629 629 ILE CB C 629 33.849 33.849 38.032 -4.183 18986 3583 1 8 . 1 1 629 629 ILE H H 629 7.970 7.970 7.873 0.097 18986 3584 1 8 . 1 1 630 630 ILE N N 630 120.737 120.737 117.468 3.269 18986 3585 1 8 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.610 -0.143 18986 3586 1 8 . 1 1 630 630 ILE C C 630 173.875 173.875 177.725 -3.850 18986 3587 1 8 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.955 -2.201 18986 3588 1 8 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.883 -2.606 18986 3589 1 8 . 1 1 630 630 ILE H H 630 8.213 8.213 8.124 0.089 18986 3590 1 8 . 1 1 631 631 GLU N N 631 119.546 119.546 121.282 -1.736 18986 3591 1 8 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.975 0.090 18986 3592 1 8 . 1 1 631 631 GLU C C 631 177.300 177.300 179.237 -1.937 18986 3593 1 8 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.758 -2.778 18986 3594 1 8 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.491 -2.498 18986 3595 1 8 . 1 1 631 631 GLU H H 631 7.742 7.742 8.069 -0.327 18986 3596 1 8 . 1 1 632 632 ILE N N 632 121.547 121.547 120.770 0.777 18986 3597 1 8 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.648 0.035 18986 3598 1 8 . 1 1 632 632 ILE C C 632 175.454 175.454 178.091 -2.637 18986 3599 1 8 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.701 -3.046 18986 3600 1 8 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.770 -1.940 18986 3601 1 8 . 1 1 632 632 ILE H H 632 8.013 8.013 8.093 -0.080 18986 3602 1 8 . 1 1 633 633 ILE N N 633 121.605 121.605 120.429 1.176 18986 3603 1 8 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.571 -0.236 18986 3604 1 8 . 1 1 633 633 ILE C C 633 174.558 174.558 178.086 -3.528 18986 3605 1 8 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.520 -1.601 18986 3606 1 8 . 1 1 633 633 ILE CB C 633 35.284 35.284 36.752 -1.468 18986 3607 1 8 . 1 1 633 633 ILE H H 633 8.594 8.594 8.436 0.158 18986 3608 1 8 . 1 1 634 634 ASP N N 634 118.706 118.706 120.233 -1.527 18986 3609 1 8 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.363 0.072 18986 3610 1 8 . 1 1 634 634 ASP C C 634 176.574 176.574 178.970 -2.396 18986 3611 1 8 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.882 -3.311 18986 3612 1 8 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.643 -2.729 18986 3613 1 8 . 1 1 634 634 ASP H H 634 8.724 8.724 8.545 0.179 18986 3614 1 8 . 1 1 635 635 SER N N 635 114.064 114.064 116.320 -2.256 18986 3615 1 8 . 1 1 635 635 SER HA H 635 4.232 4.232 4.182 0.050 18986 3616 1 8 . 1 1 635 635 SER C C 635 174.487 174.487 176.808 -2.321 18986 3617 1 8 . 1 1 635 635 SER CA C 635 58.540 58.540 61.584 -3.044 18986 3618 1 8 . 1 1 635 635 SER CB C 635 60.319 60.319 63.068 -2.749 18986 3619 1 8 . 1 1 635 635 SER H H 635 7.992 7.992 8.164 -0.172 18986 3620 1 8 . 1 1 636 636 LEU N N 636 122.493 122.493 121.165 1.328 18986 3621 1 8 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.068 0.186 18986 3622 1 8 . 1 1 636 636 LEU C C 636 176.194 176.194 178.608 -2.414 18986 3623 1 8 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.476 -3.381 18986 3624 1 8 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.198 -1.492 18986 3625 1 8 . 1 1 636 636 LEU H H 636 8.169 8.169 8.511 -0.342 18986 3626 1 8 . 1 1 637 637 ALA N N 637 121.891 121.891 122.101 -0.210 18986 3627 1 8 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.048 0.041 18986 3628 1 8 . 1 1 637 637 ALA C C 637 175.131 175.131 179.785 -4.654 18986 3629 1 8 . 1 1 637 637 ALA CA C 637 50.336 50.336 55.037 -4.701 18986 3630 1 8 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.426 -2.938 18986 3631 1 8 . 1 1 637 637 ALA H H 637 8.482 8.482 8.491 -0.009 18986 3632 1 8 . 1 1 638 638 VAL N N 638 117.140 117.140 117.710 -0.570 18986 3633 1 8 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.869 0.066 18986 3634 1 8 . 1 1 638 638 VAL C C 638 174.712 174.712 177.704 -2.992 18986 3635 1 8 . 1 1 638 638 VAL CA C 638 62.001 62.001 65.781 -3.780 18986 3636 1 8 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.579 -2.228 18986 3637 1 8 . 1 1 638 638 VAL H H 638 7.291 7.291 8.386 -1.095 18986 3638 1 8 . 1 1 639 639 SER N N 639 114.143 114.143 113.910 0.233 18986 3639 1 8 . 1 1 639 639 SER HA H 639 4.481 4.481 4.469 0.012 18986 3640 1 8 . 1 1 639 639 SER C C 639 172.122 172.122 174.171 -2.049 18986 3641 1 8 . 1 1 639 639 SER CA C 639 56.002 56.002 60.326 -4.324 18986 3642 1 8 . 1 1 639 639 SER CB C 639 60.921 60.921 63.957 -3.036 18986 3643 1 8 . 1 1 639 639 SER H H 639 7.918 7.918 8.244 -0.326 18986 3644 1 8 . 1 1 640 640 SER N N 640 115.370 115.370 114.004 1.366 18986 3645 1 8 . 1 1 640 640 SER HA H 640 4.711 4.711 4.622 0.089 18986 3646 1 8 . 1 1 640 640 SER C C 640 171.185 171.185 173.408 -2.223 18986 3647 1 8 . 1 1 640 640 SER CA C 640 55.009 55.009 56.655 -1.646 18986 3648 1 8 . 1 1 640 640 SER CB C 640 61.974 61.974 64.625 -2.651 18986 3649 1 8 . 1 1 640 640 SER H H 640 7.765 7.765 7.807 -0.042 18986 3650 1 8 . 1 1 641 641 GLU N N 641 119.994 119.994 121.310 -1.316 18986 3651 1 8 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.139 -0.095 18986 3652 1 8 . 1 1 641 641 GLU C C 641 173.167 173.167 175.602 -2.435 18986 3653 1 8 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.868 -2.217 18986 3654 1 8 . 1 1 641 641 GLU CB C 641 27.484 27.484 30.141 -2.657 18986 3655 1 8 . 1 1 641 641 GLU H H 641 8.363 8.363 8.713 -0.350 18986 3656 1 8 . 1 1 642 642 CYS N N 642 110.257 110.257 110.127 0.130 18986 3657 1 8 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.582 -0.123 18986 3658 1 8 . 1 1 642 642 CYS C C 642 168.058 168.058 172.577 -4.519 18986 3659 1 8 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.698 -5.752 18986 3660 1 8 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.377 9.984 18986 3661 1 8 . 1 1 642 642 CYS H H 642 7.881 7.881 7.239 0.642 18986 3662 1 8 . 1 1 643 643 ALA N N 643 123.922 123.922 123.051 0.871 18986 3663 1 8 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.493 0.145 18986 3664 1 8 . 1 1 643 643 ALA C C 643 172.517 172.517 176.560 -4.043 18986 3665 1 8 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.138 -3.518 18986 3666 1 8 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.407 1.037 18986 3667 1 8 . 1 1 643 643 ALA H H 643 9.787 9.787 8.945 0.842 18986 3668 1 8 . 1 1 644 644 LYS N N 644 128.479 128.479 125.798 2.681 18986 3669 1 8 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.295 0.216 18986 3670 1 8 . 1 1 644 644 LYS C C 644 176.945 176.945 177.617 -0.672 18986 3671 1 8 . 1 1 644 644 LYS CA C 644 54.338 54.338 57.055 -2.717 18986 3672 1 8 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.468 -2.526 18986 3673 1 8 . 1 1 644 644 LYS H H 644 9.809 9.809 8.186 1.623 18986 3674 1 8 . 1 1 645 645 VAL N N 645 124.257 124.257 124.770 -0.513 18986 3675 1 8 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.686 -0.038 18986 3676 1 8 . 1 1 645 645 VAL C C 645 173.996 173.996 177.283 -3.287 18986 3677 1 8 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.619 -1.757 18986 3678 1 8 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.447 -2.246 18986 3679 1 8 . 1 1 645 645 VAL H H 645 8.458 8.458 8.897 -0.439 18986 3680 1 8 . 1 1 646 646 LYS N N 646 117.598 117.598 120.652 -3.054 18986 3681 1 8 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.887 0.120 18986 3682 1 8 . 1 1 646 646 LYS C C 646 176.047 176.047 178.735 -2.688 18986 3683 1 8 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.325 -3.080 18986 3684 1 8 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.862 -2.464 18986 3685 1 8 . 1 1 646 646 LYS H H 646 8.706 8.706 7.931 0.775 18986 3686 1 8 . 1 1 647 647 ASP N N 647 119.229 119.229 120.075 -0.846 18986 3687 1 8 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.428 0.190 18986 3688 1 8 . 1 1 647 647 ASP C C 647 175.211 175.211 178.600 -3.389 18986 3689 1 8 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.861 -3.538 18986 3690 1 8 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.548 -1.810 18986 3691 1 8 . 1 1 647 647 ASP H H 647 7.012 7.012 7.812 -0.800 18986 3692 1 8 . 1 1 648 648 ILE N N 648 121.939 121.939 120.331 1.608 18986 3693 1 8 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.617 -0.236 18986 3694 1 8 . 1 1 648 648 ILE C C 648 175.243 175.243 177.771 -2.528 18986 3695 1 8 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.482 -2.441 18986 3696 1 8 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.816 -1.854 18986 3697 1 8 . 1 1 648 648 ILE H H 648 8.152 8.152 7.333 0.819 18986 3698 1 8 . 1 1 649 649 LEU N N 649 117.310 117.310 120.650 -3.340 18986 3699 1 8 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.811 0.062 18986 3700 1 8 . 1 1 649 649 LEU C C 649 176.439 176.439 178.937 -2.498 18986 3701 1 8 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.338 -2.453 18986 3702 1 8 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.394 -2.088 18986 3703 1 8 . 1 1 649 649 LEU H H 649 8.638 8.638 8.577 0.061 18986 3704 1 8 . 1 1 650 650 LYS N N 650 118.810 118.810 119.749 -0.939 18986 3705 1 8 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.909 0.137 18986 3706 1 8 . 1 1 650 650 LYS C C 650 176.801 176.801 178.744 -1.943 18986 3707 1 8 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.196 -2.145 18986 3708 1 8 . 1 1 650 650 LYS CB C 650 30.064 30.064 31.870 -1.806 18986 3709 1 8 . 1 1 650 650 LYS H H 650 7.296 7.296 8.340 -1.044 18986 3710 1 8 . 1 1 651 651 GLU N N 651 117.713 117.713 118.227 -0.514 18986 3711 1 8 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.136 -0.028 18986 3712 1 8 . 1 1 651 651 GLU C C 651 176.903 176.903 179.499 -2.596 18986 3713 1 8 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.927 -3.117 18986 3714 1 8 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.354 -1.906 18986 3715 1 8 . 1 1 651 651 GLU H H 651 8.036 8.036 8.165 -0.129 18986 3716 1 8 . 1 1 652 652 ALA N N 652 121.206 121.206 123.504 -2.298 18986 3717 1 8 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.128 -0.130 18986 3718 1 8 . 1 1 652 652 ALA C C 652 176.766 176.766 179.689 -2.923 18986 3719 1 8 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.262 -3.528 18986 3720 1 8 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.239 -2.923 18986 3721 1 8 . 1 1 652 652 ALA H H 652 8.973 8.973 8.706 0.267 18986 3722 1 8 . 1 1 653 653 GLN N N 653 117.768 117.768 118.377 -0.609 18986 3723 1 8 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.298 0.179 18986 3724 1 8 . 1 1 653 653 GLN C C 653 177.388 177.388 179.009 -1.621 18986 3725 1 8 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.844 -2.784 18986 3726 1 8 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.688 -1.919 18986 3727 1 8 . 1 1 653 653 GLN H H 653 8.059 8.059 8.405 -0.346 18986 3728 1 8 . 1 1 654 654 GLN N N 654 117.979 117.979 118.740 -0.761 18986 3729 1 8 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.066 0.111 18986 3730 1 8 . 1 1 654 654 GLN C C 654 174.834 174.834 178.343 -3.509 18986 3731 1 8 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.511 -3.093 18986 3732 1 8 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.710 -2.733 18986 3733 1 8 . 1 1 654 654 GLN H H 654 7.495 7.495 8.266 -0.771 18986 3734 1 8 . 1 1 655 655 VAL N N 655 110.080 110.080 117.146 -7.066 18986 3735 1 8 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.821 0.706 18986 3736 1 8 . 1 1 655 655 VAL C C 655 173.369 173.369 176.886 -3.517 18986 3737 1 8 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.603 -6.536 18986 3738 1 8 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.507 -4.323 18986 3739 1 8 . 1 1 655 655 VAL H H 655 7.197 7.197 7.921 -0.724 18986 3740 1 8 . 1 1 656 656 GLY N N 656 107.089 107.089 106.390 0.699 18986 3741 1 8 . 1 1 656 656 GLY C C 656 171.639 171.639 174.486 -2.847 18986 3742 1 8 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.584 -1.273 18986 3743 1 8 . 1 1 656 656 GLY H H 656 7.541 7.541 7.822 -0.281 18986 3744 1 8 . 1 1 657 657 ILE N N 657 121.266 121.266 121.156 0.110 18986 3745 1 8 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.112 0.022 18986 3746 1 8 . 1 1 657 657 ILE C C 657 171.885 171.885 174.725 -2.840 18986 3747 1 8 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.768 -2.538 18986 3748 1 8 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.270 -4.079 18986 3749 1 8 . 1 1 657 657 ILE H H 657 7.633 7.633 8.140 -0.507 18986 3750 1 8 . 1 1 658 658 GLU N N 658 127.252 127.252 124.169 3.083 18986 3751 1 8 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.465 -0.262 18986 3752 1 8 . 1 1 658 658 GLU C C 658 175.316 175.316 177.118 -1.802 18986 3753 1 8 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.583 -1.222 18986 3754 1 8 . 1 1 658 658 GLU CB C 658 27.610 27.610 30.919 -3.308 18986 3755 1 8 . 1 1 658 658 GLU H H 658 8.690 8.690 8.571 0.119 18986 3756 1 8 . 1 1 659 659 LYS N N 659 124.533 124.533 126.658 -2.125 18986 3757 1 8 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.888 -0.100 18986 3758 1 8 . 1 1 659 659 LYS C C 659 175.170 175.170 177.915 -2.745 18986 3759 1 8 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.279 -2.108 18986 3760 1 8 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.722 -1.605 18986 3761 1 8 . 1 1 659 659 LYS H H 659 8.706 8.706 8.784 -0.078 18986 3762 1 8 . 1 1 660 660 SER N N 660 113.137 113.137 115.496 -2.359 18986 3763 1 8 . 1 1 660 660 SER HA H 660 4.273 4.273 4.180 0.093 18986 3764 1 8 . 1 1 660 660 SER C C 660 173.939 173.939 176.782 -2.843 18986 3765 1 8 . 1 1 660 660 SER CA C 660 58.350 58.350 61.150 -2.800 18986 3766 1 8 . 1 1 660 660 SER CB C 660 59.504 59.504 62.556 -3.052 18986 3767 1 8 . 1 1 660 660 SER H H 660 8.777 8.777 8.465 0.312 18986 3768 1 8 . 1 1 661 661 ASN N N 661 119.986 119.986 121.219 -1.233 18986 3769 1 8 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.516 0.190 18986 3770 1 8 . 1 1 661 661 ASN C C 661 174.516 174.516 177.601 -3.085 18986 3771 1 8 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.139 -4.091 18986 3772 1 8 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.625 -1.882 18986 3773 1 8 . 1 1 661 661 ASN H H 661 7.486 7.486 7.831 -0.345 18986 3774 1 8 . 1 1 662 662 ILE N N 662 120.639 120.639 121.818 -1.179 18986 3775 1 8 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.654 -0.208 18986 3776 1 8 . 1 1 662 662 ILE C C 662 174.252 174.252 177.794 -3.542 18986 3777 1 8 . 1 1 662 662 ILE CA C 662 62.606 62.606 66.063 -3.457 18986 3778 1 8 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.895 -3.472 18986 3779 1 8 . 1 1 662 662 ILE H H 662 7.999 7.999 8.487 -0.488 18986 3780 1 8 . 1 1 663 663 GLU N N 663 117.706 117.706 118.974 -1.268 18986 3781 1 8 . 1 1 663 663 GLU HA H 663 3.790 3.790 4.134 -0.344 18986 3782 1 8 . 1 1 663 663 GLU C C 663 176.509 176.509 178.707 -2.198 18986 3783 1 8 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.360 -1.652 18986 3784 1 8 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.298 -2.543 18986 3785 1 8 . 1 1 663 663 GLU H H 663 8.190 8.190 8.394 -0.204 18986 3786 1 8 . 1 1 664 664 LYS N N 664 119.586 119.586 121.971 -2.385 18986 3787 1 8 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.005 0.048 18986 3788 1 8 . 1 1 664 664 LYS C C 664 175.941 175.941 178.785 -2.844 18986 3789 1 8 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.772 -3.191 18986 3790 1 8 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.224 -2.401 18986 3791 1 8 . 1 1 664 664 LYS H H 664 7.590 7.590 8.031 -0.441 18986 3792 1 8 . 1 1 665 665 LEU N N 665 119.756 119.756 119.671 0.085 18986 3793 1 8 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.005 0.075 18986 3794 1 8 . 1 1 665 665 LEU C C 665 176.700 176.700 179.411 -2.711 18986 3795 1 8 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.753 -2.368 18986 3796 1 8 . 1 1 665 665 LEU CB C 665 39.192 39.192 42.000 -2.808 18986 3797 1 8 . 1 1 665 665 LEU H H 665 8.075 8.075 8.339 -0.264 18986 3798 1 8 . 1 1 666 666 LEU N N 666 118.788 118.788 119.012 -0.224 18986 3799 1 8 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.671 0.093 18986 3800 1 8 . 1 1 666 666 LEU C C 666 176.484 176.484 178.698 -2.214 18986 3801 1 8 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.250 -2.592 18986 3802 1 8 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.215 -2.604 18986 3803 1 8 . 1 1 666 666 LEU H H 666 8.550 8.550 8.768 -0.218 18986 3804 1 8 . 1 1 667 667 THR N N 667 115.244 115.244 116.991 -1.747 18986 3805 1 8 . 1 1 667 667 THR HA H 667 3.839 3.839 3.812 0.027 18986 3806 1 8 . 1 1 667 667 THR C C 667 173.740 173.740 176.432 -2.692 18986 3807 1 8 . 1 1 667 667 THR CA C 667 64.378 64.378 67.651 -3.273 18986 3808 1 8 . 1 1 667 667 THR CB C 667 65.748 65.748 68.510 -2.762 18986 3809 1 8 . 1 1 667 667 THR H H 667 7.662 7.662 7.885 -0.223 18986 3810 1 8 . 1 1 668 668 ASP N N 668 122.862 122.862 122.125 0.737 18986 3811 1 8 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.338 0.045 18986 3812 1 8 . 1 1 668 668 ASP C C 668 177.192 177.192 178.743 -1.551 18986 3813 1 8 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.477 -2.346 18986 3814 1 8 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.593 -2.708 18986 3815 1 8 . 1 1 668 668 ASP H H 668 8.291 8.291 8.492 -0.201 18986 3816 1 8 . 1 1 669 669 MET N N 669 119.640 119.640 118.069 1.571 18986 3817 1 8 . 1 1 669 669 MET HA H 669 3.917 3.917 4.034 -0.117 18986 3818 1 8 . 1 1 669 669 MET C C 669 175.414 175.414 178.401 -2.987 18986 3819 1 8 . 1 1 669 669 MET CA C 669 57.234 57.234 59.407 -2.173 18986 3820 1 8 . 1 1 669 669 MET CB C 669 32.088 32.088 32.392 -0.305 18986 3821 1 8 . 1 1 669 669 MET H H 669 8.809 8.809 8.405 0.404 18986 3822 1 8 . 1 1 670 670 ARG N N 670 122.614 122.614 116.756 5.858 18986 3823 1 8 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.624 -0.107 18986 3824 1 8 . 1 1 670 670 ARG C C 670 177.928 177.928 178.603 -0.675 18986 3825 1 8 . 1 1 670 670 ARG CA C 670 56.222 56.222 57.839 -1.617 18986 3826 1 8 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.768 -2.464 18986 3827 1 8 . 1 1 670 670 ARG H H 670 8.450 8.450 8.008 0.442 18986 3828 1 8 . 1 1 671 671 LYS N N 671 121.976 121.976 119.608 2.368 18986 3829 1 8 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.248 -0.135 18986 3830 1 8 . 1 1 671 671 LYS C C 671 176.143 176.143 177.798 -1.655 18986 3831 1 8 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.198 -1.112 18986 3832 1 8 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.214 -2.710 18986 3833 1 8 . 1 1 671 671 LYS H H 671 8.609 8.609 8.165 0.444 18986 3834 1 8 . 1 1 672 672 SER N N 672 111.655 111.655 113.970 -2.315 18986 3835 1 8 . 1 1 672 672 SER HA H 672 4.469 4.469 4.449 0.020 18986 3836 1 8 . 1 1 672 672 SER C C 672 171.692 171.692 175.633 -3.941 18986 3837 1 8 . 1 1 672 672 SER CA C 672 56.790 56.790 59.187 -2.397 18986 3838 1 8 . 1 1 672 672 SER CB C 672 61.343 61.343 64.439 -3.095 18986 3839 1 8 . 1 1 672 672 SER H H 672 7.884 7.884 8.096 -0.212 18986 3840 1 8 . 1 1 673 673 GLY N N 673 108.029 108.029 108.317 -0.288 18986 3841 1 8 . 1 1 673 673 GLY C C 673 171.492 171.492 175.089 -3.597 18986 3842 1 8 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.168 -1.893 18986 3843 1 8 . 1 1 673 673 GLY H H 673 7.774 7.774 8.188 -0.414 18986 3844 1 8 . 1 1 674 674 ILE N N 674 116.193 116.193 120.399 -4.206 18986 3845 1 8 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.031 0.070 18986 3846 1 8 . 1 1 674 674 ILE C C 674 173.980 173.980 175.925 -1.945 18986 3847 1 8 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.648 -3.406 18986 3848 1 8 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.683 -1.879 18986 3849 1 8 . 1 1 674 674 ILE H H 674 8.026 8.026 8.448 -0.422 18986 3850 1 8 . 1 1 675 675 ILE N N 675 108.928 108.928 113.218 -4.290 18986 3851 1 8 . 1 1 675 675 ILE HA H 675 5.358 5.358 5.010 0.348 18986 3852 1 8 . 1 1 675 675 ILE C C 675 170.797 170.797 173.829 -3.032 18986 3853 1 8 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.666 -2.642 18986 3854 1 8 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.990 -2.504 18986 3855 1 8 . 1 1 675 675 ILE H H 675 7.120 7.120 7.306 -0.186 18986 3856 1 8 . 1 1 676 676 TYR N N 676 118.062 118.062 115.437 2.625 18986 3857 1 8 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.124 -0.129 18986 3858 1 8 . 1 1 676 676 TYR C C 676 170.020 170.020 173.913 -3.893 18986 3859 1 8 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.484 -2.591 18986 3860 1 8 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.076 -2.560 18986 3861 1 8 . 1 1 676 676 TYR H H 676 9.380 9.380 8.725 0.655 18986 3862 1 8 . 1 1 677 677 GLU N N 677 123.578 123.578 122.224 1.354 18986 3863 1 8 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.180 -0.354 18986 3864 1 8 . 1 1 677 677 GLU C C 677 172.146 172.146 175.672 -3.526 18986 3865 1 8 . 1 1 677 677 GLU CA C 677 52.476 52.476 57.718 -5.242 18986 3866 1 8 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.851 -3.239 18986 3867 1 8 . 1 1 677 677 GLU H H 677 8.951 8.951 8.940 0.011 18986 3868 1 8 . 1 1 678 678 ALA N N 678 133.220 133.220 129.027 4.193 18986 3869 1 8 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.604 -0.563 18986 3870 1 8 . 1 1 678 678 ALA C C 678 175.219 175.219 176.569 -1.350 18986 3871 1 8 . 1 1 678 678 ALA CA C 678 51.601 51.601 52.796 -1.195 18986 3872 1 8 . 1 1 678 678 ALA CB C 678 16.599 16.599 21.194 -4.595 18986 3873 1 8 . 1 1 678 678 ALA H H 678 7.912 7.912 8.938 -1.026 18986 3874 1 8 . 1 1 679 679 LYS N N 679 115.687 115.687 118.625 -2.938 18986 3875 1 8 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.706 -0.271 18986 3876 1 8 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.815 -1.799 18986 3877 1 8 . 1 1 679 679 LYS CB C 679 30.995 30.995 35.085 -4.090 18986 3878 1 8 . 1 1 679 679 LYS H H 679 8.215 8.215 7.787 0.428 18986 3879 1 8 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.205 -0.186 18986 3880 1 8 . 1 1 680 680 PRO C C 680 174.504 174.504 177.016 -2.512 18986 3881 1 8 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.299 -1.781 18986 3882 1 8 . 1 1 680 680 PRO CB C 680 28.315 28.315 30.768 -2.453 18986 3883 1 8 . 1 1 681 681 GLU N N 681 118.851 118.851 121.699 -2.848 18986 3884 1 8 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.832 -0.394 18986 3885 1 8 . 1 1 681 681 GLU C C 681 172.890 172.890 174.970 -2.080 18986 3886 1 8 . 1 1 681 681 GLU CA C 681 54.481 54.481 57.296 -2.815 18986 3887 1 8 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.319 -4.530 18986 3888 1 8 . 1 1 681 681 GLU H H 681 10.003 10.003 9.757 0.246 18986 3889 1 8 . 1 1 682 682 CYS N N 682 120.934 120.934 118.643 2.291 18986 3890 1 8 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.026 0.001 18986 3891 1 8 . 1 1 682 682 CYS C C 682 171.905 171.905 173.746 -1.841 18986 3892 1 8 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.263 -3.018 18986 3893 1 8 . 1 1 682 682 CYS CB C 682 45.295 45.295 29.075 16.220 18986 3894 1 8 . 1 1 682 682 CYS H H 682 7.860 7.860 8.696 -0.836 18986 3895 1 8 . 1 1 683 683 TYR N N 683 126.183 126.183 124.182 2.001 18986 3896 1 8 . 1 1 683 683 TYR HA H 683 5.224 5.224 4.930 0.294 18986 3897 1 8 . 1 1 683 683 TYR C C 683 173.008 173.008 174.817 -1.809 18986 3898 1 8 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.649 -1.081 18986 3899 1 8 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.192 0.760 18986 3900 1 8 . 1 1 683 683 TYR H H 683 9.297 9.297 8.915 0.382 18986 3901 1 8 . 1 1 684 684 LYS N N 684 118.604 118.604 117.935 0.669 18986 3902 1 8 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.635 -0.198 18986 3903 1 8 . 1 1 684 684 LYS C C 684 171.628 171.628 174.637 -3.009 18986 3904 1 8 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.844 -1.541 18986 3905 1 8 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.426 -1.749 18986 3906 1 8 . 1 1 684 684 LYS H H 684 8.630 8.630 8.768 -0.138 18986 3907 1 8 . 1 1 685 685 LYS N N 685 122.869 122.869 125.861 -2.992 18986 3908 1 8 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.084 0.560 18986 3909 1 8 . 1 1 685 685 LYS C C 685 173.337 173.337 176.984 -3.647 18986 3910 1 8 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.461 -3.208 18986 3911 1 8 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.830 -1.903 18986 3912 1 8 . 1 1 685 685 LYS H H 685 8.969 8.969 8.620 0.349 18986 3913 1 9 . 1 1 601 601 SER HA H 601 4.475 4.475 4.155 0.320 18986 3914 1 9 . 1 1 601 601 SER CA C 601 55.508 55.508 60.139 -4.631 18986 3915 1 9 . 1 1 601 601 SER CB C 601 61.220 61.220 61.853 -0.633 18986 3916 1 9 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.710 -0.094 18986 3917 1 9 . 1 1 602 602 HIS C C 602 172.320 172.320 174.273 -1.953 18986 3918 1 9 . 1 1 602 602 HIS CA C 602 53.854 53.854 54.688 -0.834 18986 3919 1 9 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.201 -2.118 18986 3920 1 9 . 1 1 603 603 MET N N 603 121.862 121.862 121.633 0.229 18986 3921 1 9 . 1 1 603 603 MET HA H 603 4.425 4.425 4.595 -0.170 18986 3922 1 9 . 1 1 603 603 MET C C 603 173.948 173.948 177.078 -3.130 18986 3923 1 9 . 1 1 603 603 MET CA C 603 53.108 53.108 55.206 -2.098 18986 3924 1 9 . 1 1 603 603 MET CB C 603 30.049 30.049 33.158 -3.109 18986 3925 1 9 . 1 1 603 603 MET H H 603 8.394 8.394 8.594 -0.200 18986 3926 1 9 . 1 1 604 604 GLY N N 604 110.382 110.382 108.812 1.570 18986 3927 1 9 . 1 1 604 604 GLY C C 604 171.590 171.590 173.783 -2.193 18986 3928 1 9 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.634 -2.017 18986 3929 1 9 . 1 1 604 604 GLY H H 604 8.411 8.411 9.233 -0.822 18986 3930 1 9 . 1 1 605 605 GLU N N 605 120.709 120.709 119.666 1.043 18986 3931 1 9 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.404 -0.097 18986 3932 1 9 . 1 1 605 605 GLU C C 605 174.220 174.220 176.847 -2.627 18986 3933 1 9 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.280 -2.314 18986 3934 1 9 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.700 -3.089 18986 3935 1 9 . 1 1 605 605 GLU H H 605 8.282 8.282 8.678 -0.396 18986 3936 1 9 . 1 1 606 606 SER N N 606 116.679 116.679 113.810 2.869 18986 3937 1 9 . 1 1 606 606 SER HA H 606 4.405 4.405 4.416 -0.011 18986 3938 1 9 . 1 1 606 606 SER C C 606 172.455 172.455 176.370 -3.915 18986 3939 1 9 . 1 1 606 606 SER CA C 606 56.028 56.028 58.603 -2.575 18986 3940 1 9 . 1 1 606 606 SER CB C 606 61.039 61.039 63.552 -2.513 18986 3941 1 9 . 1 1 606 606 SER H H 606 8.420 8.420 8.118 0.302 18986 3942 1 9 . 1 1 607 607 GLY N N 607 110.716 110.716 110.073 0.643 18986 3943 1 9 . 1 1 607 607 GLY C C 607 171.173 171.173 173.926 -2.753 18986 3944 1 9 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.833 -3.192 18986 3945 1 9 . 1 1 607 607 GLY H H 607 8.386 8.386 8.651 -0.265 18986 3946 1 9 . 1 1 608 608 LYS N N 608 120.785 120.785 120.179 0.606 18986 3947 1 9 . 1 1 608 608 LYS HA H 608 4.339 4.339 3.902 0.437 18986 3948 1 9 . 1 1 608 608 LYS C C 608 173.673 173.673 176.720 -3.047 18986 3949 1 9 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.343 -2.978 18986 3950 1 9 . 1 1 608 608 LYS CB C 608 30.531 30.531 31.753 -1.222 18986 3951 1 9 . 1 1 608 608 LYS H H 608 8.008 8.008 7.981 0.027 18986 3952 1 9 . 1 1 609 609 ILE N N 609 122.404 122.404 119.065 3.339 18986 3953 1 9 . 1 1 609 609 ILE HA H 609 4.149 4.149 3.924 0.225 18986 3954 1 9 . 1 1 609 609 ILE C C 609 172.675 172.675 175.544 -2.869 18986 3955 1 9 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.857 -2.854 18986 3956 1 9 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.262 -2.058 18986 3957 1 9 . 1 1 609 609 ILE H H 609 8.186 8.186 8.537 -0.351 18986 3958 1 9 . 1 1 610 610 ASP N N 610 125.357 125.357 119.016 6.341 18986 3959 1 9 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.431 0.272 18986 3960 1 9 . 1 1 610 610 ASP C C 610 173.668 173.668 177.419 -3.751 18986 3961 1 9 . 1 1 610 610 ASP CA C 610 50.702 50.702 55.141 -4.439 18986 3962 1 9 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.308 -2.618 18986 3963 1 9 . 1 1 610 610 ASP H H 610 8.369 8.369 7.724 0.645 18986 3964 1 9 . 1 1 611 611 ILE N N 611 122.494 122.494 121.158 1.336 18986 3965 1 9 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.736 0.173 18986 3966 1 9 . 1 1 611 611 ILE C C 611 173.618 173.618 177.266 -3.648 18986 3967 1 9 . 1 1 611 611 ILE CA C 611 60.040 60.040 65.010 -4.970 18986 3968 1 9 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.036 -2.239 18986 3969 1 9 . 1 1 611 611 ILE H H 611 8.284 8.284 8.379 -0.095 18986 3970 1 9 . 1 1 612 612 ASP N N 612 121.440 121.440 119.186 2.254 18986 3971 1 9 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.419 0.015 18986 3972 1 9 . 1 1 612 612 ASP C C 612 175.129 175.129 178.518 -3.389 18986 3973 1 9 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.915 -4.149 18986 3974 1 9 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.929 -1.791 18986 3975 1 9 . 1 1 612 612 ASP H H 612 8.279 8.279 8.576 -0.297 18986 3976 1 9 . 1 1 613 613 THR N N 613 114.422 114.422 113.842 0.580 18986 3977 1 9 . 1 1 613 613 THR HA H 613 4.106 4.106 4.165 -0.059 18986 3978 1 9 . 1 1 613 613 THR C C 613 173.338 173.338 175.353 -2.015 18986 3979 1 9 . 1 1 613 613 THR CA C 613 61.545 61.545 64.302 -2.756 18986 3980 1 9 . 1 1 613 613 THR CB C 613 66.267 66.267 68.703 -2.436 18986 3981 1 9 . 1 1 613 613 THR H H 613 7.866 7.866 7.636 0.230 18986 3982 1 9 . 1 1 614 614 ILE N N 614 121.654 121.654 119.643 2.011 18986 3983 1 9 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.962 0.067 18986 3984 1 9 . 1 1 614 614 ILE C C 614 174.471 174.471 177.314 -2.843 18986 3985 1 9 . 1 1 614 614 ILE CA C 614 60.173 60.173 64.028 -3.854 18986 3986 1 9 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.694 -2.878 18986 3987 1 9 . 1 1 614 614 ILE H H 614 7.819 7.819 7.259 0.560 18986 3988 1 9 . 1 1 615 615 MET N N 615 119.713 119.713 117.280 2.433 18986 3989 1 9 . 1 1 615 615 MET HA H 615 4.478 4.478 4.699 -0.221 18986 3990 1 9 . 1 1 615 615 MET C C 615 174.075 174.075 177.576 -3.501 18986 3991 1 9 . 1 1 615 615 MET CA C 615 52.764 52.764 57.809 -5.045 18986 3992 1 9 . 1 1 615 615 MET CB C 615 29.337 29.337 32.648 -3.312 18986 3993 1 9 . 1 1 615 615 MET H H 615 8.188 8.188 8.241 -0.053 18986 3994 1 9 . 1 1 616 616 THR N N 616 114.770 114.770 114.233 0.537 18986 3995 1 9 . 1 1 616 616 THR HA H 616 4.099 4.099 4.198 -0.099 18986 3996 1 9 . 1 1 616 616 THR C C 616 172.535 172.535 175.921 -3.386 18986 3997 1 9 . 1 1 616 616 THR CA C 616 61.112 61.112 64.975 -3.862 18986 3998 1 9 . 1 1 616 616 THR CB C 616 66.617 66.617 69.236 -2.619 18986 3999 1 9 . 1 1 616 616 THR H H 616 7.722 7.722 8.268 -0.546 18986 4000 1 9 . 1 1 617 617 GLY N N 617 111.384 111.384 107.858 3.526 18986 4001 1 9 . 1 1 617 617 GLY C C 617 171.437 171.437 173.858 -2.421 18986 4002 1 9 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.075 -2.633 18986 4003 1 9 . 1 1 617 617 GLY H H 617 8.431 8.431 7.560 0.871 18986 4004 1 9 . 1 1 618 618 LYS N N 618 120.996 120.996 120.551 0.445 18986 4005 1 9 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.826 -0.159 18986 4006 1 9 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.922 -2.094 18986 4007 1 9 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.804 -5.327 18986 4008 1 9 . 1 1 618 618 LYS H H 618 7.821 7.821 7.866 -0.045 18986 4009 1 9 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.649 -0.180 18986 4010 1 9 . 1 1 619 619 PRO C C 619 174.453 174.453 177.641 -3.188 18986 4011 1 9 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.433 -2.241 18986 4012 1 9 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.744 -3.164 18986 4013 1 9 . 1 1 620 620 LYS N N 620 123.464 123.464 120.062 3.402 18986 4014 1 9 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.972 0.074 18986 4015 1 9 . 1 1 620 620 LYS C C 620 174.895 174.895 178.677 -3.782 18986 4016 1 9 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.282 -2.993 18986 4017 1 9 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.347 -0.893 18986 4018 1 9 . 1 1 620 620 LYS H H 620 8.728 8.728 8.704 0.024 18986 4019 1 9 . 1 1 621 621 SER N N 621 113.921 113.921 114.575 -0.654 18986 4020 1 9 . 1 1 621 621 SER HA H 621 4.336 4.336 4.410 -0.074 18986 4021 1 9 . 1 1 621 621 SER C C 621 173.149 173.149 176.024 -2.875 18986 4022 1 9 . 1 1 621 621 SER CA C 621 56.691 56.691 60.154 -3.463 18986 4023 1 9 . 1 1 621 621 SER CB C 621 60.689 60.689 62.281 -1.592 18986 4024 1 9 . 1 1 621 621 SER H H 621 8.531 8.531 8.165 0.366 18986 4025 1 9 . 1 1 622 622 ALA N N 622 124.177 124.177 123.979 0.198 18986 4026 1 9 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.978 0.190 18986 4027 1 9 . 1 1 622 622 ALA C C 622 176.804 176.804 178.984 -2.180 18986 4028 1 9 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.482 -3.114 18986 4029 1 9 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.190 -2.336 18986 4030 1 9 . 1 1 622 622 ALA H H 622 7.835 7.835 8.161 -0.326 18986 4031 1 9 . 1 1 623 623 ARG N N 623 118.263 118.263 118.708 -0.445 18986 4032 1 9 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.954 -0.004 18986 4033 1 9 . 1 1 623 623 ARG C C 623 175.683 175.683 178.359 -2.676 18986 4034 1 9 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.098 -1.935 18986 4035 1 9 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.414 -1.963 18986 4036 1 9 . 1 1 623 623 ARG H H 623 8.148 8.148 8.261 -0.113 18986 4037 1 9 . 1 1 624 624 GLU N N 624 117.953 117.953 120.299 -2.346 18986 4038 1 9 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.019 -0.051 18986 4039 1 9 . 1 1 624 624 GLU C C 624 177.204 177.204 178.714 -1.510 18986 4040 1 9 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.325 -2.468 18986 4041 1 9 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.402 -2.435 18986 4042 1 9 . 1 1 624 624 GLU H H 624 8.143 8.143 8.465 -0.322 18986 4043 1 9 . 1 1 625 625 LYS N N 625 119.222 119.222 118.228 0.994 18986 4044 1 9 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.169 -0.312 18986 4045 1 9 . 1 1 625 625 LYS C C 625 175.480 175.480 179.230 -3.750 18986 4046 1 9 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.015 -1.528 18986 4047 1 9 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.837 -2.174 18986 4048 1 9 . 1 1 625 625 LYS H H 625 7.772 7.772 7.765 0.007 18986 4049 1 9 . 1 1 626 626 MET N N 626 117.883 117.883 118.800 -0.917 18986 4050 1 9 . 1 1 626 626 MET HA H 626 3.807 3.807 4.218 -0.411 18986 4051 1 9 . 1 1 626 626 MET C C 626 175.278 175.278 178.431 -3.153 18986 4052 1 9 . 1 1 626 626 MET CA C 626 57.782 57.782 57.686 0.096 18986 4053 1 9 . 1 1 626 626 MET CB C 626 30.657 30.657 32.014 -1.357 18986 4054 1 9 . 1 1 626 626 MET H H 626 8.367 8.367 8.573 -0.206 18986 4055 1 9 . 1 1 627 627 MET N N 627 116.185 116.185 117.426 -1.241 18986 4056 1 9 . 1 1 627 627 MET HA H 627 4.152 4.152 4.012 0.140 18986 4057 1 9 . 1 1 627 627 MET C C 627 176.393 176.393 178.359 -1.966 18986 4058 1 9 . 1 1 627 627 MET CA C 627 55.359 55.359 57.641 -2.282 18986 4059 1 9 . 1 1 627 627 MET CB C 627 28.803 28.803 31.077 -2.274 18986 4060 1 9 . 1 1 627 627 MET H H 627 8.197 8.197 8.786 -0.589 18986 4061 1 9 . 1 1 628 628 LYS N N 628 119.859 119.859 120.771 -0.912 18986 4062 1 9 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.211 -0.011 18986 4063 1 9 . 1 1 628 628 LYS C C 628 175.885 175.885 179.496 -3.611 18986 4064 1 9 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.505 -4.428 18986 4065 1 9 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.271 -3.740 18986 4066 1 9 . 1 1 628 628 LYS H H 628 7.700 7.700 7.719 -0.019 18986 4067 1 9 . 1 1 629 629 ILE N N 629 119.001 119.001 119.953 -0.952 18986 4068 1 9 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.636 -0.088 18986 4069 1 9 . 1 1 629 629 ILE C C 629 174.891 174.891 177.950 -3.059 18986 4070 1 9 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.447 -3.182 18986 4071 1 9 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.995 -4.146 18986 4072 1 9 . 1 1 629 629 ILE H H 629 7.970 7.970 8.240 -0.270 18986 4073 1 9 . 1 1 630 630 ILE N N 630 120.737 120.737 118.098 2.639 18986 4074 1 9 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.632 -0.165 18986 4075 1 9 . 1 1 630 630 ILE C C 630 173.875 173.875 177.626 -3.751 18986 4076 1 9 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.245 -2.491 18986 4077 1 9 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.877 -2.600 18986 4078 1 9 . 1 1 630 630 ILE H H 630 8.213 8.213 8.378 -0.165 18986 4079 1 9 . 1 1 631 631 GLU N N 631 119.546 119.546 121.244 -1.698 18986 4080 1 9 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.965 0.100 18986 4081 1 9 . 1 1 631 631 GLU C C 631 177.300 177.300 179.288 -1.988 18986 4082 1 9 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.992 -3.013 18986 4083 1 9 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.545 -2.552 18986 4084 1 9 . 1 1 631 631 GLU H H 631 7.742 7.742 8.086 -0.344 18986 4085 1 9 . 1 1 632 632 ILE N N 632 121.547 121.547 120.712 0.835 18986 4086 1 9 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.667 0.016 18986 4087 1 9 . 1 1 632 632 ILE C C 632 175.454 175.454 178.039 -2.585 18986 4088 1 9 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.702 -3.046 18986 4089 1 9 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.831 -2.001 18986 4090 1 9 . 1 1 632 632 ILE H H 632 8.013 8.013 8.294 -0.281 18986 4091 1 9 . 1 1 633 633 ILE N N 633 121.605 121.605 120.968 0.637 18986 4092 1 9 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.559 -0.224 18986 4093 1 9 . 1 1 633 633 ILE C C 633 174.558 174.558 178.098 -3.540 18986 4094 1 9 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.623 -1.704 18986 4095 1 9 . 1 1 633 633 ILE CB C 633 35.284 35.284 36.974 -1.690 18986 4096 1 9 . 1 1 633 633 ILE H H 633 8.594 8.594 8.300 0.294 18986 4097 1 9 . 1 1 634 634 ASP N N 634 118.706 118.706 120.349 -1.643 18986 4098 1 9 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.351 0.084 18986 4099 1 9 . 1 1 634 634 ASP C C 634 176.574 176.574 178.790 -2.216 18986 4100 1 9 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.659 -3.088 18986 4101 1 9 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.307 -2.393 18986 4102 1 9 . 1 1 634 634 ASP H H 634 8.724 8.724 8.481 0.243 18986 4103 1 9 . 1 1 635 635 SER N N 635 114.064 114.064 115.989 -1.925 18986 4104 1 9 . 1 1 635 635 SER HA H 635 4.232 4.232 4.211 0.021 18986 4105 1 9 . 1 1 635 635 SER C C 635 174.487 174.487 177.433 -2.946 18986 4106 1 9 . 1 1 635 635 SER CA C 635 58.540 58.540 61.192 -2.652 18986 4107 1 9 . 1 1 635 635 SER CB C 635 60.319 60.319 63.236 -2.917 18986 4108 1 9 . 1 1 635 635 SER H H 635 7.992 7.992 8.123 -0.131 18986 4109 1 9 . 1 1 636 636 LEU N N 636 122.493 122.493 122.499 -0.006 18986 4110 1 9 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.009 0.245 18986 4111 1 9 . 1 1 636 636 LEU C C 636 176.194 176.194 178.741 -2.547 18986 4112 1 9 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.888 -3.793 18986 4113 1 9 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.904 -2.197 18986 4114 1 9 . 1 1 636 636 LEU H H 636 8.169 8.169 8.385 -0.216 18986 4115 1 9 . 1 1 637 637 ALA N N 637 121.891 121.891 120.204 1.687 18986 4116 1 9 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.291 -0.202 18986 4117 1 9 . 1 1 637 637 ALA C C 637 175.131 175.131 179.729 -4.598 18986 4118 1 9 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.031 -3.695 18986 4119 1 9 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.292 -2.804 18986 4120 1 9 . 1 1 637 637 ALA H H 637 8.482 8.482 8.345 0.137 18986 4121 1 9 . 1 1 638 638 VAL N N 638 117.140 117.140 117.848 -0.708 18986 4122 1 9 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.867 0.068 18986 4123 1 9 . 1 1 638 638 VAL C C 638 174.712 174.712 176.554 -1.842 18986 4124 1 9 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.387 -2.386 18986 4125 1 9 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.991 -2.640 18986 4126 1 9 . 1 1 638 638 VAL H H 638 7.291 7.291 7.676 -0.385 18986 4127 1 9 . 1 1 639 639 SER N N 639 114.143 114.143 113.420 0.723 18986 4128 1 9 . 1 1 639 639 SER HA H 639 4.481 4.481 4.649 -0.168 18986 4129 1 9 . 1 1 639 639 SER C C 639 172.122 172.122 173.255 -1.133 18986 4130 1 9 . 1 1 639 639 SER CA C 639 56.002 56.002 58.240 -2.238 18986 4131 1 9 . 1 1 639 639 SER CB C 639 60.921 60.921 63.633 -2.712 18986 4132 1 9 . 1 1 639 639 SER H H 639 7.918 7.918 7.721 0.197 18986 4133 1 9 . 1 1 640 640 SER N N 640 115.370 115.370 116.363 -0.993 18986 4134 1 9 . 1 1 640 640 SER HA H 640 4.711 4.711 4.722 -0.011 18986 4135 1 9 . 1 1 640 640 SER C C 640 171.185 171.185 174.280 -3.095 18986 4136 1 9 . 1 1 640 640 SER CA C 640 55.009 55.009 57.526 -2.517 18986 4137 1 9 . 1 1 640 640 SER CB C 640 61.974 61.974 64.172 -2.198 18986 4138 1 9 . 1 1 640 640 SER H H 640 7.765 7.765 7.549 0.216 18986 4139 1 9 . 1 1 641 641 GLU N N 641 119.994 119.994 121.275 -1.281 18986 4140 1 9 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.247 -0.203 18986 4141 1 9 . 1 1 641 641 GLU C C 641 173.167 173.167 176.087 -2.920 18986 4142 1 9 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.140 -1.489 18986 4143 1 9 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.866 -2.382 18986 4144 1 9 . 1 1 641 641 GLU H H 641 8.363 8.363 8.779 -0.416 18986 4145 1 9 . 1 1 642 642 CYS N N 642 110.257 110.257 112.935 -2.678 18986 4146 1 9 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.881 -0.422 18986 4147 1 9 . 1 1 642 642 CYS C C 642 168.058 168.058 173.066 -5.008 18986 4148 1 9 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.266 -5.320 18986 4149 1 9 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.770 9.591 18986 4150 1 9 . 1 1 642 642 CYS H H 642 7.881 7.881 7.596 0.285 18986 4151 1 9 . 1 1 643 643 ALA N N 643 123.922 123.922 124.376 -0.454 18986 4152 1 9 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.428 0.210 18986 4153 1 9 . 1 1 643 643 ALA C C 643 172.517 172.517 176.287 -3.770 18986 4154 1 9 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.833 -4.213 18986 4155 1 9 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.049 -0.605 18986 4156 1 9 . 1 1 643 643 ALA H H 643 9.787 9.787 9.124 0.663 18986 4157 1 9 . 1 1 644 644 LYS N N 644 128.479 128.479 122.351 6.128 18986 4158 1 9 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.765 -0.254 18986 4159 1 9 . 1 1 644 644 LYS C C 644 176.945 176.945 177.058 -0.113 18986 4160 1 9 . 1 1 644 644 LYS CA C 644 54.338 54.338 55.176 -0.838 18986 4161 1 9 . 1 1 644 644 LYS CB C 644 29.942 29.942 33.611 -3.669 18986 4162 1 9 . 1 1 644 644 LYS H H 644 9.809 9.809 8.088 1.721 18986 4163 1 9 . 1 1 645 645 VAL N N 645 124.257 124.257 127.031 -2.774 18986 4164 1 9 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.540 0.108 18986 4165 1 9 . 1 1 645 645 VAL C C 645 173.996 173.996 177.307 -3.311 18986 4166 1 9 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.946 -2.084 18986 4167 1 9 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.320 -2.119 18986 4168 1 9 . 1 1 645 645 VAL H H 645 8.458 8.458 9.308 -0.850 18986 4169 1 9 . 1 1 646 646 LYS N N 646 117.598 117.598 120.097 -2.499 18986 4170 1 9 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.897 0.110 18986 4171 1 9 . 1 1 646 646 LYS C C 646 176.047 176.047 178.860 -2.813 18986 4172 1 9 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.172 -2.927 18986 4173 1 9 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.933 -2.535 18986 4174 1 9 . 1 1 646 646 LYS H H 646 8.706 8.706 7.845 0.861 18986 4175 1 9 . 1 1 647 647 ASP N N 647 119.229 119.229 119.220 0.009 18986 4176 1 9 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.475 0.143 18986 4177 1 9 . 1 1 647 647 ASP C C 647 175.211 175.211 178.574 -3.363 18986 4178 1 9 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.101 -2.778 18986 4179 1 9 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.928 -2.190 18986 4180 1 9 . 1 1 647 647 ASP H H 647 7.012 7.012 7.912 -0.900 18986 4181 1 9 . 1 1 648 648 ILE N N 648 121.939 121.939 120.881 1.058 18986 4182 1 9 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.662 -0.281 18986 4183 1 9 . 1 1 648 648 ILE C C 648 175.243 175.243 178.013 -2.770 18986 4184 1 9 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.168 -2.127 18986 4185 1 9 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.952 -1.990 18986 4186 1 9 . 1 1 648 648 ILE H H 648 8.152 8.152 7.555 0.597 18986 4187 1 9 . 1 1 649 649 LEU N N 649 117.310 117.310 120.641 -3.331 18986 4188 1 9 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.758 0.115 18986 4189 1 9 . 1 1 649 649 LEU C C 649 176.439 176.439 178.834 -2.395 18986 4190 1 9 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.648 -2.763 18986 4191 1 9 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.408 -2.102 18986 4192 1 9 . 1 1 649 649 LEU H H 649 8.638 8.638 8.721 -0.083 18986 4193 1 9 . 1 1 650 650 LYS N N 650 118.810 118.810 119.183 -0.373 18986 4194 1 9 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.912 0.134 18986 4195 1 9 . 1 1 650 650 LYS C C 650 176.801 176.801 179.062 -2.261 18986 4196 1 9 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.482 -2.431 18986 4197 1 9 . 1 1 650 650 LYS CB C 650 30.064 30.064 31.986 -1.922 18986 4198 1 9 . 1 1 650 650 LYS H H 650 7.296 7.296 7.868 -0.572 18986 4199 1 9 . 1 1 651 651 GLU N N 651 117.713 117.713 118.828 -1.115 18986 4200 1 9 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.061 0.047 18986 4201 1 9 . 1 1 651 651 GLU C C 651 176.903 176.903 179.016 -2.113 18986 4202 1 9 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.057 -3.247 18986 4203 1 9 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.238 -1.790 18986 4204 1 9 . 1 1 651 651 GLU H H 651 8.036 8.036 8.291 -0.255 18986 4205 1 9 . 1 1 652 652 ALA N N 652 121.206 121.206 121.952 -0.746 18986 4206 1 9 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.056 -0.058 18986 4207 1 9 . 1 1 652 652 ALA C C 652 176.766 176.766 179.965 -3.199 18986 4208 1 9 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.168 -3.434 18986 4209 1 9 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.131 -2.815 18986 4210 1 9 . 1 1 652 652 ALA H H 652 8.973 8.973 8.569 0.404 18986 4211 1 9 . 1 1 653 653 GLN N N 653 117.768 117.768 117.951 -0.183 18986 4212 1 9 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.297 0.180 18986 4213 1 9 . 1 1 653 653 GLN C C 653 177.388 177.388 179.004 -1.616 18986 4214 1 9 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.761 -2.701 18986 4215 1 9 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.794 -2.025 18986 4216 1 9 . 1 1 653 653 GLN H H 653 8.059 8.059 8.394 -0.335 18986 4217 1 9 . 1 1 654 654 GLN N N 654 117.979 117.979 119.356 -1.377 18986 4218 1 9 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.023 0.154 18986 4219 1 9 . 1 1 654 654 GLN C C 654 174.834 174.834 178.226 -3.392 18986 4220 1 9 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.579 -3.161 18986 4221 1 9 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.728 -2.751 18986 4222 1 9 . 1 1 654 654 GLN H H 654 7.495 7.495 8.065 -0.570 18986 4223 1 9 . 1 1 655 655 VAL N N 655 110.080 110.080 117.141 -7.061 18986 4224 1 9 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.828 0.699 18986 4225 1 9 . 1 1 655 655 VAL C C 655 173.369 173.369 177.029 -3.660 18986 4226 1 9 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.775 -6.707 18986 4227 1 9 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.225 -4.041 18986 4228 1 9 . 1 1 655 655 VAL H H 655 7.197 7.197 8.267 -1.070 18986 4229 1 9 . 1 1 656 656 GLY N N 656 107.089 107.089 105.714 1.375 18986 4230 1 9 . 1 1 656 656 GLY C C 656 171.639 171.639 174.490 -2.851 18986 4231 1 9 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.767 -1.456 18986 4232 1 9 . 1 1 656 656 GLY H H 656 7.541 7.541 7.833 -0.292 18986 4233 1 9 . 1 1 657 657 ILE N N 657 121.266 121.266 121.453 -0.187 18986 4234 1 9 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.192 -0.058 18986 4235 1 9 . 1 1 657 657 ILE C C 657 171.885 171.885 175.651 -3.766 18986 4236 1 9 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.265 -3.035 18986 4237 1 9 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.255 -4.064 18986 4238 1 9 . 1 1 657 657 ILE H H 657 7.633 7.633 8.425 -0.792 18986 4239 1 9 . 1 1 658 658 GLU N N 658 127.252 127.252 124.377 2.875 18986 4240 1 9 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.593 -0.390 18986 4241 1 9 . 1 1 658 658 GLU C C 658 175.316 175.316 178.101 -2.785 18986 4242 1 9 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.137 -1.777 18986 4243 1 9 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.402 -3.792 18986 4244 1 9 . 1 1 658 658 GLU H H 658 8.690 8.690 8.340 0.350 18986 4245 1 9 . 1 1 659 659 LYS N N 659 124.533 124.533 126.872 -2.339 18986 4246 1 9 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.823 -0.035 18986 4247 1 9 . 1 1 659 659 LYS C C 659 175.170 175.170 178.141 -2.971 18986 4248 1 9 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.260 -2.089 18986 4249 1 9 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.095 -1.978 18986 4250 1 9 . 1 1 659 659 LYS H H 659 8.706 8.706 9.259 -0.553 18986 4251 1 9 . 1 1 660 660 SER N N 660 113.137 113.137 113.298 -0.161 18986 4252 1 9 . 1 1 660 660 SER HA H 660 4.273 4.273 4.437 -0.164 18986 4253 1 9 . 1 1 660 660 SER C C 660 173.939 173.939 176.836 -2.897 18986 4254 1 9 . 1 1 660 660 SER CA C 660 58.350 58.350 61.633 -3.283 18986 4255 1 9 . 1 1 660 660 SER CB C 660 59.504 59.504 62.562 -3.058 18986 4256 1 9 . 1 1 660 660 SER H H 660 8.777 8.777 8.664 0.113 18986 4257 1 9 . 1 1 661 661 ASN N N 661 119.986 119.986 120.874 -0.888 18986 4258 1 9 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.450 0.256 18986 4259 1 9 . 1 1 661 661 ASN C C 661 174.516 174.516 177.414 -2.898 18986 4260 1 9 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.433 -4.385 18986 4261 1 9 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.607 -1.864 18986 4262 1 9 . 1 1 661 661 ASN H H 661 7.486 7.486 8.394 -0.908 18986 4263 1 9 . 1 1 662 662 ILE N N 662 120.639 120.639 120.640 -0.001 18986 4264 1 9 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.706 -0.260 18986 4265 1 9 . 1 1 662 662 ILE C C 662 174.252 174.252 177.497 -3.245 18986 4266 1 9 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.167 -2.561 18986 4267 1 9 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.929 -3.506 18986 4268 1 9 . 1 1 662 662 ILE H H 662 7.999 7.999 8.097 -0.098 18986 4269 1 9 . 1 1 663 663 GLU N N 663 117.706 117.706 120.531 -2.825 18986 4270 1 9 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.843 -0.053 18986 4271 1 9 . 1 1 663 663 GLU C C 663 176.509 176.509 178.613 -2.104 18986 4272 1 9 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.074 -2.366 18986 4273 1 9 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.287 -2.532 18986 4274 1 9 . 1 1 663 663 GLU H H 663 8.190 8.190 8.199 -0.009 18986 4275 1 9 . 1 1 664 664 LYS N N 664 119.586 119.586 121.034 -1.448 18986 4276 1 9 . 1 1 664 664 LYS HA H 664 4.053 4.053 3.979 0.074 18986 4277 1 9 . 1 1 664 664 LYS C C 664 175.941 175.941 178.870 -2.929 18986 4278 1 9 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.657 -3.076 18986 4279 1 9 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.367 -2.544 18986 4280 1 9 . 1 1 664 664 LYS H H 664 7.590 7.590 8.310 -0.720 18986 4281 1 9 . 1 1 665 665 LEU N N 665 119.756 119.756 120.087 -0.331 18986 4282 1 9 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.963 0.117 18986 4283 1 9 . 1 1 665 665 LEU C C 665 176.700 176.700 179.138 -2.438 18986 4284 1 9 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.041 -2.656 18986 4285 1 9 . 1 1 665 665 LEU CB C 665 39.192 39.192 42.053 -2.861 18986 4286 1 9 . 1 1 665 665 LEU H H 665 8.075 8.075 8.314 -0.239 18986 4287 1 9 . 1 1 666 666 LEU N N 666 118.788 118.788 118.658 0.130 18986 4288 1 9 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.758 0.006 18986 4289 1 9 . 1 1 666 666 LEU C C 666 176.484 176.484 179.042 -2.558 18986 4290 1 9 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.178 -2.519 18986 4291 1 9 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.661 -2.050 18986 4292 1 9 . 1 1 666 666 LEU H H 666 8.550 8.550 8.661 -0.111 18986 4293 1 9 . 1 1 667 667 THR N N 667 115.244 115.244 116.277 -1.033 18986 4294 1 9 . 1 1 667 667 THR HA H 667 3.839 3.839 3.988 -0.149 18986 4295 1 9 . 1 1 667 667 THR C C 667 173.740 173.740 176.376 -2.636 18986 4296 1 9 . 1 1 667 667 THR CA C 667 64.378 64.378 67.737 -3.360 18986 4297 1 9 . 1 1 667 667 THR CB C 667 65.748 65.748 68.518 -2.770 18986 4298 1 9 . 1 1 667 667 THR H H 667 7.662 7.662 8.109 -0.447 18986 4299 1 9 . 1 1 668 668 ASP N N 668 122.862 122.862 122.274 0.588 18986 4300 1 9 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.378 0.005 18986 4301 1 9 . 1 1 668 668 ASP C C 668 177.192 177.192 178.341 -1.149 18986 4302 1 9 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.423 -2.292 18986 4303 1 9 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.918 -3.032 18986 4304 1 9 . 1 1 668 668 ASP H H 668 8.291 8.291 8.219 0.072 18986 4305 1 9 . 1 1 669 669 MET N N 669 119.640 119.640 118.493 1.147 18986 4306 1 9 . 1 1 669 669 MET HA H 669 3.917 3.917 4.010 -0.093 18986 4307 1 9 . 1 1 669 669 MET C C 669 175.414 175.414 178.774 -3.360 18986 4308 1 9 . 1 1 669 669 MET CA C 669 57.234 57.234 59.556 -2.322 18986 4309 1 9 . 1 1 669 669 MET CB C 669 32.088 32.088 32.578 -0.490 18986 4310 1 9 . 1 1 669 669 MET H H 669 8.809 8.809 8.410 0.399 18986 4311 1 9 . 1 1 670 670 ARG N N 670 122.614 122.614 117.047 5.567 18986 4312 1 9 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.572 -0.055 18986 4313 1 9 . 1 1 670 670 ARG C C 670 177.928 177.928 178.835 -0.907 18986 4314 1 9 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.309 -2.087 18986 4315 1 9 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.923 -2.619 18986 4316 1 9 . 1 1 670 670 ARG H H 670 8.450 8.450 8.331 0.119 18986 4317 1 9 . 1 1 671 671 LYS N N 671 121.976 121.976 119.243 2.733 18986 4318 1 9 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.235 -0.122 18986 4319 1 9 . 1 1 671 671 LYS C C 671 176.143 176.143 178.036 -1.893 18986 4320 1 9 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.255 -1.169 18986 4321 1 9 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.570 -3.066 18986 4322 1 9 . 1 1 671 671 LYS H H 671 8.609 8.609 7.976 0.633 18986 4323 1 9 . 1 1 672 672 SER N N 672 111.655 111.655 111.845 -0.190 18986 4324 1 9 . 1 1 672 672 SER HA H 672 4.469 4.469 4.486 -0.017 18986 4325 1 9 . 1 1 672 672 SER C C 672 171.692 171.692 175.313 -3.621 18986 4326 1 9 . 1 1 672 672 SER CA C 672 56.790 56.790 58.846 -2.055 18986 4327 1 9 . 1 1 672 672 SER CB C 672 61.343 61.343 64.638 -3.295 18986 4328 1 9 . 1 1 672 672 SER H H 672 7.884 7.884 8.275 -0.391 18986 4329 1 9 . 1 1 673 673 GLY N N 673 108.029 108.029 108.212 -0.183 18986 4330 1 9 . 1 1 673 673 GLY C C 673 171.492 171.492 174.983 -3.491 18986 4331 1 9 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.163 -1.888 18986 4332 1 9 . 1 1 673 673 GLY H H 673 7.774 7.774 8.139 -0.365 18986 4333 1 9 . 1 1 674 674 ILE N N 674 116.193 116.193 121.071 -4.878 18986 4334 1 9 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.105 -0.004 18986 4335 1 9 . 1 1 674 674 ILE C C 674 173.980 173.980 175.693 -1.713 18986 4336 1 9 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.286 -3.044 18986 4337 1 9 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.840 -2.036 18986 4338 1 9 . 1 1 674 674 ILE H H 674 8.026 8.026 8.211 -0.185 18986 4339 1 9 . 1 1 675 675 ILE N N 675 108.928 108.928 113.347 -4.419 18986 4340 1 9 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.610 0.748 18986 4341 1 9 . 1 1 675 675 ILE C C 675 170.797 170.797 173.661 -2.864 18986 4342 1 9 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.720 -2.696 18986 4343 1 9 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.917 -2.431 18986 4344 1 9 . 1 1 675 675 ILE H H 675 7.120 7.120 7.312 -0.192 18986 4345 1 9 . 1 1 676 676 TYR N N 676 118.062 118.062 116.310 1.752 18986 4346 1 9 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.035 -0.040 18986 4347 1 9 . 1 1 676 676 TYR C C 676 170.020 170.020 173.914 -3.894 18986 4348 1 9 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.164 -2.271 18986 4349 1 9 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.524 -2.008 18986 4350 1 9 . 1 1 676 676 TYR H H 676 9.380 9.380 8.876 0.504 18986 4351 1 9 . 1 1 677 677 GLU N N 677 123.578 123.578 121.952 1.626 18986 4352 1 9 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.183 0.643 18986 4353 1 9 . 1 1 677 677 GLU C C 677 172.146 172.146 175.635 -3.489 18986 4354 1 9 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.937 -3.461 18986 4355 1 9 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.903 -2.291 18986 4356 1 9 . 1 1 677 677 GLU H H 677 8.951 8.951 8.859 0.092 18986 4357 1 9 . 1 1 678 678 ALA N N 678 133.220 133.220 131.162 2.058 18986 4358 1 9 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.310 -0.269 18986 4359 1 9 . 1 1 678 678 ALA C C 678 175.219 175.219 176.887 -1.668 18986 4360 1 9 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.633 -2.031 18986 4361 1 9 . 1 1 678 678 ALA CB C 678 16.599 16.599 20.189 -3.590 18986 4362 1 9 . 1 1 678 678 ALA H H 678 7.912 7.912 8.767 -0.855 18986 4363 1 9 . 1 1 679 679 LYS N N 679 115.687 115.687 115.671 0.016 18986 4364 1 9 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.706 -0.271 18986 4365 1 9 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.713 -1.697 18986 4366 1 9 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.616 -2.621 18986 4367 1 9 . 1 1 679 679 LYS H H 679 8.215 8.215 7.998 0.217 18986 4368 1 9 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.262 -0.243 18986 4369 1 9 . 1 1 680 680 PRO C C 680 174.504 174.504 176.700 -2.196 18986 4370 1 9 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.399 -1.881 18986 4371 1 9 . 1 1 680 680 PRO CB C 680 28.315 28.315 30.963 -2.648 18986 4372 1 9 . 1 1 681 681 GLU N N 681 118.851 118.851 118.085 0.766 18986 4373 1 9 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.020 -0.582 18986 4374 1 9 . 1 1 681 681 GLU C C 681 172.890 172.890 174.971 -2.081 18986 4375 1 9 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.140 -3.659 18986 4376 1 9 . 1 1 681 681 GLU CB C 681 24.789 24.789 27.882 -3.093 18986 4377 1 9 . 1 1 681 681 GLU H H 681 10.003 10.003 8.766 1.237 18986 4378 1 9 . 1 1 682 682 CYS N N 682 120.934 120.934 117.020 3.914 18986 4379 1 9 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.515 -0.488 18986 4380 1 9 . 1 1 682 682 CYS C C 682 171.905 171.905 173.753 -1.848 18986 4381 1 9 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.624 -3.380 18986 4382 1 9 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.469 13.826 18986 4383 1 9 . 1 1 682 682 CYS H H 682 7.860 7.860 8.013 -0.153 18986 4384 1 9 . 1 1 683 683 TYR N N 683 126.183 126.183 122.146 4.037 18986 4385 1 9 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.419 -0.195 18986 4386 1 9 . 1 1 683 683 TYR C C 683 173.008 173.008 174.203 -1.195 18986 4387 1 9 . 1 1 683 683 TYR CA C 683 56.568 56.568 56.729 -0.161 18986 4388 1 9 . 1 1 683 683 TYR CB C 683 40.952 40.952 42.823 -1.871 18986 4389 1 9 . 1 1 683 683 TYR H H 683 9.297 9.297 9.477 -0.180 18986 4390 1 9 . 1 1 684 684 LYS N N 684 118.604 118.604 120.149 -1.545 18986 4391 1 9 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.844 -0.407 18986 4392 1 9 . 1 1 684 684 LYS C C 684 171.628 171.628 174.980 -3.352 18986 4393 1 9 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.899 -1.596 18986 4394 1 9 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.718 -2.041 18986 4395 1 9 . 1 1 684 684 LYS H H 684 8.630 8.630 9.294 -0.664 18986 4396 1 9 . 1 1 685 685 LYS N N 685 122.869 122.869 126.596 -3.727 18986 4397 1 9 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.056 0.588 18986 4398 1 9 . 1 1 685 685 LYS C C 685 173.337 173.337 176.974 -3.637 18986 4399 1 9 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.217 -1.964 18986 4400 1 9 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.139 -1.212 18986 4401 1 9 . 1 1 685 685 LYS H H 685 8.969 8.969 8.695 0.274 18986 4402 1 10 . 1 1 601 601 SER HA H 601 4.475 4.475 4.596 -0.121 18986 4403 1 10 . 1 1 601 601 SER CA C 601 55.508 55.508 57.590 -2.082 18986 4404 1 10 . 1 1 601 601 SER CB C 601 61.220 61.220 64.342 -3.122 18986 4405 1 10 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.833 -0.217 18986 4406 1 10 . 1 1 602 602 HIS C C 602 172.320 172.320 172.959 -0.639 18986 4407 1 10 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.558 -1.704 18986 4408 1 10 . 1 1 602 602 HIS CB C 602 28.083 28.083 31.470 -3.387 18986 4409 1 10 . 1 1 603 603 MET N N 603 121.862 121.862 119.925 1.937 18986 4410 1 10 . 1 1 603 603 MET HA H 603 4.425 4.425 4.428 -0.003 18986 4411 1 10 . 1 1 603 603 MET C C 603 173.948 173.948 175.761 -1.813 18986 4412 1 10 . 1 1 603 603 MET CA C 603 53.108 53.108 56.358 -3.249 18986 4413 1 10 . 1 1 603 603 MET CB C 603 30.049 30.049 33.598 -3.549 18986 4414 1 10 . 1 1 603 603 MET H H 603 8.394 8.394 9.676 -1.282 18986 4415 1 10 . 1 1 604 604 GLY N N 604 110.382 110.382 107.103 3.279 18986 4416 1 10 . 1 1 604 604 GLY C C 604 171.590 171.590 174.146 -2.556 18986 4417 1 10 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.761 -2.144 18986 4418 1 10 . 1 1 604 604 GLY H H 604 8.411 8.411 8.248 0.163 18986 4419 1 10 . 1 1 605 605 GLU N N 605 120.709 120.709 120.514 0.195 18986 4420 1 10 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.293 0.014 18986 4421 1 10 . 1 1 605 605 GLU C C 605 174.220 174.220 177.956 -3.736 18986 4422 1 10 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.418 -2.452 18986 4423 1 10 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.015 -2.404 18986 4424 1 10 . 1 1 605 605 GLU H H 605 8.282 8.282 8.232 0.050 18986 4425 1 10 . 1 1 606 606 SER N N 606 116.679 116.679 121.708 -5.029 18986 4426 1 10 . 1 1 606 606 SER HA H 606 4.405 4.405 4.228 0.177 18986 4427 1 10 . 1 1 606 606 SER C C 606 172.455 172.455 175.946 -3.491 18986 4428 1 10 . 1 1 606 606 SER CA C 606 56.028 56.028 59.503 -3.475 18986 4429 1 10 . 1 1 606 606 SER CB C 606 61.039 61.039 63.182 -2.143 18986 4430 1 10 . 1 1 606 606 SER H H 606 8.420 8.420 8.435 -0.015 18986 4431 1 10 . 1 1 607 607 GLY N N 607 110.716 110.716 110.052 0.664 18986 4432 1 10 . 1 1 607 607 GLY C C 607 171.173 171.173 174.125 -2.952 18986 4433 1 10 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.265 -2.624 18986 4434 1 10 . 1 1 607 607 GLY H H 607 8.386 8.386 8.098 0.288 18986 4435 1 10 . 1 1 608 608 LYS N N 608 120.785 120.785 121.951 -1.166 18986 4436 1 10 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.539 -0.200 18986 4437 1 10 . 1 1 608 608 LYS C C 608 173.673 173.673 175.770 -2.097 18986 4438 1 10 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.514 -3.150 18986 4439 1 10 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.380 -2.849 18986 4440 1 10 . 1 1 608 608 LYS H H 608 8.008 8.008 8.324 -0.316 18986 4441 1 10 . 1 1 609 609 ILE N N 609 122.404 122.404 117.474 4.930 18986 4442 1 10 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.062 0.087 18986 4443 1 10 . 1 1 609 609 ILE C C 609 172.675 172.675 174.576 -1.901 18986 4444 1 10 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.434 -2.431 18986 4445 1 10 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.893 -2.689 18986 4446 1 10 . 1 1 609 609 ILE H H 609 8.186 8.186 7.650 0.536 18986 4447 1 10 . 1 1 610 610 ASP N N 610 125.357 125.357 120.017 5.340 18986 4448 1 10 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.445 0.258 18986 4449 1 10 . 1 1 610 610 ASP C C 610 173.668 173.668 177.303 -3.635 18986 4450 1 10 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.719 -3.017 18986 4451 1 10 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.218 -2.529 18986 4452 1 10 . 1 1 610 610 ASP H H 610 8.369 8.369 7.853 0.516 18986 4453 1 10 . 1 1 611 611 ILE N N 611 122.494 122.494 121.145 1.349 18986 4454 1 10 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.750 0.159 18986 4455 1 10 . 1 1 611 611 ILE C C 611 173.618 173.618 177.226 -3.608 18986 4456 1 10 . 1 1 611 611 ILE CA C 611 60.040 60.040 64.403 -4.363 18986 4457 1 10 . 1 1 611 611 ILE CB C 611 35.798 35.798 37.860 -2.062 18986 4458 1 10 . 1 1 611 611 ILE H H 611 8.284 8.284 8.543 -0.259 18986 4459 1 10 . 1 1 612 612 ASP N N 612 121.440 121.440 118.615 2.825 18986 4460 1 10 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.493 -0.059 18986 4461 1 10 . 1 1 612 612 ASP C C 612 175.129 175.129 178.903 -3.774 18986 4462 1 10 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.314 -4.548 18986 4463 1 10 . 1 1 612 612 ASP CB C 612 38.138 38.138 40.172 -2.034 18986 4464 1 10 . 1 1 612 612 ASP H H 612 8.279 8.279 8.448 -0.169 18986 4465 1 10 . 1 1 613 613 THR N N 613 114.422 114.422 116.166 -1.744 18986 4466 1 10 . 1 1 613 613 THR HA H 613 4.106 4.106 3.897 0.209 18986 4467 1 10 . 1 1 613 613 THR C C 613 173.338 173.338 175.819 -2.481 18986 4468 1 10 . 1 1 613 613 THR CA C 613 61.545 61.545 65.755 -4.210 18986 4469 1 10 . 1 1 613 613 THR CB C 613 66.267 66.267 68.720 -2.453 18986 4470 1 10 . 1 1 613 613 THR H H 613 7.866 7.866 8.243 -0.377 18986 4471 1 10 . 1 1 614 614 ILE N N 614 121.654 121.654 119.006 2.648 18986 4472 1 10 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.939 0.090 18986 4473 1 10 . 1 1 614 614 ILE C C 614 174.471 174.471 177.767 -3.296 18986 4474 1 10 . 1 1 614 614 ILE CA C 614 60.173 60.173 62.063 -1.890 18986 4475 1 10 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.697 -1.882 18986 4476 1 10 . 1 1 614 614 ILE H H 614 7.819 7.819 7.761 0.058 18986 4477 1 10 . 1 1 615 615 MET N N 615 119.713 119.713 117.323 2.390 18986 4478 1 10 . 1 1 615 615 MET HA H 615 4.478 4.478 4.661 -0.183 18986 4479 1 10 . 1 1 615 615 MET C C 615 174.075 174.075 178.065 -3.990 18986 4480 1 10 . 1 1 615 615 MET CA C 615 52.764 52.764 57.309 -4.545 18986 4481 1 10 . 1 1 615 615 MET CB C 615 29.337 29.337 32.088 -2.751 18986 4482 1 10 . 1 1 615 615 MET H H 615 8.188 8.188 8.233 -0.045 18986 4483 1 10 . 1 1 616 616 THR N N 616 114.770 114.770 114.453 0.317 18986 4484 1 10 . 1 1 616 616 THR HA H 616 4.099 4.099 4.210 -0.111 18986 4485 1 10 . 1 1 616 616 THR C C 616 172.535 172.535 175.759 -3.224 18986 4486 1 10 . 1 1 616 616 THR CA C 616 61.112 61.112 64.300 -3.188 18986 4487 1 10 . 1 1 616 616 THR CB C 616 66.617 66.617 69.333 -2.716 18986 4488 1 10 . 1 1 616 616 THR H H 616 7.722 7.722 8.316 -0.594 18986 4489 1 10 . 1 1 617 617 GLY N N 617 111.384 111.384 106.089 5.295 18986 4490 1 10 . 1 1 617 617 GLY C C 617 171.437 171.437 173.510 -2.073 18986 4491 1 10 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.299 -2.857 18986 4492 1 10 . 1 1 617 617 GLY H H 617 8.431 8.431 7.957 0.474 18986 4493 1 10 . 1 1 618 618 LYS N N 618 120.996 120.996 120.906 0.090 18986 4494 1 10 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.852 -0.185 18986 4495 1 10 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.859 -2.031 18986 4496 1 10 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.607 -5.130 18986 4497 1 10 . 1 1 618 618 LYS H H 618 7.821 7.821 8.032 -0.211 18986 4498 1 10 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.537 -0.068 18986 4499 1 10 . 1 1 619 619 PRO C C 619 174.453 174.453 178.057 -3.604 18986 4500 1 10 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.642 -2.450 18986 4501 1 10 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.514 -2.934 18986 4502 1 10 . 1 1 620 620 LYS N N 620 123.464 123.464 125.012 -1.548 18986 4503 1 10 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.879 0.167 18986 4504 1 10 . 1 1 620 620 LYS C C 620 174.895 174.895 178.351 -3.456 18986 4505 1 10 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.687 -3.398 18986 4506 1 10 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.411 -0.957 18986 4507 1 10 . 1 1 620 620 LYS H H 620 8.728 8.728 8.674 0.054 18986 4508 1 10 . 1 1 621 621 SER N N 621 113.921 113.921 114.273 -0.352 18986 4509 1 10 . 1 1 621 621 SER HA H 621 4.336 4.336 4.217 0.119 18986 4510 1 10 . 1 1 621 621 SER C C 621 173.149 173.149 176.644 -3.495 18986 4511 1 10 . 1 1 621 621 SER CA C 621 56.691 56.691 59.932 -3.241 18986 4512 1 10 . 1 1 621 621 SER CB C 621 60.689 60.689 62.434 -1.745 18986 4513 1 10 . 1 1 621 621 SER H H 621 8.531 8.531 8.336 0.195 18986 4514 1 10 . 1 1 622 622 ALA N N 622 124.177 124.177 126.260 -2.083 18986 4515 1 10 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.990 0.178 18986 4516 1 10 . 1 1 622 622 ALA C C 622 176.804 176.804 178.775 -1.971 18986 4517 1 10 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.127 -2.759 18986 4518 1 10 . 1 1 622 622 ALA CB C 622 15.854 15.854 17.907 -2.053 18986 4519 1 10 . 1 1 622 622 ALA H H 622 7.835 7.835 8.388 -0.553 18986 4520 1 10 . 1 1 623 623 ARG N N 623 118.263 118.263 119.186 -0.923 18986 4521 1 10 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.940 0.010 18986 4522 1 10 . 1 1 623 623 ARG C C 623 175.683 175.683 178.302 -2.619 18986 4523 1 10 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.386 -2.223 18986 4524 1 10 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.466 -2.015 18986 4525 1 10 . 1 1 623 623 ARG H H 623 8.148 8.148 7.896 0.252 18986 4526 1 10 . 1 1 624 624 GLU N N 624 117.953 117.953 119.641 -1.688 18986 4527 1 10 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.210 -0.242 18986 4528 1 10 . 1 1 624 624 GLU C C 624 177.204 177.204 178.043 -0.839 18986 4529 1 10 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.605 -1.748 18986 4530 1 10 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.429 -2.462 18986 4531 1 10 . 1 1 624 624 GLU H H 624 8.143 8.143 8.262 -0.119 18986 4532 1 10 . 1 1 625 625 LYS N N 625 119.222 119.222 117.265 1.957 18986 4533 1 10 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.391 -0.534 18986 4534 1 10 . 1 1 625 625 LYS C C 625 175.480 175.480 178.347 -2.867 18986 4535 1 10 . 1 1 625 625 LYS CA C 625 57.487 57.487 57.987 -0.500 18986 4536 1 10 . 1 1 625 625 LYS CB C 625 30.663 30.663 33.169 -2.506 18986 4537 1 10 . 1 1 625 625 LYS H H 625 7.772 7.772 7.927 -0.155 18986 4538 1 10 . 1 1 626 626 MET N N 626 117.883 117.883 120.993 -3.110 18986 4539 1 10 . 1 1 626 626 MET HA H 626 3.807 3.807 4.143 -0.336 18986 4540 1 10 . 1 1 626 626 MET C C 626 175.278 175.278 178.616 -3.338 18986 4541 1 10 . 1 1 626 626 MET CA C 626 57.782 57.782 59.339 -1.557 18986 4542 1 10 . 1 1 626 626 MET CB C 626 30.657 30.657 32.962 -2.305 18986 4543 1 10 . 1 1 626 626 MET H H 626 8.367 8.367 8.449 -0.082 18986 4544 1 10 . 1 1 627 627 MET N N 627 116.185 116.185 116.211 -0.026 18986 4545 1 10 . 1 1 627 627 MET HA H 627 4.152 4.152 4.143 0.009 18986 4546 1 10 . 1 1 627 627 MET C C 627 176.393 176.393 178.627 -2.234 18986 4547 1 10 . 1 1 627 627 MET CA C 627 55.359 55.359 56.769 -1.410 18986 4548 1 10 . 1 1 627 627 MET CB C 627 28.803 28.803 30.790 -1.986 18986 4549 1 10 . 1 1 627 627 MET H H 627 8.197 8.197 8.671 -0.474 18986 4550 1 10 . 1 1 628 628 LYS N N 628 119.859 119.859 121.477 -1.618 18986 4551 1 10 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.195 0.005 18986 4552 1 10 . 1 1 628 628 LYS C C 628 175.885 175.885 179.015 -3.130 18986 4553 1 10 . 1 1 628 628 LYS CA C 628 55.077 55.077 58.648 -3.571 18986 4554 1 10 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.405 -3.874 18986 4555 1 10 . 1 1 628 628 LYS H H 628 7.700 7.700 7.496 0.204 18986 4556 1 10 . 1 1 629 629 ILE N N 629 119.001 119.001 120.308 -1.307 18986 4557 1 10 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.626 -0.078 18986 4558 1 10 . 1 1 629 629 ILE C C 629 174.891 174.891 178.065 -3.174 18986 4559 1 10 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.550 -3.285 18986 4560 1 10 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.988 -4.139 18986 4561 1 10 . 1 1 629 629 ILE H H 629 7.970 7.970 8.294 -0.324 18986 4562 1 10 . 1 1 630 630 ILE N N 630 120.737 120.737 116.716 4.021 18986 4563 1 10 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.546 -0.079 18986 4564 1 10 . 1 1 630 630 ILE C C 630 173.875 173.875 177.499 -3.624 18986 4565 1 10 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.837 -3.083 18986 4566 1 10 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.989 -2.712 18986 4567 1 10 . 1 1 630 630 ILE H H 630 8.213 8.213 8.146 0.067 18986 4568 1 10 . 1 1 631 631 GLU N N 631 119.546 119.546 121.251 -1.705 18986 4569 1 10 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.992 0.073 18986 4570 1 10 . 1 1 631 631 GLU C C 631 177.300 177.300 178.819 -1.519 18986 4571 1 10 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.615 -2.635 18986 4572 1 10 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.608 -2.615 18986 4573 1 10 . 1 1 631 631 GLU H H 631 7.742 7.742 7.413 0.329 18986 4574 1 10 . 1 1 632 632 ILE N N 632 121.547 121.547 119.573 1.974 18986 4575 1 10 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.729 -0.046 18986 4576 1 10 . 1 1 632 632 ILE C C 632 175.454 175.454 178.710 -3.256 18986 4577 1 10 . 1 1 632 632 ILE CA C 632 62.656 62.656 63.984 -1.328 18986 4578 1 10 . 1 1 632 632 ILE CB C 632 35.830 35.830 36.437 -0.607 18986 4579 1 10 . 1 1 632 632 ILE H H 632 8.013 8.013 8.464 -0.451 18986 4580 1 10 . 1 1 633 633 ILE N N 633 121.605 121.605 120.807 0.798 18986 4581 1 10 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.579 -0.244 18986 4582 1 10 . 1 1 633 633 ILE C C 633 174.558 174.558 178.363 -3.805 18986 4583 1 10 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.881 -1.962 18986 4584 1 10 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.047 -1.763 18986 4585 1 10 . 1 1 633 633 ILE H H 633 8.594 8.594 8.028 0.566 18986 4586 1 10 . 1 1 634 634 ASP N N 634 118.706 118.706 120.816 -2.110 18986 4587 1 10 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.437 -0.002 18986 4588 1 10 . 1 1 634 634 ASP C C 634 176.574 176.574 179.041 -2.467 18986 4589 1 10 . 1 1 634 634 ASP CA C 634 54.571 54.571 58.050 -3.479 18986 4590 1 10 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.382 -2.468 18986 4591 1 10 . 1 1 634 634 ASP H H 634 8.724 8.724 8.412 0.312 18986 4592 1 10 . 1 1 635 635 SER N N 635 114.064 114.064 114.945 -0.881 18986 4593 1 10 . 1 1 635 635 SER HA H 635 4.232 4.232 4.260 -0.028 18986 4594 1 10 . 1 1 635 635 SER C C 635 174.487 174.487 176.225 -1.738 18986 4595 1 10 . 1 1 635 635 SER CA C 635 58.540 58.540 60.998 -2.458 18986 4596 1 10 . 1 1 635 635 SER CB C 635 60.319 60.319 63.190 -2.871 18986 4597 1 10 . 1 1 635 635 SER H H 635 7.992 7.992 8.314 -0.322 18986 4598 1 10 . 1 1 636 636 LEU N N 636 122.493 122.493 121.103 1.390 18986 4599 1 10 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.248 0.006 18986 4600 1 10 . 1 1 636 636 LEU C C 636 176.194 176.194 178.234 -2.040 18986 4601 1 10 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.545 -3.450 18986 4602 1 10 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.239 -2.533 18986 4603 1 10 . 1 1 636 636 LEU H H 636 8.169 8.169 7.926 0.243 18986 4604 1 10 . 1 1 637 637 ALA N N 637 121.891 121.891 122.718 -0.827 18986 4605 1 10 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.278 -0.189 18986 4606 1 10 . 1 1 637 637 ALA C C 637 175.131 175.131 180.351 -5.220 18986 4607 1 10 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.701 -4.365 18986 4608 1 10 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.364 -2.876 18986 4609 1 10 . 1 1 637 637 ALA H H 637 8.482 8.482 8.535 -0.053 18986 4610 1 10 . 1 1 638 638 VAL N N 638 117.140 117.140 118.596 -1.456 18986 4611 1 10 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.891 0.044 18986 4612 1 10 . 1 1 638 638 VAL C C 638 174.712 174.712 176.010 -1.298 18986 4613 1 10 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.454 -2.454 18986 4614 1 10 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.751 -2.400 18986 4615 1 10 . 1 1 638 638 VAL H H 638 7.291 7.291 8.413 -1.122 18986 4616 1 10 . 1 1 639 639 SER N N 639 114.143 114.143 114.287 -0.144 18986 4617 1 10 . 1 1 639 639 SER HA H 639 4.481 4.481 4.696 -0.215 18986 4618 1 10 . 1 1 639 639 SER C C 639 172.122 172.122 172.853 -0.731 18986 4619 1 10 . 1 1 639 639 SER CA C 639 56.002 56.002 57.609 -1.607 18986 4620 1 10 . 1 1 639 639 SER CB C 639 60.921 60.921 64.009 -3.088 18986 4621 1 10 . 1 1 639 639 SER H H 639 7.918 7.918 8.087 -0.169 18986 4622 1 10 . 1 1 640 640 SER N N 640 115.370 115.370 115.599 -0.229 18986 4623 1 10 . 1 1 640 640 SER HA H 640 4.711 4.711 4.634 0.077 18986 4624 1 10 . 1 1 640 640 SER C C 640 171.185 171.185 174.010 -2.825 18986 4625 1 10 . 1 1 640 640 SER CA C 640 55.009 55.009 57.685 -2.676 18986 4626 1 10 . 1 1 640 640 SER CB C 640 61.974 61.974 66.213 -4.239 18986 4627 1 10 . 1 1 640 640 SER H H 640 7.765 7.765 7.724 0.041 18986 4628 1 10 . 1 1 641 641 GLU N N 641 119.994 119.994 123.460 -3.466 18986 4629 1 10 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.067 -0.023 18986 4630 1 10 . 1 1 641 641 GLU C C 641 173.167 173.167 176.312 -3.145 18986 4631 1 10 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.776 -2.125 18986 4632 1 10 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.679 -2.195 18986 4633 1 10 . 1 1 641 641 GLU H H 641 8.363 8.363 8.871 -0.508 18986 4634 1 10 . 1 1 642 642 CYS N N 642 110.257 110.257 115.126 -4.869 18986 4635 1 10 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.660 -0.201 18986 4636 1 10 . 1 1 642 642 CYS C C 642 168.058 168.058 173.243 -5.185 18986 4637 1 10 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.825 -4.879 18986 4638 1 10 . 1 1 642 642 CYS CB C 642 41.361 41.361 32.610 8.751 18986 4639 1 10 . 1 1 642 642 CYS H H 642 7.881 7.881 7.499 0.382 18986 4640 1 10 . 1 1 643 643 ALA N N 643 123.922 123.922 123.494 0.428 18986 4641 1 10 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.560 0.078 18986 4642 1 10 . 1 1 643 643 ALA C C 643 172.517 172.517 176.907 -4.390 18986 4643 1 10 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.951 -4.331 18986 4644 1 10 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.564 0.881 18986 4645 1 10 . 1 1 643 643 ALA H H 643 9.787 9.787 9.032 0.755 18986 4646 1 10 . 1 1 644 644 LYS N N 644 128.479 128.479 126.557 1.922 18986 4647 1 10 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.326 0.185 18986 4648 1 10 . 1 1 644 644 LYS C C 644 176.945 176.945 177.712 -0.767 18986 4649 1 10 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.823 -2.485 18986 4650 1 10 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.800 -2.858 18986 4651 1 10 . 1 1 644 644 LYS H H 644 9.809 9.809 9.192 0.617 18986 4652 1 10 . 1 1 645 645 VAL N N 645 124.257 124.257 124.972 -0.715 18986 4653 1 10 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.672 -0.024 18986 4654 1 10 . 1 1 645 645 VAL C C 645 173.996 173.996 177.470 -3.474 18986 4655 1 10 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.825 -1.963 18986 4656 1 10 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.352 -2.151 18986 4657 1 10 . 1 1 645 645 VAL H H 645 8.458 8.458 8.937 -0.479 18986 4658 1 10 . 1 1 646 646 LYS N N 646 117.598 117.598 119.803 -2.205 18986 4659 1 10 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.911 0.096 18986 4660 1 10 . 1 1 646 646 LYS C C 646 176.047 176.047 178.782 -2.735 18986 4661 1 10 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.057 -2.812 18986 4662 1 10 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.562 -2.164 18986 4663 1 10 . 1 1 646 646 LYS H H 646 8.706 8.706 8.441 0.265 18986 4664 1 10 . 1 1 647 647 ASP N N 647 119.229 119.229 120.352 -1.123 18986 4665 1 10 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.419 0.199 18986 4666 1 10 . 1 1 647 647 ASP C C 647 175.211 175.211 178.607 -3.396 18986 4667 1 10 . 1 1 647 647 ASP CA C 647 54.323 54.323 56.974 -2.651 18986 4668 1 10 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.298 -1.560 18986 4669 1 10 . 1 1 647 647 ASP H H 647 7.012 7.012 7.910 -0.898 18986 4670 1 10 . 1 1 648 648 ILE N N 648 121.939 121.939 120.274 1.665 18986 4671 1 10 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.682 -0.301 18986 4672 1 10 . 1 1 648 648 ILE C C 648 175.243 175.243 178.183 -2.940 18986 4673 1 10 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.133 -2.092 18986 4674 1 10 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.873 -1.911 18986 4675 1 10 . 1 1 648 648 ILE H H 648 8.152 8.152 7.888 0.264 18986 4676 1 10 . 1 1 649 649 LEU N N 649 117.310 117.310 120.234 -2.924 18986 4677 1 10 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.824 0.050 18986 4678 1 10 . 1 1 649 649 LEU C C 649 176.439 176.439 179.202 -2.763 18986 4679 1 10 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.325 -2.440 18986 4680 1 10 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.419 -2.113 18986 4681 1 10 . 1 1 649 649 LEU H H 649 8.638 8.638 8.543 0.095 18986 4682 1 10 . 1 1 650 650 LYS N N 650 118.810 118.810 119.501 -0.691 18986 4683 1 10 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.979 0.067 18986 4684 1 10 . 1 1 650 650 LYS C C 650 176.801 176.801 178.966 -2.165 18986 4685 1 10 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.193 -2.142 18986 4686 1 10 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.173 -2.109 18986 4687 1 10 . 1 1 650 650 LYS H H 650 7.296 7.296 7.957 -0.661 18986 4688 1 10 . 1 1 651 651 GLU N N 651 117.713 117.713 118.604 -0.891 18986 4689 1 10 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.141 -0.033 18986 4690 1 10 . 1 1 651 651 GLU C C 651 176.903 176.903 179.176 -2.273 18986 4691 1 10 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.676 -2.866 18986 4692 1 10 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.387 -1.939 18986 4693 1 10 . 1 1 651 651 GLU H H 651 8.036 8.036 8.353 -0.317 18986 4694 1 10 . 1 1 652 652 ALA N N 652 121.206 121.206 122.382 -1.176 18986 4695 1 10 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.068 -0.070 18986 4696 1 10 . 1 1 652 652 ALA C C 652 176.766 176.766 179.827 -3.061 18986 4697 1 10 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.255 -3.521 18986 4698 1 10 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.199 -2.883 18986 4699 1 10 . 1 1 652 652 ALA H H 652 8.973 8.973 8.639 0.334 18986 4700 1 10 . 1 1 653 653 GLN N N 653 117.768 117.768 117.518 0.250 18986 4701 1 10 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.254 0.223 18986 4702 1 10 . 1 1 653 653 GLN C C 653 177.388 177.388 178.715 -1.327 18986 4703 1 10 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.219 -2.159 18986 4704 1 10 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.712 -1.943 18986 4705 1 10 . 1 1 653 653 GLN H H 653 8.059 8.059 7.997 0.062 18986 4706 1 10 . 1 1 654 654 GLN N N 654 117.979 117.979 118.608 -0.629 18986 4707 1 10 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.099 0.078 18986 4708 1 10 . 1 1 654 654 GLN C C 654 174.834 174.834 178.200 -3.366 18986 4709 1 10 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.113 -2.695 18986 4710 1 10 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.275 -2.298 18986 4711 1 10 . 1 1 654 654 GLN H H 654 7.495 7.495 7.935 -0.440 18986 4712 1 10 . 1 1 655 655 VAL N N 655 110.080 110.080 117.155 -7.075 18986 4713 1 10 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.852 0.675 18986 4714 1 10 . 1 1 655 655 VAL C C 655 173.369 173.369 176.789 -3.420 18986 4715 1 10 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.270 -6.203 18986 4716 1 10 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.356 -4.172 18986 4717 1 10 . 1 1 655 655 VAL H H 655 7.197 7.197 7.899 -0.702 18986 4718 1 10 . 1 1 656 656 GLY N N 656 107.089 107.089 106.018 1.071 18986 4719 1 10 . 1 1 656 656 GLY C C 656 171.639 171.639 174.874 -3.235 18986 4720 1 10 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.657 -1.346 18986 4721 1 10 . 1 1 656 656 GLY H H 656 7.541 7.541 7.773 -0.232 18986 4722 1 10 . 1 1 657 657 ILE N N 657 121.266 121.266 120.659 0.607 18986 4723 1 10 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.265 -0.131 18986 4724 1 10 . 1 1 657 657 ILE C C 657 171.885 171.885 175.850 -3.965 18986 4725 1 10 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.631 -1.401 18986 4726 1 10 . 1 1 657 657 ILE CB C 657 35.191 35.191 38.217 -3.026 18986 4727 1 10 . 1 1 657 657 ILE H H 657 7.633 7.633 8.244 -0.611 18986 4728 1 10 . 1 1 658 658 GLU N N 658 127.252 127.252 120.201 7.051 18986 4729 1 10 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.575 -0.372 18986 4730 1 10 . 1 1 658 658 GLU C C 658 175.316 175.316 177.118 -1.802 18986 4731 1 10 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.510 -0.149 18986 4732 1 10 . 1 1 658 658 GLU CB C 658 27.610 27.610 32.199 -4.589 18986 4733 1 10 . 1 1 658 658 GLU H H 658 8.690 8.690 8.195 0.495 18986 4734 1 10 . 1 1 659 659 LYS N N 659 124.533 124.533 126.309 -1.776 18986 4735 1 10 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.844 -0.056 18986 4736 1 10 . 1 1 659 659 LYS C C 659 175.170 175.170 178.012 -2.842 18986 4737 1 10 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.938 -1.767 18986 4738 1 10 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.990 -1.873 18986 4739 1 10 . 1 1 659 659 LYS H H 659 8.706 8.706 9.060 -0.354 18986 4740 1 10 . 1 1 660 660 SER N N 660 113.137 113.137 115.402 -2.265 18986 4741 1 10 . 1 1 660 660 SER HA H 660 4.273 4.273 4.419 -0.146 18986 4742 1 10 . 1 1 660 660 SER C C 660 173.939 173.939 176.567 -2.628 18986 4743 1 10 . 1 1 660 660 SER CA C 660 58.350 58.350 61.594 -3.244 18986 4744 1 10 . 1 1 660 660 SER CB C 660 59.504 59.504 62.949 -3.445 18986 4745 1 10 . 1 1 660 660 SER H H 660 8.777 8.777 8.629 0.148 18986 4746 1 10 . 1 1 661 661 ASN N N 661 119.986 119.986 120.532 -0.546 18986 4747 1 10 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.525 0.181 18986 4748 1 10 . 1 1 661 661 ASN C C 661 174.516 174.516 177.213 -2.697 18986 4749 1 10 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.299 -4.251 18986 4750 1 10 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.592 -1.849 18986 4751 1 10 . 1 1 661 661 ASN H H 661 7.486 7.486 8.344 -0.858 18986 4752 1 10 . 1 1 662 662 ILE N N 662 120.639 120.639 120.446 0.193 18986 4753 1 10 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.799 -0.353 18986 4754 1 10 . 1 1 662 662 ILE C C 662 174.252 174.252 177.871 -3.619 18986 4755 1 10 . 1 1 662 662 ILE CA C 662 62.606 62.606 63.575 -0.969 18986 4756 1 10 . 1 1 662 662 ILE CB C 662 34.423 34.423 36.947 -2.525 18986 4757 1 10 . 1 1 662 662 ILE H H 662 7.999 7.999 8.130 -0.131 18986 4758 1 10 . 1 1 663 663 GLU N N 663 117.706 117.706 120.813 -3.107 18986 4759 1 10 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.893 -0.103 18986 4760 1 10 . 1 1 663 663 GLU C C 663 176.509 176.509 179.123 -2.614 18986 4761 1 10 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.383 -2.675 18986 4762 1 10 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.434 -2.679 18986 4763 1 10 . 1 1 663 663 GLU H H 663 8.190 8.190 8.296 -0.106 18986 4764 1 10 . 1 1 664 664 LYS N N 664 119.586 119.586 120.265 -0.679 18986 4765 1 10 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.029 0.024 18986 4766 1 10 . 1 1 664 664 LYS C C 664 175.941 175.941 178.914 -2.973 18986 4767 1 10 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.388 -2.807 18986 4768 1 10 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.208 -2.385 18986 4769 1 10 . 1 1 664 664 LYS H H 664 7.590 7.590 8.193 -0.603 18986 4770 1 10 . 1 1 665 665 LEU N N 665 119.756 119.756 120.561 -0.805 18986 4771 1 10 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.110 -0.030 18986 4772 1 10 . 1 1 665 665 LEU C C 665 176.700 176.700 178.841 -2.141 18986 4773 1 10 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.572 -2.187 18986 4774 1 10 . 1 1 665 665 LEU CB C 665 39.192 39.192 42.041 -2.849 18986 4775 1 10 . 1 1 665 665 LEU H H 665 8.075 8.075 8.075 -0.000 18986 4776 1 10 . 1 1 666 666 LEU N N 666 118.788 118.788 120.004 -1.216 18986 4777 1 10 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.632 0.132 18986 4778 1 10 . 1 1 666 666 LEU C C 666 176.484 176.484 178.807 -2.323 18986 4779 1 10 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.170 -2.512 18986 4780 1 10 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.948 -2.337 18986 4781 1 10 . 1 1 666 666 LEU H H 666 8.550 8.550 8.595 -0.045 18986 4782 1 10 . 1 1 667 667 THR N N 667 115.244 115.244 115.982 -0.738 18986 4783 1 10 . 1 1 667 667 THR HA H 667 3.839 3.839 3.914 -0.075 18986 4784 1 10 . 1 1 667 667 THR C C 667 173.740 173.740 176.213 -2.473 18986 4785 1 10 . 1 1 667 667 THR CA C 667 64.378 64.378 67.745 -3.366 18986 4786 1 10 . 1 1 667 667 THR CB C 667 65.748 65.748 68.118 -2.370 18986 4787 1 10 . 1 1 667 667 THR H H 667 7.662 7.662 8.046 -0.384 18986 4788 1 10 . 1 1 668 668 ASP N N 668 122.862 122.862 122.109 0.753 18986 4789 1 10 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.319 0.064 18986 4790 1 10 . 1 1 668 668 ASP C C 668 177.192 177.192 178.406 -1.214 18986 4791 1 10 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.346 -2.215 18986 4792 1 10 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.904 -3.018 18986 4793 1 10 . 1 1 668 668 ASP H H 668 8.291 8.291 8.297 -0.006 18986 4794 1 10 . 1 1 669 669 MET N N 669 119.640 119.640 118.358 1.282 18986 4795 1 10 . 1 1 669 669 MET HA H 669 3.917 3.917 4.003 -0.086 18986 4796 1 10 . 1 1 669 669 MET C C 669 175.414 175.414 178.641 -3.227 18986 4797 1 10 . 1 1 669 669 MET CA C 669 57.234 57.234 59.379 -2.145 18986 4798 1 10 . 1 1 669 669 MET CB C 669 32.088 32.088 32.456 -0.368 18986 4799 1 10 . 1 1 669 669 MET H H 669 8.809 8.809 8.409 0.400 18986 4800 1 10 . 1 1 670 670 ARG N N 670 122.614 122.614 118.458 4.156 18986 4801 1 10 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.539 -0.022 18986 4802 1 10 . 1 1 670 670 ARG C C 670 177.928 177.928 178.950 -1.022 18986 4803 1 10 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.414 -2.192 18986 4804 1 10 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.823 -2.519 18986 4805 1 10 . 1 1 670 670 ARG H H 670 8.450 8.450 8.440 0.010 18986 4806 1 10 . 1 1 671 671 LYS N N 671 121.976 121.976 119.990 1.986 18986 4807 1 10 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.152 -0.039 18986 4808 1 10 . 1 1 671 671 LYS C C 671 176.143 176.143 178.439 -2.296 18986 4809 1 10 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.673 -1.587 18986 4810 1 10 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.568 -3.064 18986 4811 1 10 . 1 1 671 671 LYS H H 671 8.609 8.609 8.218 0.391 18986 4812 1 10 . 1 1 672 672 SER N N 672 111.655 111.655 112.820 -1.165 18986 4813 1 10 . 1 1 672 672 SER HA H 672 4.469 4.469 4.393 0.076 18986 4814 1 10 . 1 1 672 672 SER C C 672 171.692 171.692 175.445 -3.753 18986 4815 1 10 . 1 1 672 672 SER CA C 672 56.790 56.790 58.971 -2.181 18986 4816 1 10 . 1 1 672 672 SER CB C 672 61.343 61.343 64.018 -2.675 18986 4817 1 10 . 1 1 672 672 SER H H 672 7.884 7.884 8.175 -0.291 18986 4818 1 10 . 1 1 673 673 GLY N N 673 108.029 108.029 108.852 -0.823 18986 4819 1 10 . 1 1 673 673 GLY C C 673 171.492 171.492 175.179 -3.687 18986 4820 1 10 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.525 -2.250 18986 4821 1 10 . 1 1 673 673 GLY H H 673 7.774 7.774 7.933 -0.159 18986 4822 1 10 . 1 1 674 674 ILE N N 674 116.193 116.193 120.186 -3.993 18986 4823 1 10 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.855 0.246 18986 4824 1 10 . 1 1 674 674 ILE C C 674 173.980 173.980 175.356 -1.376 18986 4825 1 10 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.760 -3.518 18986 4826 1 10 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.394 -1.590 18986 4827 1 10 . 1 1 674 674 ILE H H 674 8.026 8.026 8.202 -0.176 18986 4828 1 10 . 1 1 675 675 ILE N N 675 108.928 108.928 113.044 -4.116 18986 4829 1 10 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.456 0.902 18986 4830 1 10 . 1 1 675 675 ILE C C 675 170.797 170.797 173.899 -3.102 18986 4831 1 10 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.992 -2.967 18986 4832 1 10 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.617 -2.131 18986 4833 1 10 . 1 1 675 675 ILE H H 675 7.120 7.120 7.289 -0.169 18986 4834 1 10 . 1 1 676 676 TYR N N 676 118.062 118.062 118.232 -0.170 18986 4835 1 10 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.137 -0.142 18986 4836 1 10 . 1 1 676 676 TYR C C 676 170.020 170.020 175.763 -5.743 18986 4837 1 10 . 1 1 676 676 TYR CA C 676 52.893 52.893 54.792 -1.899 18986 4838 1 10 . 1 1 676 676 TYR CB C 676 38.516 38.516 39.407 -0.891 18986 4839 1 10 . 1 1 676 676 TYR H H 676 9.380 9.380 9.146 0.234 18986 4840 1 10 . 1 1 677 677 GLU N N 677 123.578 123.578 123.173 0.405 18986 4841 1 10 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.523 0.303 18986 4842 1 10 . 1 1 677 677 GLU C C 677 172.146 172.146 178.710 -6.564 18986 4843 1 10 . 1 1 677 677 GLU CA C 677 52.476 52.476 59.982 -7.506 18986 4844 1 10 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.493 -2.881 18986 4845 1 10 . 1 1 677 677 GLU H H 677 8.951 8.951 9.032 -0.081 18986 4846 1 10 . 1 1 678 678 ALA N N 678 133.220 133.220 120.265 12.955 18986 4847 1 10 . 1 1 678 678 ALA HA H 678 4.041 4.041 3.941 0.100 18986 4848 1 10 . 1 1 678 678 ALA C C 678 175.219 175.219 176.758 -1.539 18986 4849 1 10 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.908 -2.307 18986 4850 1 10 . 1 1 678 678 ALA CB C 678 16.599 16.599 17.619 -1.020 18986 4851 1 10 . 1 1 678 678 ALA H H 678 7.912 7.912 8.383 -0.471 18986 4852 1 10 . 1 1 679 679 LYS N N 679 115.687 115.687 117.206 -1.519 18986 4853 1 10 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.623 -0.188 18986 4854 1 10 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.422 -1.406 18986 4855 1 10 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.579 -3.584 18986 4856 1 10 . 1 1 679 679 LYS H H 679 8.215 8.215 7.656 0.559 18986 4857 1 10 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.262 -0.243 18986 4858 1 10 . 1 1 680 680 PRO C C 680 174.504 174.504 177.236 -2.732 18986 4859 1 10 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.590 -1.072 18986 4860 1 10 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.988 -3.673 18986 4861 1 10 . 1 1 681 681 GLU N N 681 118.851 118.851 118.383 0.468 18986 4862 1 10 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.972 -0.534 18986 4863 1 10 . 1 1 681 681 GLU C C 681 172.890 172.890 175.033 -2.143 18986 4864 1 10 . 1 1 681 681 GLU CA C 681 54.481 54.481 57.968 -3.487 18986 4865 1 10 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.098 -4.309 18986 4866 1 10 . 1 1 681 681 GLU H H 681 10.003 10.003 8.737 1.266 18986 4867 1 10 . 1 1 682 682 CYS N N 682 120.934 120.934 114.975 5.959 18986 4868 1 10 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.164 -0.137 18986 4869 1 10 . 1 1 682 682 CYS C C 682 171.905 171.905 172.806 -0.901 18986 4870 1 10 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.492 -3.248 18986 4871 1 10 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.536 13.759 18986 4872 1 10 . 1 1 682 682 CYS H H 682 7.860 7.860 7.292 0.568 18986 4873 1 10 . 1 1 683 683 TYR N N 683 126.183 126.183 119.318 6.865 18986 4874 1 10 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.334 -0.110 18986 4875 1 10 . 1 1 683 683 TYR C C 683 173.008 173.008 174.094 -1.086 18986 4876 1 10 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.169 -0.601 18986 4877 1 10 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.301 -2.349 18986 4878 1 10 . 1 1 683 683 TYR H H 683 9.297 9.297 9.220 0.077 18986 4879 1 10 . 1 1 684 684 LYS N N 684 118.604 118.604 118.285 0.319 18986 4880 1 10 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.902 -0.465 18986 4881 1 10 . 1 1 684 684 LYS C C 684 171.628 171.628 175.094 -3.466 18986 4882 1 10 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.404 -2.101 18986 4883 1 10 . 1 1 684 684 LYS CB C 684 34.677 34.677 37.192 -2.515 18986 4884 1 10 . 1 1 684 684 LYS H H 684 8.630 8.630 9.396 -0.766 18986 4885 1 10 . 1 1 685 685 LYS N N 685 122.869 122.869 122.968 -0.099 18986 4886 1 10 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.013 0.631 18986 4887 1 10 . 1 1 685 685 LYS C C 685 173.337 173.337 176.546 -3.209 18986 4888 1 10 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.537 -2.284 18986 4889 1 10 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.373 -1.446 18986 4890 1 10 . 1 1 685 685 LYS H H 685 8.969 8.969 8.636 0.333 18986 4891 1 11 . 1 1 601 601 SER HA H 601 4.475 4.475 4.340 0.135 18986 4892 1 11 . 1 1 601 601 SER CA C 601 55.508 55.508 59.779 -4.271 18986 4893 1 11 . 1 1 601 601 SER CB C 601 61.220 61.220 62.199 -0.979 18986 4894 1 11 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.855 -0.239 18986 4895 1 11 . 1 1 602 602 HIS C C 602 172.320 172.320 174.745 -2.425 18986 4896 1 11 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.301 -1.447 18986 4897 1 11 . 1 1 602 602 HIS CB C 602 28.083 28.083 31.584 -3.501 18986 4898 1 11 . 1 1 603 603 MET N N 603 121.862 121.862 119.650 2.212 18986 4899 1 11 . 1 1 603 603 MET HA H 603 4.425 4.425 4.761 -0.336 18986 4900 1 11 . 1 1 603 603 MET C C 603 173.948 173.948 175.688 -1.740 18986 4901 1 11 . 1 1 603 603 MET CA C 603 53.108 53.108 54.925 -1.817 18986 4902 1 11 . 1 1 603 603 MET CB C 603 30.049 30.049 36.400 -6.351 18986 4903 1 11 . 1 1 603 603 MET H H 603 8.394 8.394 8.525 -0.131 18986 4904 1 11 . 1 1 604 604 GLY N N 604 110.382 110.382 109.323 1.059 18986 4905 1 11 . 1 1 604 604 GLY C C 604 171.590 171.590 172.223 -0.633 18986 4906 1 11 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.585 -1.968 18986 4907 1 11 . 1 1 604 604 GLY H H 604 8.411 8.411 8.916 -0.505 18986 4908 1 11 . 1 1 605 605 GLU N N 605 120.709 120.709 118.565 2.144 18986 4909 1 11 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.916 -0.609 18986 4910 1 11 . 1 1 605 605 GLU C C 605 174.220 174.220 176.172 -1.952 18986 4911 1 11 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.668 -1.702 18986 4912 1 11 . 1 1 605 605 GLU CB C 605 27.611 27.611 31.596 -3.985 18986 4913 1 11 . 1 1 605 605 GLU H H 605 8.282 8.282 8.610 -0.328 18986 4914 1 11 . 1 1 606 606 SER N N 606 116.679 116.679 116.066 0.613 18986 4915 1 11 . 1 1 606 606 SER HA H 606 4.405 4.405 4.391 0.014 18986 4916 1 11 . 1 1 606 606 SER C C 606 172.455 172.455 174.648 -2.193 18986 4917 1 11 . 1 1 606 606 SER CA C 606 56.028 56.028 58.180 -2.152 18986 4918 1 11 . 1 1 606 606 SER CB C 606 61.039 61.039 63.318 -2.279 18986 4919 1 11 . 1 1 606 606 SER H H 606 8.420 8.420 8.543 -0.123 18986 4920 1 11 . 1 1 607 607 GLY N N 607 110.716 110.716 109.609 1.107 18986 4921 1 11 . 1 1 607 607 GLY C C 607 171.173 171.173 174.937 -3.764 18986 4922 1 11 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.527 -1.886 18986 4923 1 11 . 1 1 607 607 GLY H H 607 8.386 8.386 8.498 -0.112 18986 4924 1 11 . 1 1 608 608 LYS N N 608 120.785 120.785 122.113 -1.328 18986 4925 1 11 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.281 0.058 18986 4926 1 11 . 1 1 608 608 LYS C C 608 173.673 173.673 175.545 -1.872 18986 4927 1 11 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.889 -2.523 18986 4928 1 11 . 1 1 608 608 LYS CB C 608 30.531 30.531 30.763 -0.232 18986 4929 1 11 . 1 1 608 608 LYS H H 608 8.008 8.008 8.493 -0.485 18986 4930 1 11 . 1 1 609 609 ILE N N 609 122.404 122.404 121.022 1.382 18986 4931 1 11 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.207 -0.058 18986 4932 1 11 . 1 1 609 609 ILE C C 609 172.675 172.675 174.591 -1.916 18986 4933 1 11 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.761 -2.758 18986 4934 1 11 . 1 1 609 609 ILE CB C 609 36.204 36.204 40.361 -4.157 18986 4935 1 11 . 1 1 609 609 ILE H H 609 8.186 8.186 7.907 0.279 18986 4936 1 11 . 1 1 610 610 ASP N N 610 125.357 125.357 124.395 0.962 18986 4937 1 11 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.852 -0.149 18986 4938 1 11 . 1 1 610 610 ASP C C 610 173.668 173.668 175.068 -1.400 18986 4939 1 11 . 1 1 610 610 ASP CA C 610 50.702 50.702 52.567 -1.865 18986 4940 1 11 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.802 -5.112 18986 4941 1 11 . 1 1 610 610 ASP H H 610 8.369 8.369 8.163 0.206 18986 4942 1 11 . 1 1 611 611 ILE N N 611 122.494 122.494 120.909 1.585 18986 4943 1 11 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.087 -0.178 18986 4944 1 11 . 1 1 611 611 ILE C C 611 173.618 173.618 177.316 -3.698 18986 4945 1 11 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.958 -2.918 18986 4946 1 11 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.276 -2.478 18986 4947 1 11 . 1 1 611 611 ILE H H 611 8.284 8.284 8.439 -0.155 18986 4948 1 11 . 1 1 612 612 ASP N N 612 121.440 121.440 119.577 1.863 18986 4949 1 11 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.398 0.036 18986 4950 1 11 . 1 1 612 612 ASP C C 612 175.129 175.129 178.396 -3.267 18986 4951 1 11 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.427 -3.661 18986 4952 1 11 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.359 -1.221 18986 4953 1 11 . 1 1 612 612 ASP H H 612 8.279 8.279 8.496 -0.217 18986 4954 1 11 . 1 1 613 613 THR N N 613 114.422 114.422 113.629 0.793 18986 4955 1 11 . 1 1 613 613 THR HA H 613 4.106 4.106 4.104 0.002 18986 4956 1 11 . 1 1 613 613 THR C C 613 173.338 173.338 175.602 -2.264 18986 4957 1 11 . 1 1 613 613 THR CA C 613 61.545 61.545 64.828 -3.283 18986 4958 1 11 . 1 1 613 613 THR CB C 613 66.267 66.267 68.478 -2.211 18986 4959 1 11 . 1 1 613 613 THR H H 613 7.866 7.866 8.311 -0.445 18986 4960 1 11 . 1 1 614 614 ILE N N 614 121.654 121.654 118.876 2.778 18986 4961 1 11 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.051 -0.022 18986 4962 1 11 . 1 1 614 614 ILE C C 614 174.471 174.471 177.401 -2.930 18986 4963 1 11 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.512 -3.339 18986 4964 1 11 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.907 -3.092 18986 4965 1 11 . 1 1 614 614 ILE H H 614 7.819 7.819 7.366 0.453 18986 4966 1 11 . 1 1 615 615 MET N N 615 119.713 119.713 118.670 1.043 18986 4967 1 11 . 1 1 615 615 MET HA H 615 4.478 4.478 4.624 -0.146 18986 4968 1 11 . 1 1 615 615 MET C C 615 174.075 174.075 177.622 -3.547 18986 4969 1 11 . 1 1 615 615 MET CA C 615 52.764 52.764 57.425 -4.662 18986 4970 1 11 . 1 1 615 615 MET CB C 615 29.337 29.337 32.207 -2.870 18986 4971 1 11 . 1 1 615 615 MET H H 615 8.188 8.188 8.224 -0.036 18986 4972 1 11 . 1 1 616 616 THR N N 616 114.770 114.770 113.963 0.807 18986 4973 1 11 . 1 1 616 616 THR HA H 616 4.099 4.099 4.143 -0.044 18986 4974 1 11 . 1 1 616 616 THR C C 616 172.535 172.535 176.040 -3.505 18986 4975 1 11 . 1 1 616 616 THR CA C 616 61.112 61.112 63.917 -2.805 18986 4976 1 11 . 1 1 616 616 THR CB C 616 66.617 66.617 69.104 -2.487 18986 4977 1 11 . 1 1 616 616 THR H H 616 7.722 7.722 8.333 -0.611 18986 4978 1 11 . 1 1 617 617 GLY N N 617 111.384 111.384 107.392 3.992 18986 4979 1 11 . 1 1 617 617 GLY C C 617 171.437 171.437 173.720 -2.283 18986 4980 1 11 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.017 -2.575 18986 4981 1 11 . 1 1 617 617 GLY H H 617 8.431 8.431 7.705 0.726 18986 4982 1 11 . 1 1 618 618 LYS N N 618 120.996 120.996 120.482 0.514 18986 4983 1 11 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.818 -0.151 18986 4984 1 11 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.860 -2.032 18986 4985 1 11 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.861 -5.384 18986 4986 1 11 . 1 1 618 618 LYS H H 618 7.821 7.821 7.804 0.017 18986 4987 1 11 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.459 0.010 18986 4988 1 11 . 1 1 619 619 PRO C C 619 174.453 174.453 178.217 -3.764 18986 4989 1 11 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.565 -2.373 18986 4990 1 11 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.691 -3.111 18986 4991 1 11 . 1 1 620 620 LYS N N 620 123.464 123.464 122.104 1.360 18986 4992 1 11 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.883 0.163 18986 4993 1 11 . 1 1 620 620 LYS C C 620 174.895 174.895 178.459 -3.564 18986 4994 1 11 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.493 -3.204 18986 4995 1 11 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.709 -1.255 18986 4996 1 11 . 1 1 620 620 LYS H H 620 8.728 8.728 8.729 -0.001 18986 4997 1 11 . 1 1 621 621 SER N N 621 113.921 113.921 115.160 -1.239 18986 4998 1 11 . 1 1 621 621 SER HA H 621 4.336 4.336 4.157 0.179 18986 4999 1 11 . 1 1 621 621 SER C C 621 173.149 173.149 176.186 -3.037 18986 5000 1 11 . 1 1 621 621 SER CA C 621 56.691 56.691 60.509 -3.818 18986 5001 1 11 . 1 1 621 621 SER CB C 621 60.689 60.689 62.592 -1.903 18986 5002 1 11 . 1 1 621 621 SER H H 621 8.531 8.531 8.218 0.313 18986 5003 1 11 . 1 1 622 622 ALA N N 622 124.177 124.177 123.347 0.830 18986 5004 1 11 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.950 0.218 18986 5005 1 11 . 1 1 622 622 ALA C C 622 176.804 176.804 178.650 -1.846 18986 5006 1 11 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.212 -2.844 18986 5007 1 11 . 1 1 622 622 ALA CB C 622 15.854 15.854 17.843 -1.989 18986 5008 1 11 . 1 1 622 622 ALA H H 622 7.835 7.835 8.275 -0.440 18986 5009 1 11 . 1 1 623 623 ARG N N 623 118.263 118.263 119.725 -1.462 18986 5010 1 11 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.854 0.096 18986 5011 1 11 . 1 1 623 623 ARG C C 623 175.683 175.683 178.147 -2.464 18986 5012 1 11 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.368 -2.205 18986 5013 1 11 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.782 -2.331 18986 5014 1 11 . 1 1 623 623 ARG H H 623 8.148 8.148 8.105 0.043 18986 5015 1 11 . 1 1 624 624 GLU N N 624 117.953 117.953 117.959 -0.006 18986 5016 1 11 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.070 -0.102 18986 5017 1 11 . 1 1 624 624 GLU C C 624 177.204 177.204 178.813 -1.609 18986 5018 1 11 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.002 -2.145 18986 5019 1 11 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.342 -2.375 18986 5020 1 11 . 1 1 624 624 GLU H H 624 8.143 8.143 8.370 -0.227 18986 5021 1 11 . 1 1 625 625 LYS N N 625 119.222 119.222 118.179 1.043 18986 5022 1 11 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.212 -0.355 18986 5023 1 11 . 1 1 625 625 LYS C C 625 175.480 175.480 178.997 -3.517 18986 5024 1 11 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.850 -1.363 18986 5025 1 11 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.804 -2.141 18986 5026 1 11 . 1 1 625 625 LYS H H 625 7.772 7.772 7.810 -0.038 18986 5027 1 11 . 1 1 626 626 MET N N 626 117.883 117.883 119.159 -1.276 18986 5028 1 11 . 1 1 626 626 MET HA H 626 3.807 3.807 4.020 -0.213 18986 5029 1 11 . 1 1 626 626 MET C C 626 175.278 175.278 178.571 -3.293 18986 5030 1 11 . 1 1 626 626 MET CA C 626 57.782 57.782 59.696 -1.914 18986 5031 1 11 . 1 1 626 626 MET CB C 626 30.657 30.657 32.572 -1.915 18986 5032 1 11 . 1 1 626 626 MET H H 626 8.367 8.367 8.543 -0.176 18986 5033 1 11 . 1 1 627 627 MET N N 627 116.185 116.185 117.207 -1.022 18986 5034 1 11 . 1 1 627 627 MET HA H 627 4.152 4.152 4.042 0.110 18986 5035 1 11 . 1 1 627 627 MET C C 627 176.393 176.393 177.586 -1.193 18986 5036 1 11 . 1 1 627 627 MET CA C 627 55.359 55.359 60.147 -4.788 18986 5037 1 11 . 1 1 627 627 MET CB C 627 28.803 28.803 32.290 -3.487 18986 5038 1 11 . 1 1 627 627 MET H H 627 8.197 8.197 8.762 -0.565 18986 5039 1 11 . 1 1 628 628 LYS N N 628 119.859 119.859 120.513 -0.654 18986 5040 1 11 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.049 0.151 18986 5041 1 11 . 1 1 628 628 LYS C C 628 175.885 175.885 179.252 -3.367 18986 5042 1 11 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.260 -4.183 18986 5043 1 11 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.234 -3.703 18986 5044 1 11 . 1 1 628 628 LYS H H 628 7.700 7.700 7.682 0.018 18986 5045 1 11 . 1 1 629 629 ILE N N 629 119.001 119.001 120.508 -1.507 18986 5046 1 11 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.613 -0.065 18986 5047 1 11 . 1 1 629 629 ILE C C 629 174.891 174.891 177.907 -3.016 18986 5048 1 11 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.575 -3.310 18986 5049 1 11 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.916 -4.067 18986 5050 1 11 . 1 1 629 629 ILE H H 629 7.970 7.970 8.378 -0.408 18986 5051 1 11 . 1 1 630 630 ILE N N 630 120.737 120.737 117.270 3.467 18986 5052 1 11 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.606 -0.139 18986 5053 1 11 . 1 1 630 630 ILE C C 630 173.875 173.875 177.759 -3.884 18986 5054 1 11 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.124 -2.370 18986 5055 1 11 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.934 -2.657 18986 5056 1 11 . 1 1 630 630 ILE H H 630 8.213 8.213 8.149 0.064 18986 5057 1 11 . 1 1 631 631 GLU N N 631 119.546 119.546 121.029 -1.483 18986 5058 1 11 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.982 0.083 18986 5059 1 11 . 1 1 631 631 GLU C C 631 177.300 177.300 179.260 -1.960 18986 5060 1 11 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.866 -2.886 18986 5061 1 11 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.624 -2.631 18986 5062 1 11 . 1 1 631 631 GLU H H 631 7.742 7.742 7.973 -0.231 18986 5063 1 11 . 1 1 632 632 ILE N N 632 121.547 121.547 121.075 0.472 18986 5064 1 11 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.649 0.034 18986 5065 1 11 . 1 1 632 632 ILE C C 632 175.454 175.454 178.107 -2.653 18986 5066 1 11 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.734 -3.078 18986 5067 1 11 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.892 -2.062 18986 5068 1 11 . 1 1 632 632 ILE H H 632 8.013 8.013 8.273 -0.260 18986 5069 1 11 . 1 1 633 633 ILE N N 633 121.605 121.605 119.588 2.017 18986 5070 1 11 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.572 -0.237 18986 5071 1 11 . 1 1 633 633 ILE C C 633 174.558 174.558 177.983 -3.425 18986 5072 1 11 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.684 -1.765 18986 5073 1 11 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.106 -1.822 18986 5074 1 11 . 1 1 633 633 ILE H H 633 8.594 8.594 8.432 0.162 18986 5075 1 11 . 1 1 634 634 ASP N N 634 118.706 118.706 121.248 -2.542 18986 5076 1 11 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.367 0.068 18986 5077 1 11 . 1 1 634 634 ASP C C 634 176.574 176.574 178.502 -1.928 18986 5078 1 11 . 1 1 634 634 ASP CA C 634 54.571 54.571 58.054 -3.483 18986 5079 1 11 . 1 1 634 634 ASP CB C 634 37.914 37.914 41.024 -3.110 18986 5080 1 11 . 1 1 634 634 ASP H H 634 8.724 8.724 8.626 0.098 18986 5081 1 11 . 1 1 635 635 SER N N 635 114.064 114.064 115.219 -1.155 18986 5082 1 11 . 1 1 635 635 SER HA H 635 4.232 4.232 4.278 -0.046 18986 5083 1 11 . 1 1 635 635 SER C C 635 174.487 174.487 176.118 -1.631 18986 5084 1 11 . 1 1 635 635 SER CA C 635 58.540 58.540 61.215 -2.675 18986 5085 1 11 . 1 1 635 635 SER CB C 635 60.319 60.319 63.173 -2.854 18986 5086 1 11 . 1 1 635 635 SER H H 635 7.992 7.992 8.137 -0.145 18986 5087 1 11 . 1 1 636 636 LEU N N 636 122.493 122.493 121.598 0.895 18986 5088 1 11 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.294 -0.040 18986 5089 1 11 . 1 1 636 636 LEU C C 636 176.194 176.194 178.265 -2.071 18986 5090 1 11 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.051 -2.956 18986 5091 1 11 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.546 -1.840 18986 5092 1 11 . 1 1 636 636 LEU H H 636 8.169 8.169 8.027 0.142 18986 5093 1 11 . 1 1 637 637 ALA N N 637 121.891 121.891 122.768 -0.877 18986 5094 1 11 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.361 -0.272 18986 5095 1 11 . 1 1 637 637 ALA C C 637 175.131 175.131 180.766 -5.635 18986 5096 1 11 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.474 -4.138 18986 5097 1 11 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.396 -2.908 18986 5098 1 11 . 1 1 637 637 ALA H H 637 8.482 8.482 8.423 0.059 18986 5099 1 11 . 1 1 638 638 VAL N N 638 117.140 117.140 117.719 -0.579 18986 5100 1 11 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.859 0.076 18986 5101 1 11 . 1 1 638 638 VAL C C 638 174.712 174.712 175.964 -1.252 18986 5102 1 11 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.242 -2.241 18986 5103 1 11 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.188 -2.837 18986 5104 1 11 . 1 1 638 638 VAL H H 638 7.291 7.291 8.337 -1.046 18986 5105 1 11 . 1 1 639 639 SER N N 639 114.143 114.143 113.548 0.595 18986 5106 1 11 . 1 1 639 639 SER HA H 639 4.481 4.481 4.724 -0.243 18986 5107 1 11 . 1 1 639 639 SER C C 639 172.122 172.122 173.061 -0.939 18986 5108 1 11 . 1 1 639 639 SER CA C 639 56.002 56.002 57.579 -1.577 18986 5109 1 11 . 1 1 639 639 SER CB C 639 60.921 60.921 64.485 -3.564 18986 5110 1 11 . 1 1 639 639 SER H H 639 7.918 7.918 7.958 -0.040 18986 5111 1 11 . 1 1 640 640 SER N N 640 115.370 115.370 115.631 -0.261 18986 5112 1 11 . 1 1 640 640 SER HA H 640 4.711 4.711 4.632 0.079 18986 5113 1 11 . 1 1 640 640 SER C C 640 171.185 171.185 175.025 -3.840 18986 5114 1 11 . 1 1 640 640 SER CA C 640 55.009 55.009 57.344 -2.335 18986 5115 1 11 . 1 1 640 640 SER CB C 640 61.974 61.974 65.686 -3.712 18986 5116 1 11 . 1 1 640 640 SER H H 640 7.765 7.765 7.373 0.392 18986 5117 1 11 . 1 1 641 641 GLU N N 641 119.994 119.994 121.650 -1.656 18986 5118 1 11 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.132 -0.088 18986 5119 1 11 . 1 1 641 641 GLU C C 641 173.167 173.167 175.681 -2.514 18986 5120 1 11 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.980 -2.329 18986 5121 1 11 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.995 -2.511 18986 5122 1 11 . 1 1 641 641 GLU H H 641 8.363 8.363 8.828 -0.465 18986 5123 1 11 . 1 1 642 642 CYS N N 642 110.257 110.257 114.791 -4.534 18986 5124 1 11 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.674 -0.215 18986 5125 1 11 . 1 1 642 642 CYS C C 642 168.058 168.058 173.197 -5.139 18986 5126 1 11 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.478 -5.532 18986 5127 1 11 . 1 1 642 642 CYS CB C 642 41.361 41.361 32.272 9.089 18986 5128 1 11 . 1 1 642 642 CYS H H 642 7.881 7.881 7.482 0.399 18986 5129 1 11 . 1 1 643 643 ALA N N 643 123.922 123.922 122.735 1.187 18986 5130 1 11 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.342 0.296 18986 5131 1 11 . 1 1 643 643 ALA C C 643 172.517 172.517 175.837 -3.320 18986 5132 1 11 . 1 1 643 643 ALA CA C 643 47.620 47.620 52.245 -4.625 18986 5133 1 11 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.448 -0.004 18986 5134 1 11 . 1 1 643 643 ALA H H 643 9.787 9.787 8.977 0.810 18986 5135 1 11 . 1 1 644 644 LYS N N 644 128.479 128.479 117.497 10.982 18986 5136 1 11 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.941 -0.430 18986 5137 1 11 . 1 1 644 644 LYS C C 644 176.945 176.945 177.280 -0.335 18986 5138 1 11 . 1 1 644 644 LYS CA C 644 54.338 54.338 54.955 -0.617 18986 5139 1 11 . 1 1 644 644 LYS CB C 644 29.942 29.942 33.713 -3.771 18986 5140 1 11 . 1 1 644 644 LYS H H 644 9.809 9.809 8.280 1.529 18986 5141 1 11 . 1 1 645 645 VAL N N 645 124.257 124.257 125.006 -0.749 18986 5142 1 11 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.658 -0.010 18986 5143 1 11 . 1 1 645 645 VAL C C 645 173.996 173.996 177.541 -3.545 18986 5144 1 11 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.735 -1.873 18986 5145 1 11 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.541 -2.340 18986 5146 1 11 . 1 1 645 645 VAL H H 645 8.458 8.458 9.132 -0.674 18986 5147 1 11 . 1 1 646 646 LYS N N 646 117.598 117.598 120.311 -2.713 18986 5148 1 11 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.942 0.065 18986 5149 1 11 . 1 1 646 646 LYS C C 646 176.047 176.047 178.901 -2.854 18986 5150 1 11 . 1 1 646 646 LYS CA C 646 57.245 57.245 59.852 -2.607 18986 5151 1 11 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.809 -2.411 18986 5152 1 11 . 1 1 646 646 LYS H H 646 8.706 8.706 9.099 -0.393 18986 5153 1 11 . 1 1 647 647 ASP N N 647 119.229 119.229 119.194 0.035 18986 5154 1 11 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.556 0.062 18986 5155 1 11 . 1 1 647 647 ASP C C 647 175.211 175.211 178.511 -3.300 18986 5156 1 11 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.616 -3.293 18986 5157 1 11 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.733 -1.995 18986 5158 1 11 . 1 1 647 647 ASP H H 647 7.012 7.012 7.766 -0.753 18986 5159 1 11 . 1 1 648 648 ILE N N 648 121.939 121.939 121.074 0.865 18986 5160 1 11 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.599 -0.218 18986 5161 1 11 . 1 1 648 648 ILE C C 648 175.243 175.243 177.723 -2.480 18986 5162 1 11 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.713 -2.672 18986 5163 1 11 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.876 -1.914 18986 5164 1 11 . 1 1 648 648 ILE H H 648 8.152 8.152 7.578 0.574 18986 5165 1 11 . 1 1 649 649 LEU N N 649 117.310 117.310 120.442 -3.132 18986 5166 1 11 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.799 0.074 18986 5167 1 11 . 1 1 649 649 LEU C C 649 176.439 176.439 179.194 -2.755 18986 5168 1 11 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.409 -2.524 18986 5169 1 11 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.256 -1.950 18986 5170 1 11 . 1 1 649 649 LEU H H 649 8.638 8.638 8.617 0.021 18986 5171 1 11 . 1 1 650 650 LYS N N 650 118.810 118.810 119.753 -0.943 18986 5172 1 11 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.935 0.111 18986 5173 1 11 . 1 1 650 650 LYS C C 650 176.801 176.801 179.422 -2.621 18986 5174 1 11 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.493 -2.442 18986 5175 1 11 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.021 -1.957 18986 5176 1 11 . 1 1 650 650 LYS H H 650 7.296 7.296 8.165 -0.869 18986 5177 1 11 . 1 1 651 651 GLU N N 651 117.713 117.713 118.035 -0.322 18986 5178 1 11 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.159 -0.051 18986 5179 1 11 . 1 1 651 651 GLU C C 651 176.903 176.903 179.193 -2.290 18986 5180 1 11 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.682 -2.872 18986 5181 1 11 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.287 -1.839 18986 5182 1 11 . 1 1 651 651 GLU H H 651 8.036 8.036 8.004 0.032 18986 5183 1 11 . 1 1 652 652 ALA N N 652 121.206 121.206 123.395 -2.189 18986 5184 1 11 . 1 1 652 652 ALA HA H 652 3.998 3.998 3.965 0.033 18986 5185 1 11 . 1 1 652 652 ALA C C 652 176.766 176.766 179.380 -2.614 18986 5186 1 11 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.428 -3.694 18986 5187 1 11 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.294 -2.978 18986 5188 1 11 . 1 1 652 652 ALA H H 652 8.973 8.973 8.770 0.203 18986 5189 1 11 . 1 1 653 653 GLN N N 653 117.768 117.768 118.381 -0.613 18986 5190 1 11 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.304 0.173 18986 5191 1 11 . 1 1 653 653 GLN C C 653 177.388 177.388 179.366 -1.978 18986 5192 1 11 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.641 -2.580 18986 5193 1 11 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.860 -2.091 18986 5194 1 11 . 1 1 653 653 GLN H H 653 8.059 8.059 8.177 -0.118 18986 5195 1 11 . 1 1 654 654 GLN N N 654 117.979 117.979 119.039 -1.060 18986 5196 1 11 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.062 0.115 18986 5197 1 11 . 1 1 654 654 GLN C C 654 174.834 174.834 178.127 -3.293 18986 5198 1 11 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.329 -2.911 18986 5199 1 11 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.669 -2.692 18986 5200 1 11 . 1 1 654 654 GLN H H 654 7.495 7.495 8.148 -0.653 18986 5201 1 11 . 1 1 655 655 VAL N N 655 110.080 110.080 117.247 -7.167 18986 5202 1 11 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.845 0.682 18986 5203 1 11 . 1 1 655 655 VAL C C 655 173.369 173.369 176.766 -3.397 18986 5204 1 11 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.319 -6.252 18986 5205 1 11 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.367 -4.184 18986 5206 1 11 . 1 1 655 655 VAL H H 655 7.197 7.197 7.967 -0.770 18986 5207 1 11 . 1 1 656 656 GLY N N 656 107.089 107.089 107.157 -0.068 18986 5208 1 11 . 1 1 656 656 GLY C C 656 171.639 171.639 173.096 -1.457 18986 5209 1 11 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.794 -1.483 18986 5210 1 11 . 1 1 656 656 GLY H H 656 7.541 7.541 7.887 -0.346 18986 5211 1 11 . 1 1 657 657 ILE N N 657 121.266 121.266 118.873 2.393 18986 5212 1 11 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.439 -0.305 18986 5213 1 11 . 1 1 657 657 ILE C C 657 171.885 171.885 174.830 -2.945 18986 5214 1 11 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.221 -0.991 18986 5215 1 11 . 1 1 657 657 ILE CB C 657 35.191 35.191 42.191 -7.000 18986 5216 1 11 . 1 1 657 657 ILE H H 657 7.633 7.633 7.416 0.217 18986 5217 1 11 . 1 1 658 658 GLU N N 658 127.252 127.252 122.172 5.080 18986 5218 1 11 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.456 -0.253 18986 5219 1 11 . 1 1 658 658 GLU C C 658 175.316 175.316 177.052 -1.736 18986 5220 1 11 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.312 -0.952 18986 5221 1 11 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.056 -3.446 18986 5222 1 11 . 1 1 658 658 GLU H H 658 8.690 8.690 8.549 0.141 18986 5223 1 11 . 1 1 659 659 LYS N N 659 124.533 124.533 127.130 -2.597 18986 5224 1 11 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.779 0.009 18986 5225 1 11 . 1 1 659 659 LYS C C 659 175.170 175.170 177.697 -2.527 18986 5226 1 11 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.689 -2.518 18986 5227 1 11 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.001 -1.884 18986 5228 1 11 . 1 1 659 659 LYS H H 659 8.706 8.706 9.159 -0.453 18986 5229 1 11 . 1 1 660 660 SER N N 660 113.137 113.137 111.929 1.208 18986 5230 1 11 . 1 1 660 660 SER HA H 660 4.273 4.273 4.467 -0.194 18986 5231 1 11 . 1 1 660 660 SER C C 660 173.939 173.939 176.627 -2.688 18986 5232 1 11 . 1 1 660 660 SER CA C 660 58.350 58.350 61.200 -2.850 18986 5233 1 11 . 1 1 660 660 SER CB C 660 59.504 59.504 62.431 -2.927 18986 5234 1 11 . 1 1 660 660 SER H H 660 8.777 8.777 8.366 0.411 18986 5235 1 11 . 1 1 661 661 ASN N N 661 119.986 119.986 121.365 -1.379 18986 5236 1 11 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.507 0.199 18986 5237 1 11 . 1 1 661 661 ASN C C 661 174.516 174.516 177.441 -2.925 18986 5238 1 11 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.467 -4.419 18986 5239 1 11 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.643 -1.900 18986 5240 1 11 . 1 1 661 661 ASN H H 661 7.486 7.486 8.106 -0.620 18986 5241 1 11 . 1 1 662 662 ILE N N 662 120.639 120.639 120.111 0.528 18986 5242 1 11 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.786 -0.340 18986 5243 1 11 . 1 1 662 662 ILE C C 662 174.252 174.252 177.836 -3.584 18986 5244 1 11 . 1 1 662 662 ILE CA C 662 62.606 62.606 63.390 -0.784 18986 5245 1 11 . 1 1 662 662 ILE CB C 662 34.423 34.423 36.805 -2.382 18986 5246 1 11 . 1 1 662 662 ILE H H 662 7.999 7.999 8.226 -0.227 18986 5247 1 11 . 1 1 663 663 GLU N N 663 117.706 117.706 120.406 -2.700 18986 5248 1 11 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.862 -0.072 18986 5249 1 11 . 1 1 663 663 GLU C C 663 176.509 176.509 179.103 -2.594 18986 5250 1 11 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.370 -2.663 18986 5251 1 11 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.357 -2.602 18986 5252 1 11 . 1 1 663 663 GLU H H 663 8.190 8.190 8.287 -0.097 18986 5253 1 11 . 1 1 664 664 LYS N N 664 119.586 119.586 119.976 -0.390 18986 5254 1 11 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.085 -0.032 18986 5255 1 11 . 1 1 664 664 LYS C C 664 175.941 175.941 178.890 -2.949 18986 5256 1 11 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.297 -2.716 18986 5257 1 11 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.286 -2.463 18986 5258 1 11 . 1 1 664 664 LYS H H 664 7.590 7.590 8.173 -0.583 18986 5259 1 11 . 1 1 665 665 LEU N N 665 119.756 119.756 121.188 -1.432 18986 5260 1 11 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.053 0.027 18986 5261 1 11 . 1 1 665 665 LEU C C 665 176.700 176.700 178.896 -2.196 18986 5262 1 11 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.727 -2.342 18986 5263 1 11 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.956 -2.764 18986 5264 1 11 . 1 1 665 665 LEU H H 665 8.075 8.075 8.101 -0.026 18986 5265 1 11 . 1 1 666 666 LEU N N 666 118.788 118.788 119.779 -0.991 18986 5266 1 11 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.599 0.165 18986 5267 1 11 . 1 1 666 666 LEU C C 666 176.484 176.484 178.824 -2.340 18986 5268 1 11 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.149 -2.491 18986 5269 1 11 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.790 -2.179 18986 5270 1 11 . 1 1 666 666 LEU H H 666 8.550 8.550 8.639 -0.089 18986 5271 1 11 . 1 1 667 667 THR N N 667 115.244 115.244 115.554 -0.310 18986 5272 1 11 . 1 1 667 667 THR HA H 667 3.839 3.839 3.992 -0.153 18986 5273 1 11 . 1 1 667 667 THR C C 667 173.740 173.740 176.353 -2.613 18986 5274 1 11 . 1 1 667 667 THR CA C 667 64.378 64.378 67.591 -3.213 18986 5275 1 11 . 1 1 667 667 THR CB C 667 65.748 65.748 68.257 -2.509 18986 5276 1 11 . 1 1 667 667 THR H H 667 7.662 7.662 8.028 -0.366 18986 5277 1 11 . 1 1 668 668 ASP N N 668 122.862 122.862 121.946 0.916 18986 5278 1 11 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.357 0.026 18986 5279 1 11 . 1 1 668 668 ASP C C 668 177.192 177.192 178.425 -1.233 18986 5280 1 11 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.229 -2.098 18986 5281 1 11 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.915 -3.029 18986 5282 1 11 . 1 1 668 668 ASP H H 668 8.291 8.291 8.205 0.086 18986 5283 1 11 . 1 1 669 669 MET N N 669 119.640 119.640 118.641 0.999 18986 5284 1 11 . 1 1 669 669 MET HA H 669 3.917 3.917 3.978 -0.061 18986 5285 1 11 . 1 1 669 669 MET C C 669 175.414 175.414 178.538 -3.124 18986 5286 1 11 . 1 1 669 669 MET CA C 669 57.234 57.234 59.807 -2.573 18986 5287 1 11 . 1 1 669 669 MET CB C 669 32.088 32.088 32.557 -0.469 18986 5288 1 11 . 1 1 669 669 MET H H 669 8.809 8.809 8.426 0.383 18986 5289 1 11 . 1 1 670 670 ARG N N 670 122.614 122.614 117.557 5.057 18986 5290 1 11 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.538 -0.021 18986 5291 1 11 . 1 1 670 670 ARG C C 670 177.928 177.928 179.002 -1.074 18986 5292 1 11 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.557 -2.335 18986 5293 1 11 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.892 -2.588 18986 5294 1 11 . 1 1 670 670 ARG H H 670 8.450 8.450 8.373 0.077 18986 5295 1 11 . 1 1 671 671 LYS N N 671 121.976 121.976 119.704 2.272 18986 5296 1 11 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.242 -0.129 18986 5297 1 11 . 1 1 671 671 LYS C C 671 176.143 176.143 178.132 -1.989 18986 5298 1 11 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.316 -1.230 18986 5299 1 11 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.687 -3.183 18986 5300 1 11 . 1 1 671 671 LYS H H 671 8.609 8.609 7.913 0.696 18986 5301 1 11 . 1 1 672 672 SER N N 672 111.655 111.655 114.143 -2.488 18986 5302 1 11 . 1 1 672 672 SER HA H 672 4.469 4.469 4.434 0.035 18986 5303 1 11 . 1 1 672 672 SER C C 672 171.692 171.692 175.717 -4.025 18986 5304 1 11 . 1 1 672 672 SER CA C 672 56.790 56.790 59.589 -2.799 18986 5305 1 11 . 1 1 672 672 SER CB C 672 61.343 61.343 64.392 -3.049 18986 5306 1 11 . 1 1 672 672 SER H H 672 7.884 7.884 8.054 -0.170 18986 5307 1 11 . 1 1 673 673 GLY N N 673 108.029 108.029 108.128 -0.099 18986 5308 1 11 . 1 1 673 673 GLY C C 673 171.492 171.492 175.594 -4.102 18986 5309 1 11 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.168 -1.893 18986 5310 1 11 . 1 1 673 673 GLY H H 673 7.774 7.774 8.287 -0.513 18986 5311 1 11 . 1 1 674 674 ILE N N 674 116.193 116.193 119.762 -3.569 18986 5312 1 11 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.892 0.209 18986 5313 1 11 . 1 1 674 674 ILE C C 674 173.980 173.980 176.142 -2.162 18986 5314 1 11 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.669 -3.427 18986 5315 1 11 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.264 -1.460 18986 5316 1 11 . 1 1 674 674 ILE H H 674 8.026 8.026 8.265 -0.239 18986 5317 1 11 . 1 1 675 675 ILE N N 675 108.928 108.928 111.977 -3.049 18986 5318 1 11 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.701 0.657 18986 5319 1 11 . 1 1 675 675 ILE C C 675 170.797 170.797 174.119 -3.322 18986 5320 1 11 . 1 1 675 675 ILE CA C 675 56.024 56.024 59.044 -3.020 18986 5321 1 11 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.938 -2.452 18986 5322 1 11 . 1 1 675 675 ILE H H 675 7.120 7.120 7.250 -0.130 18986 5323 1 11 . 1 1 676 676 TYR N N 676 118.062 118.062 120.720 -2.658 18986 5324 1 11 . 1 1 676 676 TYR HA H 676 4.995 4.995 4.917 0.078 18986 5325 1 11 . 1 1 676 676 TYR C C 676 170.020 170.020 176.703 -6.683 18986 5326 1 11 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.625 -3.732 18986 5327 1 11 . 1 1 676 676 TYR CB C 676 38.516 38.516 39.819 -1.303 18986 5328 1 11 . 1 1 676 676 TYR H H 676 9.380 9.380 8.788 0.592 18986 5329 1 11 . 1 1 677 677 GLU N N 677 123.578 123.578 123.145 0.433 18986 5330 1 11 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.509 0.317 18986 5331 1 11 . 1 1 677 677 GLU C C 677 172.146 172.146 177.970 -5.824 18986 5332 1 11 . 1 1 677 677 GLU CA C 677 52.476 52.476 58.597 -6.121 18986 5333 1 11 . 1 1 677 677 GLU CB C 677 26.612 26.612 30.058 -3.446 18986 5334 1 11 . 1 1 677 677 GLU H H 677 8.951 8.951 8.804 0.147 18986 5335 1 11 . 1 1 678 678 ALA N N 678 133.220 133.220 120.329 12.891 18986 5336 1 11 . 1 1 678 678 ALA HA H 678 4.041 4.041 3.956 0.085 18986 5337 1 11 . 1 1 678 678 ALA C C 678 175.219 175.219 176.922 -1.703 18986 5338 1 11 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.933 -2.332 18986 5339 1 11 . 1 1 678 678 ALA CB C 678 16.599 16.599 17.727 -1.128 18986 5340 1 11 . 1 1 678 678 ALA H H 678 7.912 7.912 8.302 -0.390 18986 5341 1 11 . 1 1 679 679 LYS N N 679 115.687 115.687 117.255 -1.568 18986 5342 1 11 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.645 -0.210 18986 5343 1 11 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.544 -1.528 18986 5344 1 11 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.717 -3.722 18986 5345 1 11 . 1 1 679 679 LYS H H 679 8.215 8.215 7.821 0.394 18986 5346 1 11 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.291 -0.272 18986 5347 1 11 . 1 1 680 680 PRO C C 680 174.504 174.504 177.280 -2.776 18986 5348 1 11 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.550 -1.032 18986 5349 1 11 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.782 -3.467 18986 5350 1 11 . 1 1 681 681 GLU N N 681 118.851 118.851 120.208 -1.357 18986 5351 1 11 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.988 -0.550 18986 5352 1 11 . 1 1 681 681 GLU C C 681 172.890 172.890 175.358 -2.468 18986 5353 1 11 . 1 1 681 681 GLU CA C 681 54.481 54.481 57.646 -3.165 18986 5354 1 11 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.428 -4.639 18986 5355 1 11 . 1 1 681 681 GLU H H 681 10.003 10.003 8.842 1.161 18986 5356 1 11 . 1 1 682 682 CYS N N 682 120.934 120.934 115.789 5.145 18986 5357 1 11 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.055 -0.028 18986 5358 1 11 . 1 1 682 682 CYS C C 682 171.905 171.905 173.356 -1.451 18986 5359 1 11 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.569 -3.325 18986 5360 1 11 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.371 13.924 18986 5361 1 11 . 1 1 682 682 CYS H H 682 7.860 7.860 7.734 0.126 18986 5362 1 11 . 1 1 683 683 TYR N N 683 126.183 126.183 118.616 7.567 18986 5363 1 11 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.052 0.172 18986 5364 1 11 . 1 1 683 683 TYR C C 683 173.008 173.008 174.063 -1.055 18986 5365 1 11 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.524 -0.956 18986 5366 1 11 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.267 -2.315 18986 5367 1 11 . 1 1 683 683 TYR H H 683 9.297 9.297 8.927 0.370 18986 5368 1 11 . 1 1 684 684 LYS N N 684 118.604 118.604 122.351 -3.747 18986 5369 1 11 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.880 -0.443 18986 5370 1 11 . 1 1 684 684 LYS C C 684 171.628 171.628 175.241 -3.613 18986 5371 1 11 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.047 -1.744 18986 5372 1 11 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.144 -1.467 18986 5373 1 11 . 1 1 684 684 LYS H H 684 8.630 8.630 9.130 -0.500 18986 5374 1 11 . 1 1 685 685 LYS N N 685 122.869 122.869 127.861 -4.992 18986 5375 1 11 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.064 0.580 18986 5376 1 11 . 1 1 685 685 LYS C C 685 173.337 173.337 176.338 -3.001 18986 5377 1 11 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.645 -2.392 18986 5378 1 11 . 1 1 685 685 LYS CB C 685 30.927 30.927 31.713 -0.786 18986 5379 1 11 . 1 1 685 685 LYS H H 685 8.969 8.969 8.771 0.198 18986 5380 1 12 . 1 1 601 601 SER HA H 601 4.475 4.475 4.215 0.260 18986 5381 1 12 . 1 1 601 601 SER CA C 601 55.508 55.508 57.679 -2.171 18986 5382 1 12 . 1 1 601 601 SER CB C 601 61.220 61.220 64.647 -3.427 18986 5383 1 12 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.896 -0.280 18986 5384 1 12 . 1 1 602 602 HIS C C 602 172.320 172.320 176.027 -3.707 18986 5385 1 12 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.078 -2.224 18986 5386 1 12 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.458 -2.375 18986 5387 1 12 . 1 1 603 603 MET N N 603 121.862 121.862 116.398 5.464 18986 5388 1 12 . 1 1 603 603 MET HA H 603 4.425 4.425 4.100 0.325 18986 5389 1 12 . 1 1 603 603 MET C C 603 173.948 173.948 176.091 -2.143 18986 5390 1 12 . 1 1 603 603 MET CA C 603 53.108 53.108 56.991 -3.883 18986 5391 1 12 . 1 1 603 603 MET CB C 603 30.049 30.049 29.977 0.072 18986 5392 1 12 . 1 1 603 603 MET H H 603 8.394 8.394 8.371 0.023 18986 5393 1 12 . 1 1 604 604 GLY N N 604 110.382 110.382 106.764 3.618 18986 5394 1 12 . 1 1 604 604 GLY C C 604 171.590 171.590 174.134 -2.544 18986 5395 1 12 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.724 -2.107 18986 5396 1 12 . 1 1 604 604 GLY H H 604 8.411 8.411 8.027 0.384 18986 5397 1 12 . 1 1 605 605 GLU N N 605 120.709 120.709 119.734 0.975 18986 5398 1 12 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.296 0.011 18986 5399 1 12 . 1 1 605 605 GLU C C 605 174.220 174.220 176.045 -1.825 18986 5400 1 12 . 1 1 605 605 GLU CA C 605 53.966 53.966 57.529 -3.563 18986 5401 1 12 . 1 1 605 605 GLU CB C 605 27.611 27.611 29.671 -2.060 18986 5402 1 12 . 1 1 605 605 GLU H H 605 8.282 8.282 8.601 -0.319 18986 5403 1 12 . 1 1 606 606 SER N N 606 116.679 116.679 113.052 3.627 18986 5404 1 12 . 1 1 606 606 SER HA H 606 4.405 4.405 4.649 -0.244 18986 5405 1 12 . 1 1 606 606 SER C C 606 172.455 172.455 173.001 -0.546 18986 5406 1 12 . 1 1 606 606 SER CA C 606 56.028 56.028 58.203 -2.175 18986 5407 1 12 . 1 1 606 606 SER CB C 606 61.039 61.039 64.818 -3.779 18986 5408 1 12 . 1 1 606 606 SER H H 606 8.420 8.420 7.888 0.532 18986 5409 1 12 . 1 1 607 607 GLY N N 607 110.716 110.716 109.723 0.993 18986 5410 1 12 . 1 1 607 607 GLY C C 607 171.173 171.173 171.691 -0.518 18986 5411 1 12 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.247 -2.606 18986 5412 1 12 . 1 1 607 607 GLY H H 607 8.386 8.386 7.823 0.563 18986 5413 1 12 . 1 1 608 608 LYS N N 608 120.785 120.785 118.983 1.802 18986 5414 1 12 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.525 -0.186 18986 5415 1 12 . 1 1 608 608 LYS C C 608 173.673 173.673 175.168 -1.495 18986 5416 1 12 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.206 -2.841 18986 5417 1 12 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.987 -3.456 18986 5418 1 12 . 1 1 608 608 LYS H H 608 8.008 8.008 8.073 -0.065 18986 5419 1 12 . 1 1 609 609 ILE N N 609 122.404 122.404 121.483 0.921 18986 5420 1 12 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.378 -0.229 18986 5421 1 12 . 1 1 609 609 ILE C C 609 172.675 172.675 173.839 -1.164 18986 5422 1 12 . 1 1 609 609 ILE CA C 609 58.003 58.003 61.027 -3.024 18986 5423 1 12 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.902 -3.698 18986 5424 1 12 . 1 1 609 609 ILE H H 609 8.186 8.186 7.614 0.572 18986 5425 1 12 . 1 1 610 610 ASP N N 610 125.357 125.357 126.147 -0.790 18986 5426 1 12 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.866 -0.163 18986 5427 1 12 . 1 1 610 610 ASP C C 610 173.668 173.668 175.752 -2.084 18986 5428 1 12 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.127 -2.425 18986 5429 1 12 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.012 -4.322 18986 5430 1 12 . 1 1 610 610 ASP H H 610 8.369 8.369 8.007 0.362 18986 5431 1 12 . 1 1 611 611 ILE N N 611 122.494 122.494 121.482 1.012 18986 5432 1 12 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.955 -0.046 18986 5433 1 12 . 1 1 611 611 ILE C C 611 173.618 173.618 177.328 -3.710 18986 5434 1 12 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.678 -3.638 18986 5435 1 12 . 1 1 611 611 ILE CB C 611 35.798 35.798 37.932 -2.134 18986 5436 1 12 . 1 1 611 611 ILE H H 611 8.284 8.284 8.338 -0.054 18986 5437 1 12 . 1 1 612 612 ASP N N 612 121.440 121.440 118.848 2.592 18986 5438 1 12 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.413 0.021 18986 5439 1 12 . 1 1 612 612 ASP C C 612 175.129 175.129 178.559 -3.430 18986 5440 1 12 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.751 -3.985 18986 5441 1 12 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.223 -1.085 18986 5442 1 12 . 1 1 612 612 ASP H H 612 8.279 8.279 8.556 -0.277 18986 5443 1 12 . 1 1 613 613 THR N N 613 114.422 114.422 113.238 1.184 18986 5444 1 12 . 1 1 613 613 THR HA H 613 4.106 4.106 4.066 0.040 18986 5445 1 12 . 1 1 613 613 THR C C 613 173.338 173.338 175.346 -2.008 18986 5446 1 12 . 1 1 613 613 THR CA C 613 61.545 61.545 64.686 -3.141 18986 5447 1 12 . 1 1 613 613 THR CB C 613 66.267 66.267 68.585 -2.318 18986 5448 1 12 . 1 1 613 613 THR H H 613 7.866 7.866 8.203 -0.337 18986 5449 1 12 . 1 1 614 614 ILE N N 614 121.654 121.654 118.461 3.193 18986 5450 1 12 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.036 -0.007 18986 5451 1 12 . 1 1 614 614 ILE C C 614 174.471 174.471 177.668 -3.197 18986 5452 1 12 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.443 -3.269 18986 5453 1 12 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.926 -3.111 18986 5454 1 12 . 1 1 614 614 ILE H H 614 7.819 7.819 7.228 0.591 18986 5455 1 12 . 1 1 615 615 MET N N 615 119.713 119.713 119.192 0.521 18986 5456 1 12 . 1 1 615 615 MET HA H 615 4.478 4.478 4.571 -0.093 18986 5457 1 12 . 1 1 615 615 MET C C 615 174.075 174.075 177.695 -3.620 18986 5458 1 12 . 1 1 615 615 MET CA C 615 52.764 52.764 57.668 -4.904 18986 5459 1 12 . 1 1 615 615 MET CB C 615 29.337 29.337 32.139 -2.801 18986 5460 1 12 . 1 1 615 615 MET H H 615 8.188 8.188 8.429 -0.241 18986 5461 1 12 . 1 1 616 616 THR N N 616 114.770 114.770 113.600 1.170 18986 5462 1 12 . 1 1 616 616 THR HA H 616 4.099 4.099 4.141 -0.042 18986 5463 1 12 . 1 1 616 616 THR C C 616 172.535 172.535 175.896 -3.361 18986 5464 1 12 . 1 1 616 616 THR CA C 616 61.112 61.112 63.756 -2.644 18986 5465 1 12 . 1 1 616 616 THR CB C 616 66.617 66.617 69.218 -2.601 18986 5466 1 12 . 1 1 616 616 THR H H 616 7.722 7.722 8.196 -0.474 18986 5467 1 12 . 1 1 617 617 GLY N N 617 111.384 111.384 106.770 4.614 18986 5468 1 12 . 1 1 617 617 GLY C C 617 171.437 171.437 173.372 -1.935 18986 5469 1 12 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.150 -2.708 18986 5470 1 12 . 1 1 617 617 GLY H H 617 8.431 8.431 7.880 0.551 18986 5471 1 12 . 1 1 618 618 LYS N N 618 120.996 120.996 120.085 0.911 18986 5472 1 12 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.773 -0.106 18986 5473 1 12 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.901 -2.073 18986 5474 1 12 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.451 -4.974 18986 5475 1 12 . 1 1 618 618 LYS H H 618 7.821 7.821 7.815 0.006 18986 5476 1 12 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.490 -0.021 18986 5477 1 12 . 1 1 619 619 PRO C C 619 174.453 174.453 176.873 -2.420 18986 5478 1 12 . 1 1 619 619 PRO CA C 619 60.192 60.192 63.366 -3.174 18986 5479 1 12 . 1 1 619 619 PRO CB C 619 29.580 29.580 30.818 -1.238 18986 5480 1 12 . 1 1 620 620 LYS N N 620 123.464 123.464 115.627 7.837 18986 5481 1 12 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.754 0.292 18986 5482 1 12 . 1 1 620 620 LYS C C 620 174.895 174.895 177.439 -2.544 18986 5483 1 12 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.487 -3.198 18986 5484 1 12 . 1 1 620 620 LYS CB C 620 30.454 30.454 30.698 -0.244 18986 5485 1 12 . 1 1 620 620 LYS H H 620 8.728 8.728 8.549 0.179 18986 5486 1 12 . 1 1 621 621 SER N N 621 113.921 113.921 116.169 -2.248 18986 5487 1 12 . 1 1 621 621 SER HA H 621 4.336 4.336 4.155 0.181 18986 5488 1 12 . 1 1 621 621 SER C C 621 173.149 173.149 176.002 -2.853 18986 5489 1 12 . 1 1 621 621 SER CA C 621 56.691 56.691 61.171 -4.480 18986 5490 1 12 . 1 1 621 621 SER CB C 621 60.689 60.689 62.996 -2.307 18986 5491 1 12 . 1 1 621 621 SER H H 621 8.531 8.531 8.119 0.412 18986 5492 1 12 . 1 1 622 622 ALA N N 622 124.177 124.177 125.662 -1.485 18986 5493 1 12 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.957 0.211 18986 5494 1 12 . 1 1 622 622 ALA C C 622 176.804 176.804 179.062 -2.258 18986 5495 1 12 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.391 -3.023 18986 5496 1 12 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.074 -2.220 18986 5497 1 12 . 1 1 622 622 ALA H H 622 7.835 7.835 8.453 -0.618 18986 5498 1 12 . 1 1 623 623 ARG N N 623 118.263 118.263 119.220 -0.957 18986 5499 1 12 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.008 -0.058 18986 5500 1 12 . 1 1 623 623 ARG C C 623 175.683 175.683 178.426 -2.743 18986 5501 1 12 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.268 -2.105 18986 5502 1 12 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.740 -2.289 18986 5503 1 12 . 1 1 623 623 ARG H H 623 8.148 8.148 7.958 0.190 18986 5504 1 12 . 1 1 624 624 GLU N N 624 117.953 117.953 117.620 0.333 18986 5505 1 12 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.179 -0.211 18986 5506 1 12 . 1 1 624 624 GLU C C 624 177.204 177.204 177.201 0.003 18986 5507 1 12 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.041 -1.184 18986 5508 1 12 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.281 -2.314 18986 5509 1 12 . 1 1 624 624 GLU H H 624 8.143 8.143 8.242 -0.099 18986 5510 1 12 . 1 1 625 625 LYS N N 625 119.222 119.222 117.898 1.324 18986 5511 1 12 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.255 -0.398 18986 5512 1 12 . 1 1 625 625 LYS C C 625 175.480 175.480 178.694 -3.214 18986 5513 1 12 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.681 -1.194 18986 5514 1 12 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.996 -2.333 18986 5515 1 12 . 1 1 625 625 LYS H H 625 7.772 7.772 7.755 0.017 18986 5516 1 12 . 1 1 626 626 MET N N 626 117.883 117.883 119.952 -2.069 18986 5517 1 12 . 1 1 626 626 MET HA H 626 3.807 3.807 3.976 -0.169 18986 5518 1 12 . 1 1 626 626 MET C C 626 175.278 175.278 178.485 -3.207 18986 5519 1 12 . 1 1 626 626 MET CA C 626 57.782 57.782 59.896 -2.114 18986 5520 1 12 . 1 1 626 626 MET CB C 626 30.657 30.657 32.763 -2.106 18986 5521 1 12 . 1 1 626 626 MET H H 626 8.367 8.367 8.509 -0.142 18986 5522 1 12 . 1 1 627 627 MET N N 627 116.185 116.185 117.264 -1.079 18986 5523 1 12 . 1 1 627 627 MET HA H 627 4.152 4.152 4.026 0.126 18986 5524 1 12 . 1 1 627 627 MET C C 627 176.393 176.393 178.594 -2.201 18986 5525 1 12 . 1 1 627 627 MET CA C 627 55.359 55.359 57.851 -2.492 18986 5526 1 12 . 1 1 627 627 MET CB C 627 28.803 28.803 31.084 -2.281 18986 5527 1 12 . 1 1 627 627 MET H H 627 8.197 8.197 8.651 -0.454 18986 5528 1 12 . 1 1 628 628 LYS N N 628 119.859 119.859 119.779 0.080 18986 5529 1 12 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.201 -0.001 18986 5530 1 12 . 1 1 628 628 LYS C C 628 175.885 175.885 179.262 -3.377 18986 5531 1 12 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.236 -4.159 18986 5532 1 12 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.223 -3.692 18986 5533 1 12 . 1 1 628 628 LYS H H 628 7.700 7.700 7.492 0.208 18986 5534 1 12 . 1 1 629 629 ILE N N 629 119.001 119.001 120.967 -1.966 18986 5535 1 12 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.646 -0.098 18986 5536 1 12 . 1 1 629 629 ILE C C 629 174.891 174.891 177.888 -2.997 18986 5537 1 12 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.638 -3.373 18986 5538 1 12 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.911 -4.062 18986 5539 1 12 . 1 1 629 629 ILE H H 629 7.970 7.970 8.388 -0.418 18986 5540 1 12 . 1 1 630 630 ILE N N 630 120.737 120.737 117.481 3.256 18986 5541 1 12 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.683 -0.216 18986 5542 1 12 . 1 1 630 630 ILE C C 630 173.875 173.875 177.753 -3.878 18986 5543 1 12 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.668 -1.914 18986 5544 1 12 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.850 -2.573 18986 5545 1 12 . 1 1 630 630 ILE H H 630 8.213 8.213 8.121 0.092 18986 5546 1 12 . 1 1 631 631 GLU N N 631 119.546 119.546 121.467 -1.921 18986 5547 1 12 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.992 0.073 18986 5548 1 12 . 1 1 631 631 GLU C C 631 177.300 177.300 179.209 -1.909 18986 5549 1 12 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.798 -2.818 18986 5550 1 12 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.512 -2.519 18986 5551 1 12 . 1 1 631 631 GLU H H 631 7.742 7.742 8.083 -0.341 18986 5552 1 12 . 1 1 632 632 ILE N N 632 121.547 121.547 120.797 0.750 18986 5553 1 12 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.662 0.021 18986 5554 1 12 . 1 1 632 632 ILE C C 632 175.454 175.454 178.140 -2.686 18986 5555 1 12 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.647 -2.991 18986 5556 1 12 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.769 -1.938 18986 5557 1 12 . 1 1 632 632 ILE H H 632 8.013 8.013 8.144 -0.131 18986 5558 1 12 . 1 1 633 633 ILE N N 633 121.605 121.605 120.825 0.780 18986 5559 1 12 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.615 -0.280 18986 5560 1 12 . 1 1 633 633 ILE C C 633 174.558 174.558 178.279 -3.721 18986 5561 1 12 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.848 -1.929 18986 5562 1 12 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.185 -1.901 18986 5563 1 12 . 1 1 633 633 ILE H H 633 8.594 8.594 8.490 0.104 18986 5564 1 12 . 1 1 634 634 ASP N N 634 118.706 118.706 119.272 -0.566 18986 5565 1 12 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.441 -0.006 18986 5566 1 12 . 1 1 634 634 ASP C C 634 176.574 176.574 178.782 -2.208 18986 5567 1 12 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.276 -2.705 18986 5568 1 12 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.943 -3.029 18986 5569 1 12 . 1 1 634 634 ASP H H 634 8.724 8.724 8.326 0.398 18986 5570 1 12 . 1 1 635 635 SER N N 635 114.064 114.064 115.545 -1.481 18986 5571 1 12 . 1 1 635 635 SER HA H 635 4.232 4.232 4.211 0.021 18986 5572 1 12 . 1 1 635 635 SER C C 635 174.487 174.487 177.424 -2.937 18986 5573 1 12 . 1 1 635 635 SER CA C 635 58.540 58.540 61.347 -2.807 18986 5574 1 12 . 1 1 635 635 SER CB C 635 60.319 60.319 63.256 -2.937 18986 5575 1 12 . 1 1 635 635 SER H H 635 7.992 7.992 8.109 -0.117 18986 5576 1 12 . 1 1 636 636 LEU N N 636 122.493 122.493 122.318 0.175 18986 5577 1 12 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.114 0.140 18986 5578 1 12 . 1 1 636 636 LEU C C 636 176.194 176.194 179.013 -2.819 18986 5579 1 12 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.974 -3.878 18986 5580 1 12 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.467 -1.761 18986 5581 1 12 . 1 1 636 636 LEU H H 636 8.169 8.169 8.394 -0.225 18986 5582 1 12 . 1 1 637 637 ALA N N 637 121.891 121.891 119.989 1.902 18986 5583 1 12 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.334 -0.245 18986 5584 1 12 . 1 1 637 637 ALA C C 637 175.131 175.131 179.873 -4.742 18986 5585 1 12 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.839 -3.503 18986 5586 1 12 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.272 -2.784 18986 5587 1 12 . 1 1 637 637 ALA H H 637 8.482 8.482 8.276 0.206 18986 5588 1 12 . 1 1 638 638 VAL N N 638 117.140 117.140 119.358 -2.218 18986 5589 1 12 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.814 0.121 18986 5590 1 12 . 1 1 638 638 VAL C C 638 174.712 174.712 176.511 -1.799 18986 5591 1 12 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.633 -2.632 18986 5592 1 12 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.258 -2.907 18986 5593 1 12 . 1 1 638 638 VAL H H 638 7.291 7.291 7.571 -0.280 18986 5594 1 12 . 1 1 639 639 SER N N 639 114.143 114.143 112.358 1.785 18986 5595 1 12 . 1 1 639 639 SER HA H 639 4.481 4.481 4.652 -0.171 18986 5596 1 12 . 1 1 639 639 SER C C 639 172.122 172.122 174.170 -2.048 18986 5597 1 12 . 1 1 639 639 SER CA C 639 56.002 56.002 57.859 -1.857 18986 5598 1 12 . 1 1 639 639 SER CB C 639 60.921 60.921 63.885 -2.964 18986 5599 1 12 . 1 1 639 639 SER H H 639 7.918 7.918 7.844 0.074 18986 5600 1 12 . 1 1 640 640 SER N N 640 115.370 115.370 117.159 -1.789 18986 5601 1 12 . 1 1 640 640 SER HA H 640 4.711 4.711 4.573 0.138 18986 5602 1 12 . 1 1 640 640 SER C C 640 171.185 171.185 173.474 -2.289 18986 5603 1 12 . 1 1 640 640 SER CA C 640 55.009 55.009 57.347 -2.338 18986 5604 1 12 . 1 1 640 640 SER CB C 640 61.974 61.974 65.093 -3.119 18986 5605 1 12 . 1 1 640 640 SER H H 640 7.765 7.765 7.544 0.221 18986 5606 1 12 . 1 1 641 641 GLU N N 641 119.994 119.994 120.651 -0.657 18986 5607 1 12 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.086 -0.042 18986 5608 1 12 . 1 1 641 641 GLU C C 641 173.167 173.167 175.466 -2.299 18986 5609 1 12 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.459 -1.808 18986 5610 1 12 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.930 -2.446 18986 5611 1 12 . 1 1 641 641 GLU H H 641 8.363 8.363 8.700 -0.337 18986 5612 1 12 . 1 1 642 642 CYS N N 642 110.257 110.257 112.591 -2.334 18986 5613 1 12 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.626 -0.167 18986 5614 1 12 . 1 1 642 642 CYS C C 642 168.058 168.058 173.129 -5.071 18986 5615 1 12 . 1 1 642 642 CYS CA C 642 50.946 50.946 54.965 -4.019 18986 5616 1 12 . 1 1 642 642 CYS CB C 642 41.361 41.361 30.715 10.646 18986 5617 1 12 . 1 1 642 642 CYS H H 642 7.881 7.881 7.286 0.595 18986 5618 1 12 . 1 1 643 643 ALA N N 643 123.922 123.922 122.761 1.161 18986 5619 1 12 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.382 0.256 18986 5620 1 12 . 1 1 643 643 ALA C C 643 172.517 172.517 176.508 -3.991 18986 5621 1 12 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.478 -3.858 18986 5622 1 12 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.236 -0.792 18986 5623 1 12 . 1 1 643 643 ALA H H 643 9.787 9.787 8.874 0.913 18986 5624 1 12 . 1 1 644 644 LYS N N 644 128.479 128.479 122.164 6.315 18986 5625 1 12 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.407 0.103 18986 5626 1 12 . 1 1 644 644 LYS C C 644 176.945 176.945 177.021 -0.076 18986 5627 1 12 . 1 1 644 644 LYS CA C 644 54.338 54.338 55.483 -1.145 18986 5628 1 12 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.055 -2.113 18986 5629 1 12 . 1 1 644 644 LYS H H 644 9.809 9.809 8.566 1.243 18986 5630 1 12 . 1 1 645 645 VAL N N 645 124.257 124.257 125.316 -1.059 18986 5631 1 12 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.725 -0.077 18986 5632 1 12 . 1 1 645 645 VAL C C 645 173.996 173.996 176.786 -2.790 18986 5633 1 12 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.034 -1.172 18986 5634 1 12 . 1 1 645 645 VAL CB C 645 29.201 29.201 32.005 -2.804 18986 5635 1 12 . 1 1 645 645 VAL H H 645 8.458 8.458 9.028 -0.570 18986 5636 1 12 . 1 1 646 646 LYS N N 646 117.598 117.598 120.288 -2.690 18986 5637 1 12 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.939 0.068 18986 5638 1 12 . 1 1 646 646 LYS C C 646 176.047 176.047 178.531 -2.484 18986 5639 1 12 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.102 -2.857 18986 5640 1 12 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.848 -2.450 18986 5641 1 12 . 1 1 646 646 LYS H H 646 8.706 8.706 8.353 0.353 18986 5642 1 12 . 1 1 647 647 ASP N N 647 119.229 119.229 119.299 -0.070 18986 5643 1 12 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.565 0.053 18986 5644 1 12 . 1 1 647 647 ASP C C 647 175.211 175.211 178.738 -3.527 18986 5645 1 12 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.044 -2.721 18986 5646 1 12 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.693 -1.955 18986 5647 1 12 . 1 1 647 647 ASP H H 647 7.012 7.012 7.788 -0.776 18986 5648 1 12 . 1 1 648 648 ILE N N 648 121.939 121.939 121.340 0.599 18986 5649 1 12 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.585 -0.204 18986 5650 1 12 . 1 1 648 648 ILE C C 648 175.243 175.243 177.864 -2.621 18986 5651 1 12 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.859 -2.818 18986 5652 1 12 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.872 -1.910 18986 5653 1 12 . 1 1 648 648 ILE H H 648 8.152 8.152 7.576 0.576 18986 5654 1 12 . 1 1 649 649 LEU N N 649 117.310 117.310 119.956 -2.646 18986 5655 1 12 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.801 0.072 18986 5656 1 12 . 1 1 649 649 LEU C C 649 176.439 176.439 178.923 -2.484 18986 5657 1 12 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.441 -2.556 18986 5658 1 12 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.386 -2.079 18986 5659 1 12 . 1 1 649 649 LEU H H 649 8.638 8.638 8.622 0.016 18986 5660 1 12 . 1 1 650 650 LYS N N 650 118.810 118.810 119.894 -1.084 18986 5661 1 12 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.851 0.195 18986 5662 1 12 . 1 1 650 650 LYS C C 650 176.801 176.801 178.742 -1.941 18986 5663 1 12 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.818 -2.767 18986 5664 1 12 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.355 -2.291 18986 5665 1 12 . 1 1 650 650 LYS H H 650 7.296 7.296 7.970 -0.674 18986 5666 1 12 . 1 1 651 651 GLU N N 651 117.713 117.713 118.438 -0.725 18986 5667 1 12 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.107 0.001 18986 5668 1 12 . 1 1 651 651 GLU C C 651 176.903 176.903 179.135 -2.232 18986 5669 1 12 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.560 -2.750 18986 5670 1 12 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.074 -1.626 18986 5671 1 12 . 1 1 651 651 GLU H H 651 8.036 8.036 8.417 -0.381 18986 5672 1 12 . 1 1 652 652 ALA N N 652 121.206 121.206 123.785 -2.579 18986 5673 1 12 . 1 1 652 652 ALA HA H 652 3.998 3.998 3.915 0.083 18986 5674 1 12 . 1 1 652 652 ALA C C 652 176.766 176.766 179.317 -2.551 18986 5675 1 12 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.562 -3.828 18986 5676 1 12 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.102 -2.786 18986 5677 1 12 . 1 1 652 652 ALA H H 652 8.973 8.973 8.828 0.145 18986 5678 1 12 . 1 1 653 653 GLN N N 653 117.768 117.768 118.178 -0.410 18986 5679 1 12 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.324 0.153 18986 5680 1 12 . 1 1 653 653 GLN C C 653 177.388 177.388 178.993 -1.605 18986 5681 1 12 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.786 -2.726 18986 5682 1 12 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.570 -1.801 18986 5683 1 12 . 1 1 653 653 GLN H H 653 8.059 8.059 8.030 0.029 18986 5684 1 12 . 1 1 654 654 GLN N N 654 117.979 117.979 118.164 -0.185 18986 5685 1 12 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.093 0.084 18986 5686 1 12 . 1 1 654 654 GLN C C 654 174.834 174.834 178.586 -3.752 18986 5687 1 12 . 1 1 654 654 GLN CA C 654 55.418 55.418 57.899 -2.481 18986 5688 1 12 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.477 -2.500 18986 5689 1 12 . 1 1 654 654 GLN H H 654 7.495 7.495 8.206 -0.711 18986 5690 1 12 . 1 1 655 655 VAL N N 655 110.080 110.080 117.047 -6.967 18986 5691 1 12 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.803 0.724 18986 5692 1 12 . 1 1 655 655 VAL C C 655 173.369 173.369 177.035 -3.666 18986 5693 1 12 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.404 -6.337 18986 5694 1 12 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.447 -4.263 18986 5695 1 12 . 1 1 655 655 VAL H H 655 7.197 7.197 8.148 -0.951 18986 5696 1 12 . 1 1 656 656 GLY N N 656 107.089 107.089 105.702 1.387 18986 5697 1 12 . 1 1 656 656 GLY C C 656 171.639 171.639 174.529 -2.890 18986 5698 1 12 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.474 -1.163 18986 5699 1 12 . 1 1 656 656 GLY H H 656 7.541 7.541 7.932 -0.391 18986 5700 1 12 . 1 1 657 657 ILE N N 657 121.266 121.266 120.333 0.933 18986 5701 1 12 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.190 -0.056 18986 5702 1 12 . 1 1 657 657 ILE C C 657 171.885 171.885 175.082 -3.197 18986 5703 1 12 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.037 -2.807 18986 5704 1 12 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.115 -3.924 18986 5705 1 12 . 1 1 657 657 ILE H H 657 7.633 7.633 8.233 -0.600 18986 5706 1 12 . 1 1 658 658 GLU N N 658 127.252 127.252 122.722 4.530 18986 5707 1 12 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.484 -0.281 18986 5708 1 12 . 1 1 658 658 GLU C C 658 175.316 175.316 177.301 -1.985 18986 5709 1 12 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.217 -0.857 18986 5710 1 12 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.704 -4.094 18986 5711 1 12 . 1 1 658 658 GLU H H 658 8.690 8.690 8.469 0.221 18986 5712 1 12 . 1 1 659 659 LYS N N 659 124.533 124.533 125.435 -0.902 18986 5713 1 12 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.892 -0.104 18986 5714 1 12 . 1 1 659 659 LYS C C 659 175.170 175.170 178.384 -3.214 18986 5715 1 12 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.603 -2.432 18986 5716 1 12 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.321 -2.204 18986 5717 1 12 . 1 1 659 659 LYS H H 659 8.706 8.706 8.952 -0.246 18986 5718 1 12 . 1 1 660 660 SER N N 660 113.137 113.137 113.119 0.018 18986 5719 1 12 . 1 1 660 660 SER HA H 660 4.273 4.273 4.265 0.008 18986 5720 1 12 . 1 1 660 660 SER C C 660 173.939 173.939 176.455 -2.516 18986 5721 1 12 . 1 1 660 660 SER CA C 660 58.350 58.350 60.071 -1.721 18986 5722 1 12 . 1 1 660 660 SER CB C 660 59.504 59.504 62.929 -3.425 18986 5723 1 12 . 1 1 660 660 SER H H 660 8.777 8.777 8.803 -0.026 18986 5724 1 12 . 1 1 661 661 ASN N N 661 119.986 119.986 121.732 -1.746 18986 5725 1 12 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.368 0.338 18986 5726 1 12 . 1 1 661 661 ASN C C 661 174.516 174.516 177.713 -3.197 18986 5727 1 12 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.802 -4.754 18986 5728 1 12 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.525 -1.782 18986 5729 1 12 . 1 1 661 661 ASN H H 661 7.486 7.486 8.694 -1.208 18986 5730 1 12 . 1 1 662 662 ILE N N 662 120.639 120.639 121.134 -0.495 18986 5731 1 12 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.608 -0.162 18986 5732 1 12 . 1 1 662 662 ILE C C 662 174.252 174.252 177.870 -3.618 18986 5733 1 12 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.856 -3.250 18986 5734 1 12 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.775 -3.352 18986 5735 1 12 . 1 1 662 662 ILE H H 662 7.999 7.999 8.358 -0.359 18986 5736 1 12 . 1 1 663 663 GLU N N 663 117.706 117.706 119.577 -1.871 18986 5737 1 12 . 1 1 663 663 GLU HA H 663 3.790 3.790 4.015 -0.225 18986 5738 1 12 . 1 1 663 663 GLU C C 663 176.509 176.509 179.079 -2.570 18986 5739 1 12 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.722 -2.014 18986 5740 1 12 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.313 -2.558 18986 5741 1 12 . 1 1 663 663 GLU H H 663 8.190 8.190 8.253 -0.063 18986 5742 1 12 . 1 1 664 664 LYS N N 664 119.586 119.586 121.124 -1.538 18986 5743 1 12 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.100 -0.047 18986 5744 1 12 . 1 1 664 664 LYS C C 664 175.941 175.941 178.922 -2.981 18986 5745 1 12 . 1 1 664 664 LYS CA C 664 56.581 56.581 58.966 -2.385 18986 5746 1 12 . 1 1 664 664 LYS CB C 664 29.823 29.823 31.733 -1.910 18986 5747 1 12 . 1 1 664 664 LYS H H 664 7.590 7.590 8.318 -0.728 18986 5748 1 12 . 1 1 665 665 LEU N N 665 119.756 119.756 121.339 -1.583 18986 5749 1 12 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.990 0.090 18986 5750 1 12 . 1 1 665 665 LEU C C 665 176.700 176.700 179.081 -2.381 18986 5751 1 12 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.046 -2.661 18986 5752 1 12 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.777 -2.585 18986 5753 1 12 . 1 1 665 665 LEU H H 665 8.075 8.075 8.217 -0.142 18986 5754 1 12 . 1 1 666 666 LEU N N 666 118.788 118.788 118.976 -0.188 18986 5755 1 12 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.619 0.145 18986 5756 1 12 . 1 1 666 666 LEU C C 666 176.484 176.484 178.917 -2.433 18986 5757 1 12 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.313 -2.655 18986 5758 1 12 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.020 -2.409 18986 5759 1 12 . 1 1 666 666 LEU H H 666 8.550 8.550 8.630 -0.080 18986 5760 1 12 . 1 1 667 667 THR N N 667 115.244 115.244 116.430 -1.186 18986 5761 1 12 . 1 1 667 667 THR HA H 667 3.839 3.839 3.928 -0.089 18986 5762 1 12 . 1 1 667 667 THR C C 667 173.740 173.740 176.445 -2.705 18986 5763 1 12 . 1 1 667 667 THR CA C 667 64.378 64.378 67.539 -3.161 18986 5764 1 12 . 1 1 667 667 THR CB C 667 65.748 65.748 68.539 -2.791 18986 5765 1 12 . 1 1 667 667 THR H H 667 7.662 7.662 7.904 -0.242 18986 5766 1 12 . 1 1 668 668 ASP N N 668 122.862 122.862 122.123 0.739 18986 5767 1 12 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.436 -0.053 18986 5768 1 12 . 1 1 668 668 ASP C C 668 177.192 177.192 178.677 -1.485 18986 5769 1 12 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.158 -2.027 18986 5770 1 12 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.397 -2.511 18986 5771 1 12 . 1 1 668 668 ASP H H 668 8.291 8.291 8.309 -0.018 18986 5772 1 12 . 1 1 669 669 MET N N 669 119.640 119.640 118.509 1.131 18986 5773 1 12 . 1 1 669 669 MET HA H 669 3.917 3.917 4.035 -0.118 18986 5774 1 12 . 1 1 669 669 MET C C 669 175.414 175.414 178.438 -3.024 18986 5775 1 12 . 1 1 669 669 MET CA C 669 57.234 57.234 59.613 -2.379 18986 5776 1 12 . 1 1 669 669 MET CB C 669 32.088 32.088 32.503 -0.415 18986 5777 1 12 . 1 1 669 669 MET H H 669 8.809 8.809 8.683 0.126 18986 5778 1 12 . 1 1 670 670 ARG N N 670 122.614 122.614 117.397 5.217 18986 5779 1 12 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.474 0.043 18986 5780 1 12 . 1 1 670 670 ARG C C 670 177.928 177.928 178.841 -0.913 18986 5781 1 12 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.458 -2.236 18986 5782 1 12 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.890 -2.586 18986 5783 1 12 . 1 1 670 670 ARG H H 670 8.450 8.450 8.326 0.124 18986 5784 1 12 . 1 1 671 671 LYS N N 671 121.976 121.976 119.310 2.666 18986 5785 1 12 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.251 -0.138 18986 5786 1 12 . 1 1 671 671 LYS C C 671 176.143 176.143 177.828 -1.685 18986 5787 1 12 . 1 1 671 671 LYS CA C 671 57.086 57.086 57.971 -0.885 18986 5788 1 12 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.724 -3.220 18986 5789 1 12 . 1 1 671 671 LYS H H 671 8.609 8.609 7.902 0.707 18986 5790 1 12 . 1 1 672 672 SER N N 672 111.655 111.655 113.108 -1.453 18986 5791 1 12 . 1 1 672 672 SER HA H 672 4.469 4.469 4.365 0.104 18986 5792 1 12 . 1 1 672 672 SER C C 672 171.692 171.692 175.364 -3.672 18986 5793 1 12 . 1 1 672 672 SER CA C 672 56.790 56.790 59.451 -2.661 18986 5794 1 12 . 1 1 672 672 SER CB C 672 61.343 61.343 64.530 -3.187 18986 5795 1 12 . 1 1 672 672 SER H H 672 7.884 7.884 8.138 -0.254 18986 5796 1 12 . 1 1 673 673 GLY N N 673 108.029 108.029 108.210 -0.181 18986 5797 1 12 . 1 1 673 673 GLY C C 673 171.492 171.492 175.074 -3.582 18986 5798 1 12 . 1 1 673 673 GLY CA C 673 43.275 43.275 44.844 -1.569 18986 5799 1 12 . 1 1 673 673 GLY H H 673 7.774 7.774 8.094 -0.320 18986 5800 1 12 . 1 1 674 674 ILE N N 674 116.193 116.193 119.411 -3.218 18986 5801 1 12 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.050 0.051 18986 5802 1 12 . 1 1 674 674 ILE C C 674 173.980 173.980 175.398 -1.418 18986 5803 1 12 . 1 1 674 674 ILE CA C 674 60.242 60.242 62.299 -2.057 18986 5804 1 12 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.261 -1.457 18986 5805 1 12 . 1 1 674 674 ILE H H 674 8.026 8.026 8.289 -0.263 18986 5806 1 12 . 1 1 675 675 ILE N N 675 108.928 108.928 112.720 -3.792 18986 5807 1 12 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.783 0.575 18986 5808 1 12 . 1 1 675 675 ILE C C 675 170.797 170.797 174.021 -3.224 18986 5809 1 12 . 1 1 675 675 ILE CA C 675 56.024 56.024 59.169 -3.145 18986 5810 1 12 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.963 -2.477 18986 5811 1 12 . 1 1 675 675 ILE H H 675 7.120 7.120 7.249 -0.129 18986 5812 1 12 . 1 1 676 676 TYR N N 676 118.062 118.062 120.059 -1.997 18986 5813 1 12 . 1 1 676 676 TYR HA H 676 4.995 4.995 4.933 0.062 18986 5814 1 12 . 1 1 676 676 TYR C C 676 170.020 170.020 176.490 -6.470 18986 5815 1 12 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.706 -3.813 18986 5816 1 12 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.132 -1.616 18986 5817 1 12 . 1 1 676 676 TYR H H 676 9.380 9.380 8.949 0.431 18986 5818 1 12 . 1 1 677 677 GLU N N 677 123.578 123.578 123.189 0.389 18986 5819 1 12 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.442 0.384 18986 5820 1 12 . 1 1 677 677 GLU C C 677 172.146 172.146 177.988 -5.842 18986 5821 1 12 . 1 1 677 677 GLU CA C 677 52.476 52.476 58.594 -6.118 18986 5822 1 12 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.959 -3.346 18986 5823 1 12 . 1 1 677 677 GLU H H 677 8.951 8.951 8.861 0.090 18986 5824 1 12 . 1 1 678 678 ALA N N 678 133.220 133.220 119.779 13.441 18986 5825 1 12 . 1 1 678 678 ALA HA H 678 4.041 4.041 3.953 0.088 18986 5826 1 12 . 1 1 678 678 ALA C C 678 175.219 175.219 177.273 -2.054 18986 5827 1 12 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.971 -2.369 18986 5828 1 12 . 1 1 678 678 ALA CB C 678 16.599 16.599 17.739 -1.140 18986 5829 1 12 . 1 1 678 678 ALA H H 678 7.912 7.912 8.225 -0.313 18986 5830 1 12 . 1 1 679 679 LYS N N 679 115.687 115.687 117.868 -2.181 18986 5831 1 12 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.676 -0.241 18986 5832 1 12 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.800 -1.784 18986 5833 1 12 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.595 -3.600 18986 5834 1 12 . 1 1 679 679 LYS H H 679 8.215 8.215 7.754 0.461 18986 5835 1 12 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.313 -0.294 18986 5836 1 12 . 1 1 680 680 PRO C C 680 174.504 174.504 177.051 -2.547 18986 5837 1 12 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.903 -1.385 18986 5838 1 12 . 1 1 680 680 PRO CB C 680 28.315 28.315 32.151 -3.836 18986 5839 1 12 . 1 1 681 681 GLU N N 681 118.851 118.851 117.306 1.545 18986 5840 1 12 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.061 -0.623 18986 5841 1 12 . 1 1 681 681 GLU C C 681 172.890 172.890 175.437 -2.547 18986 5842 1 12 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.060 -3.579 18986 5843 1 12 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.349 -3.560 18986 5844 1 12 . 1 1 681 681 GLU H H 681 10.003 10.003 8.709 1.294 18986 5845 1 12 . 1 1 682 682 CYS N N 682 120.934 120.934 115.433 5.501 18986 5846 1 12 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.372 -0.345 18986 5847 1 12 . 1 1 682 682 CYS C C 682 171.905 171.905 173.161 -1.256 18986 5848 1 12 . 1 1 682 682 CYS CA C 682 54.244 54.244 58.011 -3.767 18986 5849 1 12 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.881 13.414 18986 5850 1 12 . 1 1 682 682 CYS H H 682 7.860 7.860 7.367 0.493 18986 5851 1 12 . 1 1 683 683 TYR N N 683 126.183 126.183 117.889 8.294 18986 5852 1 12 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.076 0.148 18986 5853 1 12 . 1 1 683 683 TYR C C 683 173.008 173.008 174.016 -1.008 18986 5854 1 12 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.303 -0.735 18986 5855 1 12 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.470 -2.518 18986 5856 1 12 . 1 1 683 683 TYR H H 683 9.297 9.297 9.114 0.183 18986 5857 1 12 . 1 1 684 684 LYS N N 684 118.604 118.604 119.343 -0.739 18986 5858 1 12 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.888 -0.451 18986 5859 1 12 . 1 1 684 684 LYS C C 684 171.628 171.628 174.510 -2.882 18986 5860 1 12 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.033 -1.730 18986 5861 1 12 . 1 1 684 684 LYS CB C 684 34.677 34.677 37.229 -2.552 18986 5862 1 12 . 1 1 684 684 LYS H H 684 8.630 8.630 9.138 -0.508 18986 5863 1 12 . 1 1 685 685 LYS N N 685 122.869 122.869 124.026 -1.157 18986 5864 1 12 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.222 0.422 18986 5865 1 12 . 1 1 685 685 LYS C C 685 173.337 173.337 176.080 -2.743 18986 5866 1 12 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.253 -2.000 18986 5867 1 12 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.500 -1.573 18986 5868 1 12 . 1 1 685 685 LYS H H 685 8.969 8.969 8.680 0.289 18986 5869 1 13 . 1 1 601 601 SER HA H 601 4.475 4.475 4.454 0.021 18986 5870 1 13 . 1 1 601 601 SER CA C 601 55.508 55.508 57.279 -1.771 18986 5871 1 13 . 1 1 601 601 SER CB C 601 61.220 61.220 63.813 -2.593 18986 5872 1 13 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.640 -0.024 18986 5873 1 13 . 1 1 602 602 HIS C C 602 172.320 172.320 174.886 -2.566 18986 5874 1 13 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.069 -2.215 18986 5875 1 13 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.100 -2.017 18986 5876 1 13 . 1 1 603 603 MET N N 603 121.862 121.862 119.934 1.928 18986 5877 1 13 . 1 1 603 603 MET HA H 603 4.425 4.425 4.372 0.053 18986 5878 1 13 . 1 1 603 603 MET C C 603 173.948 173.948 176.011 -2.063 18986 5879 1 13 . 1 1 603 603 MET CA C 603 53.108 53.108 56.031 -2.922 18986 5880 1 13 . 1 1 603 603 MET CB C 603 30.049 30.049 33.078 -3.029 18986 5881 1 13 . 1 1 603 603 MET H H 603 8.394 8.394 8.541 -0.147 18986 5882 1 13 . 1 1 604 604 GLY N N 604 110.382 110.382 110.090 0.292 18986 5883 1 13 . 1 1 604 604 GLY C C 604 171.590 171.590 172.838 -1.248 18986 5884 1 13 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.653 -2.036 18986 5885 1 13 . 1 1 604 604 GLY H H 604 8.411 8.411 8.315 0.096 18986 5886 1 13 . 1 1 605 605 GLU N N 605 120.709 120.709 119.842 0.867 18986 5887 1 13 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.403 -0.096 18986 5888 1 13 . 1 1 605 605 GLU C C 605 174.220 174.220 177.158 -2.938 18986 5889 1 13 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.178 -2.212 18986 5890 1 13 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.878 -3.267 18986 5891 1 13 . 1 1 605 605 GLU H H 605 8.282 8.282 8.379 -0.097 18986 5892 1 13 . 1 1 606 606 SER N N 606 116.679 116.679 120.532 -3.853 18986 5893 1 13 . 1 1 606 606 SER HA H 606 4.405 4.405 4.232 0.173 18986 5894 1 13 . 1 1 606 606 SER C C 606 172.455 172.455 175.971 -3.516 18986 5895 1 13 . 1 1 606 606 SER CA C 606 56.028 56.028 60.675 -4.647 18986 5896 1 13 . 1 1 606 606 SER CB C 606 61.039 61.039 63.104 -2.065 18986 5897 1 13 . 1 1 606 606 SER H H 606 8.420 8.420 8.706 -0.286 18986 5898 1 13 . 1 1 607 607 GLY N N 607 110.716 110.716 109.552 1.164 18986 5899 1 13 . 1 1 607 607 GLY C C 607 171.173 171.173 174.808 -3.635 18986 5900 1 13 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.575 -2.934 18986 5901 1 13 . 1 1 607 607 GLY H H 607 8.386 8.386 8.688 -0.302 18986 5902 1 13 . 1 1 608 608 LYS N N 608 120.785 120.785 120.242 0.543 18986 5903 1 13 . 1 1 608 608 LYS HA H 608 4.339 4.339 3.964 0.375 18986 5904 1 13 . 1 1 608 608 LYS C C 608 173.673 173.673 176.212 -2.539 18986 5905 1 13 . 1 1 608 608 LYS CA C 608 53.365 53.365 57.184 -3.819 18986 5906 1 13 . 1 1 608 608 LYS CB C 608 30.531 30.531 31.509 -0.978 18986 5907 1 13 . 1 1 608 608 LYS H H 608 8.008 8.008 8.993 -0.985 18986 5908 1 13 . 1 1 609 609 ILE N N 609 122.404 122.404 116.625 5.779 18986 5909 1 13 . 1 1 609 609 ILE HA H 609 4.149 4.149 3.880 0.269 18986 5910 1 13 . 1 1 609 609 ILE C C 609 172.675 172.675 176.424 -3.749 18986 5911 1 13 . 1 1 609 609 ILE CA C 609 58.003 58.003 61.433 -3.430 18986 5912 1 13 . 1 1 609 609 ILE CB C 609 36.204 36.204 34.935 1.269 18986 5913 1 13 . 1 1 609 609 ILE H H 609 8.186 8.186 8.147 0.039 18986 5914 1 13 . 1 1 610 610 ASP N N 610 125.357 125.357 123.794 1.563 18986 5915 1 13 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.555 0.148 18986 5916 1 13 . 1 1 610 610 ASP C C 610 173.668 173.668 175.868 -2.200 18986 5917 1 13 . 1 1 610 610 ASP CA C 610 50.702 50.702 54.485 -3.783 18986 5918 1 13 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.336 -3.646 18986 5919 1 13 . 1 1 610 610 ASP H H 610 8.369 8.369 8.147 0.222 18986 5920 1 13 . 1 1 611 611 ILE N N 611 122.494 122.494 118.699 3.795 18986 5921 1 13 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.433 -0.524 18986 5922 1 13 . 1 1 611 611 ILE C C 611 173.618 173.618 177.444 -3.826 18986 5923 1 13 . 1 1 611 611 ILE CA C 611 60.040 60.040 61.854 -1.814 18986 5924 1 13 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.018 -2.220 18986 5925 1 13 . 1 1 611 611 ILE H H 611 8.284 8.284 8.005 0.279 18986 5926 1 13 . 1 1 612 612 ASP N N 612 121.440 121.440 122.134 -0.694 18986 5927 1 13 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.278 0.156 18986 5928 1 13 . 1 1 612 612 ASP C C 612 175.129 175.129 177.791 -2.662 18986 5929 1 13 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.356 -4.590 18986 5930 1 13 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.824 -1.686 18986 5931 1 13 . 1 1 612 612 ASP H H 612 8.279 8.279 9.109 -0.830 18986 5932 1 13 . 1 1 613 613 THR N N 613 114.422 114.422 113.385 1.037 18986 5933 1 13 . 1 1 613 613 THR HA H 613 4.106 4.106 4.127 -0.021 18986 5934 1 13 . 1 1 613 613 THR C C 613 173.338 173.338 175.056 -1.718 18986 5935 1 13 . 1 1 613 613 THR CA C 613 61.545 61.545 64.910 -3.365 18986 5936 1 13 . 1 1 613 613 THR CB C 613 66.267 66.267 68.653 -2.386 18986 5937 1 13 . 1 1 613 613 THR H H 613 7.866 7.866 8.359 -0.493 18986 5938 1 13 . 1 1 614 614 ILE N N 614 121.654 121.654 119.219 2.435 18986 5939 1 13 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.101 -0.072 18986 5940 1 13 . 1 1 614 614 ILE C C 614 174.471 174.471 177.378 -2.907 18986 5941 1 13 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.007 -2.834 18986 5942 1 13 . 1 1 614 614 ILE CB C 614 35.815 35.815 39.149 -3.334 18986 5943 1 13 . 1 1 614 614 ILE H H 614 7.819 7.819 7.682 0.137 18986 5944 1 13 . 1 1 615 615 MET N N 615 119.713 119.713 119.854 -0.141 18986 5945 1 13 . 1 1 615 615 MET HA H 615 4.478 4.478 4.379 0.099 18986 5946 1 13 . 1 1 615 615 MET C C 615 174.075 174.075 178.325 -4.250 18986 5947 1 13 . 1 1 615 615 MET CA C 615 52.764 52.764 58.807 -6.043 18986 5948 1 13 . 1 1 615 615 MET CB C 615 29.337 29.337 32.816 -3.479 18986 5949 1 13 . 1 1 615 615 MET H H 615 8.188 8.188 8.545 -0.357 18986 5950 1 13 . 1 1 616 616 THR N N 616 114.770 114.770 113.057 1.713 18986 5951 1 13 . 1 1 616 616 THR HA H 616 4.099 4.099 4.136 -0.037 18986 5952 1 13 . 1 1 616 616 THR C C 616 172.535 172.535 175.611 -3.076 18986 5953 1 13 . 1 1 616 616 THR CA C 616 61.112 61.112 64.647 -3.535 18986 5954 1 13 . 1 1 616 616 THR CB C 616 66.617 66.617 69.226 -2.609 18986 5955 1 13 . 1 1 616 616 THR H H 616 7.722 7.722 8.214 -0.492 18986 5956 1 13 . 1 1 617 617 GLY N N 617 111.384 111.384 105.768 5.616 18986 5957 1 13 . 1 1 617 617 GLY C C 617 171.437 171.437 173.655 -2.218 18986 5958 1 13 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.182 -2.740 18986 5959 1 13 . 1 1 617 617 GLY H H 617 8.431 8.431 7.832 0.599 18986 5960 1 13 . 1 1 618 618 LYS N N 618 120.996 120.996 121.081 -0.085 18986 5961 1 13 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.864 -0.197 18986 5962 1 13 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.812 -1.984 18986 5963 1 13 . 1 1 618 618 LYS CB C 618 29.477 29.477 33.916 -4.439 18986 5964 1 13 . 1 1 618 618 LYS H H 618 7.821 7.821 7.820 0.001 18986 5965 1 13 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.561 -0.092 18986 5966 1 13 . 1 1 619 619 PRO C C 619 174.453 174.453 177.840 -3.387 18986 5967 1 13 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.378 -2.186 18986 5968 1 13 . 1 1 619 619 PRO CB C 619 29.580 29.580 33.018 -3.438 18986 5969 1 13 . 1 1 620 620 LYS N N 620 123.464 123.464 122.042 1.422 18986 5970 1 13 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.968 0.078 18986 5971 1 13 . 1 1 620 620 LYS C C 620 174.895 174.895 178.109 -3.214 18986 5972 1 13 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.639 -3.350 18986 5973 1 13 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.880 -1.426 18986 5974 1 13 . 1 1 620 620 LYS H H 620 8.728 8.728 8.784 -0.056 18986 5975 1 13 . 1 1 621 621 SER N N 621 113.921 113.921 113.579 0.342 18986 5976 1 13 . 1 1 621 621 SER HA H 621 4.336 4.336 4.429 -0.093 18986 5977 1 13 . 1 1 621 621 SER C C 621 173.149 173.149 176.228 -3.079 18986 5978 1 13 . 1 1 621 621 SER CA C 621 56.691 56.691 60.862 -4.171 18986 5979 1 13 . 1 1 621 621 SER CB C 621 60.689 60.689 62.596 -1.907 18986 5980 1 13 . 1 1 621 621 SER H H 621 8.531 8.531 8.348 0.183 18986 5981 1 13 . 1 1 622 622 ALA N N 622 124.177 124.177 125.204 -1.027 18986 5982 1 13 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.863 0.305 18986 5983 1 13 . 1 1 622 622 ALA C C 622 176.804 176.804 178.570 -1.766 18986 5984 1 13 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.939 -3.571 18986 5985 1 13 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.312 -2.458 18986 5986 1 13 . 1 1 622 622 ALA H H 622 7.835 7.835 8.371 -0.536 18986 5987 1 13 . 1 1 623 623 ARG N N 623 118.263 118.263 119.070 -0.807 18986 5988 1 13 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.028 -0.078 18986 5989 1 13 . 1 1 623 623 ARG C C 623 175.683 175.683 178.451 -2.768 18986 5990 1 13 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.982 -1.819 18986 5991 1 13 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.362 -1.911 18986 5992 1 13 . 1 1 623 623 ARG H H 623 8.148 8.148 8.083 0.065 18986 5993 1 13 . 1 1 624 624 GLU N N 624 117.953 117.953 120.507 -2.554 18986 5994 1 13 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.060 -0.092 18986 5995 1 13 . 1 1 624 624 GLU C C 624 177.204 177.204 178.200 -0.996 18986 5996 1 13 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.238 -2.381 18986 5997 1 13 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.447 -2.480 18986 5998 1 13 . 1 1 624 624 GLU H H 624 8.143 8.143 8.144 -0.001 18986 5999 1 13 . 1 1 625 625 LYS N N 625 119.222 119.222 117.160 2.062 18986 6000 1 13 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.235 -0.378 18986 6001 1 13 . 1 1 625 625 LYS C C 625 175.480 175.480 178.969 -3.489 18986 6002 1 13 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.752 -1.265 18986 6003 1 13 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.973 -2.310 18986 6004 1 13 . 1 1 625 625 LYS H H 625 7.772 7.772 7.770 0.002 18986 6005 1 13 . 1 1 626 626 MET N N 626 117.883 117.883 120.069 -2.186 18986 6006 1 13 . 1 1 626 626 MET HA H 626 3.807 3.807 4.049 -0.242 18986 6007 1 13 . 1 1 626 626 MET C C 626 175.278 175.278 178.057 -2.779 18986 6008 1 13 . 1 1 626 626 MET CA C 626 57.782 57.782 59.795 -2.013 18986 6009 1 13 . 1 1 626 626 MET CB C 626 30.657 30.657 32.764 -2.107 18986 6010 1 13 . 1 1 626 626 MET H H 626 8.367 8.367 8.708 -0.341 18986 6011 1 13 . 1 1 627 627 MET N N 627 116.185 116.185 116.022 0.163 18986 6012 1 13 . 1 1 627 627 MET HA H 627 4.152 4.152 4.242 -0.090 18986 6013 1 13 . 1 1 627 627 MET C C 627 176.393 176.393 177.583 -1.190 18986 6014 1 13 . 1 1 627 627 MET CA C 627 55.359 55.359 57.498 -2.139 18986 6015 1 13 . 1 1 627 627 MET CB C 627 28.803 28.803 31.452 -2.649 18986 6016 1 13 . 1 1 627 627 MET H H 627 8.197 8.197 8.431 -0.234 18986 6017 1 13 . 1 1 628 628 LYS N N 628 119.859 119.859 118.622 1.237 18986 6018 1 13 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.248 -0.048 18986 6019 1 13 . 1 1 628 628 LYS C C 628 175.885 175.885 178.639 -2.754 18986 6020 1 13 . 1 1 628 628 LYS CA C 628 55.077 55.077 58.544 -3.467 18986 6021 1 13 . 1 1 628 628 LYS CB C 628 28.531 28.531 33.559 -5.028 18986 6022 1 13 . 1 1 628 628 LYS H H 628 7.700 7.700 7.408 0.292 18986 6023 1 13 . 1 1 629 629 ILE N N 629 119.001 119.001 121.068 -2.067 18986 6024 1 13 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.607 -0.059 18986 6025 1 13 . 1 1 629 629 ILE C C 629 174.891 174.891 177.925 -3.034 18986 6026 1 13 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.609 -3.344 18986 6027 1 13 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.953 -4.104 18986 6028 1 13 . 1 1 629 629 ILE H H 629 7.970 7.970 8.228 -0.258 18986 6029 1 13 . 1 1 630 630 ILE N N 630 120.737 120.737 116.389 4.348 18986 6030 1 13 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.603 -0.136 18986 6031 1 13 . 1 1 630 630 ILE C C 630 173.875 173.875 177.710 -3.835 18986 6032 1 13 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.398 -2.644 18986 6033 1 13 . 1 1 630 630 ILE CB C 630 34.277 34.277 37.225 -2.948 18986 6034 1 13 . 1 1 630 630 ILE H H 630 8.213 8.213 8.547 -0.334 18986 6035 1 13 . 1 1 631 631 GLU N N 631 119.546 119.546 120.903 -1.357 18986 6036 1 13 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.095 -0.030 18986 6037 1 13 . 1 1 631 631 GLU C C 631 177.300 177.300 178.777 -1.477 18986 6038 1 13 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.128 -2.148 18986 6039 1 13 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.711 -2.718 18986 6040 1 13 . 1 1 631 631 GLU H H 631 7.742 7.742 7.488 0.254 18986 6041 1 13 . 1 1 632 632 ILE N N 632 121.547 121.547 120.384 1.163 18986 6042 1 13 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.743 -0.060 18986 6043 1 13 . 1 1 632 632 ILE C C 632 175.454 175.454 178.604 -3.150 18986 6044 1 13 . 1 1 632 632 ILE CA C 632 62.656 62.656 63.876 -1.220 18986 6045 1 13 . 1 1 632 632 ILE CB C 632 35.830 35.830 36.484 -0.654 18986 6046 1 13 . 1 1 632 632 ILE H H 632 8.013 8.013 8.466 -0.453 18986 6047 1 13 . 1 1 633 633 ILE N N 633 121.605 121.605 120.587 1.018 18986 6048 1 13 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.569 -0.234 18986 6049 1 13 . 1 1 633 633 ILE C C 633 174.558 174.558 178.308 -3.750 18986 6050 1 13 . 1 1 633 633 ILE CA C 633 63.919 63.919 66.018 -2.099 18986 6051 1 13 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.368 -2.084 18986 6052 1 13 . 1 1 633 633 ILE H H 633 8.594 8.594 8.066 0.528 18986 6053 1 13 . 1 1 634 634 ASP N N 634 118.706 118.706 120.572 -1.866 18986 6054 1 13 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.398 0.037 18986 6055 1 13 . 1 1 634 634 ASP C C 634 176.574 176.574 178.596 -2.022 18986 6056 1 13 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.651 -3.080 18986 6057 1 13 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.862 -2.948 18986 6058 1 13 . 1 1 634 634 ASP H H 634 8.724 8.724 8.296 0.428 18986 6059 1 13 . 1 1 635 635 SER N N 635 114.064 114.064 114.737 -0.673 18986 6060 1 13 . 1 1 635 635 SER HA H 635 4.232 4.232 4.220 0.012 18986 6061 1 13 . 1 1 635 635 SER C C 635 174.487 174.487 175.732 -1.245 18986 6062 1 13 . 1 1 635 635 SER CA C 635 58.540 58.540 61.378 -2.838 18986 6063 1 13 . 1 1 635 635 SER CB C 635 60.319 60.319 63.259 -2.940 18986 6064 1 13 . 1 1 635 635 SER H H 635 7.992 7.992 8.376 -0.384 18986 6065 1 13 . 1 1 636 636 LEU N N 636 122.493 122.493 120.305 2.188 18986 6066 1 13 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.473 -0.219 18986 6067 1 13 . 1 1 636 636 LEU C C 636 176.194 176.194 178.260 -2.066 18986 6068 1 13 . 1 1 636 636 LEU CA C 636 54.095 54.095 56.175 -2.080 18986 6069 1 13 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.733 -2.027 18986 6070 1 13 . 1 1 636 636 LEU H H 636 8.169 8.169 7.987 0.182 18986 6071 1 13 . 1 1 637 637 ALA N N 637 121.891 121.891 124.204 -2.313 18986 6072 1 13 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.223 -0.134 18986 6073 1 13 . 1 1 637 637 ALA C C 637 175.131 175.131 179.611 -4.480 18986 6074 1 13 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.894 -4.558 18986 6075 1 13 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.376 -2.888 18986 6076 1 13 . 1 1 637 637 ALA H H 637 8.482 8.482 8.319 0.163 18986 6077 1 13 . 1 1 638 638 VAL N N 638 117.140 117.140 116.111 1.029 18986 6078 1 13 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.861 0.074 18986 6079 1 13 . 1 1 638 638 VAL C C 638 174.712 174.712 175.687 -0.975 18986 6080 1 13 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.037 -2.036 18986 6081 1 13 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.811 -2.460 18986 6082 1 13 . 1 1 638 638 VAL H H 638 7.291 7.291 8.547 -1.256 18986 6083 1 13 . 1 1 639 639 SER N N 639 114.143 114.143 114.104 0.039 18986 6084 1 13 . 1 1 639 639 SER HA H 639 4.481 4.481 4.781 -0.300 18986 6085 1 13 . 1 1 639 639 SER C C 639 172.122 172.122 173.265 -1.143 18986 6086 1 13 . 1 1 639 639 SER CA C 639 56.002 56.002 58.021 -2.019 18986 6087 1 13 . 1 1 639 639 SER CB C 639 60.921 60.921 64.544 -3.623 18986 6088 1 13 . 1 1 639 639 SER H H 639 7.918 7.918 7.857 0.061 18986 6089 1 13 . 1 1 640 640 SER N N 640 115.370 115.370 114.771 0.599 18986 6090 1 13 . 1 1 640 640 SER HA H 640 4.711 4.711 4.621 0.090 18986 6091 1 13 . 1 1 640 640 SER C C 640 171.185 171.185 173.158 -1.973 18986 6092 1 13 . 1 1 640 640 SER CA C 640 55.009 55.009 58.888 -3.879 18986 6093 1 13 . 1 1 640 640 SER CB C 640 61.974 61.974 65.629 -3.655 18986 6094 1 13 . 1 1 640 640 SER H H 640 7.765 7.765 8.346 -0.581 18986 6095 1 13 . 1 1 641 641 GLU N N 641 119.994 119.994 120.478 -0.484 18986 6096 1 13 . 1 1 641 641 GLU HA H 641 4.044 4.044 3.996 0.048 18986 6097 1 13 . 1 1 641 641 GLU C C 641 173.167 173.167 174.488 -1.321 18986 6098 1 13 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.291 -1.639 18986 6099 1 13 . 1 1 641 641 GLU CB C 641 27.484 27.484 27.511 -0.027 18986 6100 1 13 . 1 1 641 641 GLU H H 641 8.363 8.363 8.704 -0.341 18986 6101 1 13 . 1 1 642 642 CYS N N 642 110.257 110.257 112.033 -1.776 18986 6102 1 13 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.449 0.010 18986 6103 1 13 . 1 1 642 642 CYS C C 642 168.058 168.058 173.777 -5.719 18986 6104 1 13 . 1 1 642 642 CYS CA C 642 50.946 50.946 58.106 -7.160 18986 6105 1 13 . 1 1 642 642 CYS CB C 642 41.361 41.361 28.290 13.071 18986 6106 1 13 . 1 1 642 642 CYS H H 642 7.881 7.881 7.607 0.274 18986 6107 1 13 . 1 1 643 643 ALA N N 643 123.922 123.922 126.846 -2.924 18986 6108 1 13 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.396 0.242 18986 6109 1 13 . 1 1 643 643 ALA C C 643 172.517 172.517 175.833 -3.316 18986 6110 1 13 . 1 1 643 643 ALA CA C 643 47.620 47.620 52.314 -4.694 18986 6111 1 13 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.058 -0.614 18986 6112 1 13 . 1 1 643 643 ALA H H 643 9.787 9.787 8.895 0.892 18986 6113 1 13 . 1 1 644 644 LYS N N 644 128.479 128.479 118.000 10.479 18986 6114 1 13 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.784 -0.273 18986 6115 1 13 . 1 1 644 644 LYS C C 644 176.945 176.945 176.577 0.368 18986 6116 1 13 . 1 1 644 644 LYS CA C 644 54.338 54.338 55.422 -1.084 18986 6117 1 13 . 1 1 644 644 LYS CB C 644 29.942 29.942 33.739 -3.797 18986 6118 1 13 . 1 1 644 644 LYS H H 644 9.809 9.809 8.231 1.578 18986 6119 1 13 . 1 1 645 645 VAL N N 645 124.257 124.257 125.710 -1.453 18986 6120 1 13 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.628 0.020 18986 6121 1 13 . 1 1 645 645 VAL C C 645 173.996 173.996 176.282 -2.286 18986 6122 1 13 . 1 1 645 645 VAL CA C 645 64.862 64.862 65.456 -0.594 18986 6123 1 13 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.948 -2.747 18986 6124 1 13 . 1 1 645 645 VAL H H 645 8.458 8.458 9.161 -0.703 18986 6125 1 13 . 1 1 646 646 LYS N N 646 117.598 117.598 120.722 -3.124 18986 6126 1 13 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.883 0.124 18986 6127 1 13 . 1 1 646 646 LYS C C 646 176.047 176.047 178.673 -2.626 18986 6128 1 13 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.340 -3.095 18986 6129 1 13 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.823 -2.425 18986 6130 1 13 . 1 1 646 646 LYS H H 646 8.706 8.706 8.423 0.283 18986 6131 1 13 . 1 1 647 647 ASP N N 647 119.229 119.229 119.546 -0.317 18986 6132 1 13 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.487 0.131 18986 6133 1 13 . 1 1 647 647 ASP C C 647 175.211 175.211 178.504 -3.293 18986 6134 1 13 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.461 -3.138 18986 6135 1 13 . 1 1 647 647 ASP CB C 647 38.738 38.738 41.114 -2.376 18986 6136 1 13 . 1 1 647 647 ASP H H 647 7.012 7.012 8.072 -1.060 18986 6137 1 13 . 1 1 648 648 ILE N N 648 121.939 121.939 120.958 0.981 18986 6138 1 13 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.660 -0.279 18986 6139 1 13 . 1 1 648 648 ILE C C 648 175.243 175.243 177.975 -2.732 18986 6140 1 13 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.174 -2.133 18986 6141 1 13 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.841 -1.879 18986 6142 1 13 . 1 1 648 648 ILE H H 648 8.152 8.152 8.068 0.084 18986 6143 1 13 . 1 1 649 649 LEU N N 649 117.310 117.310 120.427 -3.117 18986 6144 1 13 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.742 0.131 18986 6145 1 13 . 1 1 649 649 LEU C C 649 176.439 176.439 178.741 -2.302 18986 6146 1 13 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.717 -2.832 18986 6147 1 13 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.349 -2.042 18986 6148 1 13 . 1 1 649 649 LEU H H 649 8.638 8.638 8.558 0.080 18986 6149 1 13 . 1 1 650 650 LYS N N 650 118.810 118.810 119.348 -0.538 18986 6150 1 13 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.846 0.200 18986 6151 1 13 . 1 1 650 650 LYS C C 650 176.801 176.801 178.941 -2.140 18986 6152 1 13 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.658 -2.607 18986 6153 1 13 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.123 -2.059 18986 6154 1 13 . 1 1 650 650 LYS H H 650 7.296 7.296 7.834 -0.538 18986 6155 1 13 . 1 1 651 651 GLU N N 651 117.713 117.713 118.517 -0.804 18986 6156 1 13 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.043 0.065 18986 6157 1 13 . 1 1 651 651 GLU C C 651 176.903 176.903 179.049 -2.146 18986 6158 1 13 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.966 -3.156 18986 6159 1 13 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.114 -1.667 18986 6160 1 13 . 1 1 651 651 GLU H H 651 8.036 8.036 8.399 -0.363 18986 6161 1 13 . 1 1 652 652 ALA N N 652 121.206 121.206 122.545 -1.339 18986 6162 1 13 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.010 -0.012 18986 6163 1 13 . 1 1 652 652 ALA C C 652 176.766 176.766 179.925 -3.159 18986 6164 1 13 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.414 -3.680 18986 6165 1 13 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.020 -2.704 18986 6166 1 13 . 1 1 652 652 ALA H H 652 8.973 8.973 8.575 0.398 18986 6167 1 13 . 1 1 653 653 GLN N N 653 117.768 117.768 118.555 -0.787 18986 6168 1 13 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.422 0.055 18986 6169 1 13 . 1 1 653 653 GLN C C 653 177.388 177.388 178.584 -1.196 18986 6170 1 13 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.409 -2.349 18986 6171 1 13 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.915 -2.146 18986 6172 1 13 . 1 1 653 653 GLN H H 653 8.059 8.059 8.343 -0.284 18986 6173 1 13 . 1 1 654 654 GLN N N 654 117.979 117.979 118.111 -0.132 18986 6174 1 13 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.120 0.057 18986 6175 1 13 . 1 1 654 654 GLN C C 654 174.834 174.834 178.682 -3.848 18986 6176 1 13 . 1 1 654 654 GLN CA C 654 55.418 55.418 57.786 -2.368 18986 6177 1 13 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.644 -2.667 18986 6178 1 13 . 1 1 654 654 GLN H H 654 7.495 7.495 7.996 -0.501 18986 6179 1 13 . 1 1 655 655 VAL N N 655 110.080 110.080 117.152 -7.072 18986 6180 1 13 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.941 0.587 18986 6181 1 13 . 1 1 655 655 VAL C C 655 173.369 173.369 176.283 -2.914 18986 6182 1 13 . 1 1 655 655 VAL CA C 655 58.067 58.067 63.548 -5.481 18986 6183 1 13 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.451 -4.267 18986 6184 1 13 . 1 1 655 655 VAL H H 655 7.197 7.197 7.999 -0.802 18986 6185 1 13 . 1 1 656 656 GLY N N 656 107.089 107.089 107.094 -0.005 18986 6186 1 13 . 1 1 656 656 GLY C C 656 171.639 171.639 174.203 -2.564 18986 6187 1 13 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.779 -1.468 18986 6188 1 13 . 1 1 656 656 GLY H H 656 7.541 7.541 7.868 -0.327 18986 6189 1 13 . 1 1 657 657 ILE N N 657 121.266 121.266 121.164 0.102 18986 6190 1 13 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.314 -0.180 18986 6191 1 13 . 1 1 657 657 ILE C C 657 171.885 171.885 175.614 -3.729 18986 6192 1 13 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.662 -2.432 18986 6193 1 13 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.889 -4.698 18986 6194 1 13 . 1 1 657 657 ILE H H 657 7.633 7.633 8.441 -0.808 18986 6195 1 13 . 1 1 658 658 GLU N N 658 127.252 127.252 123.419 3.833 18986 6196 1 13 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.394 -0.192 18986 6197 1 13 . 1 1 658 658 GLU C C 658 175.316 175.316 177.219 -1.903 18986 6198 1 13 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.946 -1.586 18986 6199 1 13 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.471 -3.861 18986 6200 1 13 . 1 1 658 658 GLU H H 658 8.690 8.690 8.600 0.090 18986 6201 1 13 . 1 1 659 659 LYS N N 659 124.533 124.533 126.066 -1.533 18986 6202 1 13 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.843 -0.055 18986 6203 1 13 . 1 1 659 659 LYS C C 659 175.170 175.170 178.152 -2.982 18986 6204 1 13 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.678 -1.507 18986 6205 1 13 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.225 -1.108 18986 6206 1 13 . 1 1 659 659 LYS H H 659 8.706 8.706 8.851 -0.145 18986 6207 1 13 . 1 1 660 660 SER N N 660 113.137 113.137 114.433 -1.296 18986 6208 1 13 . 1 1 660 660 SER HA H 660 4.273 4.273 4.375 -0.102 18986 6209 1 13 . 1 1 660 660 SER C C 660 173.939 173.939 176.674 -2.735 18986 6210 1 13 . 1 1 660 660 SER CA C 660 58.350 58.350 61.667 -3.317 18986 6211 1 13 . 1 1 660 660 SER CB C 660 59.504 59.504 62.649 -3.145 18986 6212 1 13 . 1 1 660 660 SER H H 660 8.777 8.777 8.493 0.284 18986 6213 1 13 . 1 1 661 661 ASN N N 661 119.986 119.986 120.716 -0.730 18986 6214 1 13 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.495 0.211 18986 6215 1 13 . 1 1 661 661 ASN C C 661 174.516 174.516 177.375 -2.859 18986 6216 1 13 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.324 -4.276 18986 6217 1 13 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.525 -1.782 18986 6218 1 13 . 1 1 661 661 ASN H H 661 7.486 7.486 7.645 -0.159 18986 6219 1 13 . 1 1 662 662 ILE N N 662 120.639 120.639 121.034 -0.395 18986 6220 1 13 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.692 -0.246 18986 6221 1 13 . 1 1 662 662 ILE C C 662 174.252 174.252 177.488 -3.236 18986 6222 1 13 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.293 -2.687 18986 6223 1 13 . 1 1 662 662 ILE CB C 662 34.423 34.423 38.038 -3.615 18986 6224 1 13 . 1 1 662 662 ILE H H 662 7.999 7.999 8.110 -0.111 18986 6225 1 13 . 1 1 663 663 GLU N N 663 117.706 117.706 120.464 -2.758 18986 6226 1 13 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.853 -0.063 18986 6227 1 13 . 1 1 663 663 GLU C C 663 176.509 176.509 178.862 -2.353 18986 6228 1 13 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.402 -2.694 18986 6229 1 13 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.470 -2.715 18986 6230 1 13 . 1 1 663 663 GLU H H 663 8.190 8.190 8.467 -0.277 18986 6231 1 13 . 1 1 664 664 LYS N N 664 119.586 119.586 120.998 -1.412 18986 6232 1 13 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.072 -0.019 18986 6233 1 13 . 1 1 664 664 LYS C C 664 175.941 175.941 178.722 -2.781 18986 6234 1 13 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.165 -2.584 18986 6235 1 13 . 1 1 664 664 LYS CB C 664 29.823 29.823 31.804 -1.981 18986 6236 1 13 . 1 1 664 664 LYS H H 664 7.590 7.590 8.302 -0.712 18986 6237 1 13 . 1 1 665 665 LEU N N 665 119.756 119.756 121.121 -1.365 18986 6238 1 13 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.065 0.015 18986 6239 1 13 . 1 1 665 665 LEU C C 665 176.700 176.700 178.621 -1.921 18986 6240 1 13 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.602 -2.217 18986 6241 1 13 . 1 1 665 665 LEU CB C 665 39.192 39.192 40.870 -1.678 18986 6242 1 13 . 1 1 665 665 LEU H H 665 8.075 8.075 8.380 -0.305 18986 6243 1 13 . 1 1 666 666 LEU N N 666 118.788 118.788 118.991 -0.203 18986 6244 1 13 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.743 0.021 18986 6245 1 13 . 1 1 666 666 LEU C C 666 176.484 176.484 179.123 -2.639 18986 6246 1 13 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.634 -2.976 18986 6247 1 13 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.595 -1.984 18986 6248 1 13 . 1 1 666 666 LEU H H 666 8.550 8.550 8.736 -0.186 18986 6249 1 13 . 1 1 667 667 THR N N 667 115.244 115.244 115.736 -0.492 18986 6250 1 13 . 1 1 667 667 THR HA H 667 3.839 3.839 3.973 -0.134 18986 6251 1 13 . 1 1 667 667 THR C C 667 173.740 173.740 176.568 -2.828 18986 6252 1 13 . 1 1 667 667 THR CA C 667 64.378 64.378 67.328 -2.950 18986 6253 1 13 . 1 1 667 667 THR CB C 667 65.748 65.748 68.283 -2.535 18986 6254 1 13 . 1 1 667 667 THR H H 667 7.662 7.662 8.111 -0.449 18986 6255 1 13 . 1 1 668 668 ASP N N 668 122.862 122.862 122.173 0.689 18986 6256 1 13 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.396 -0.013 18986 6257 1 13 . 1 1 668 668 ASP C C 668 177.192 177.192 178.812 -1.620 18986 6258 1 13 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.248 -2.117 18986 6259 1 13 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.869 -2.983 18986 6260 1 13 . 1 1 668 668 ASP H H 668 8.291 8.291 8.359 -0.068 18986 6261 1 13 . 1 1 669 669 MET N N 669 119.640 119.640 119.332 0.308 18986 6262 1 13 . 1 1 669 669 MET HA H 669 3.917 3.917 4.128 -0.211 18986 6263 1 13 . 1 1 669 669 MET C C 669 175.414 175.414 178.708 -3.294 18986 6264 1 13 . 1 1 669 669 MET CA C 669 57.234 57.234 59.663 -2.429 18986 6265 1 13 . 1 1 669 669 MET CB C 669 32.088 32.088 32.859 -0.771 18986 6266 1 13 . 1 1 669 669 MET H H 669 8.809 8.809 8.539 0.270 18986 6267 1 13 . 1 1 670 670 ARG N N 670 122.614 122.614 116.431 6.183 18986 6268 1 13 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.638 -0.121 18986 6269 1 13 . 1 1 670 670 ARG C C 670 177.928 177.928 178.426 -0.498 18986 6270 1 13 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.009 -1.787 18986 6271 1 13 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.919 -2.615 18986 6272 1 13 . 1 1 670 670 ARG H H 670 8.450 8.450 8.438 0.012 18986 6273 1 13 . 1 1 671 671 LYS N N 671 121.976 121.976 119.535 2.441 18986 6274 1 13 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.388 -0.275 18986 6275 1 13 . 1 1 671 671 LYS C C 671 176.143 176.143 177.765 -1.622 18986 6276 1 13 . 1 1 671 671 LYS CA C 671 57.086 57.086 57.972 -0.886 18986 6277 1 13 . 1 1 671 671 LYS CB C 671 29.504 29.504 33.399 -3.895 18986 6278 1 13 . 1 1 671 671 LYS H H 671 8.609 8.609 8.016 0.593 18986 6279 1 13 . 1 1 672 672 SER N N 672 111.655 111.655 113.446 -1.791 18986 6280 1 13 . 1 1 672 672 SER HA H 672 4.469 4.469 4.447 0.022 18986 6281 1 13 . 1 1 672 672 SER C C 672 171.692 171.692 175.996 -4.304 18986 6282 1 13 . 1 1 672 672 SER CA C 672 56.790 56.790 59.542 -2.752 18986 6283 1 13 . 1 1 672 672 SER CB C 672 61.343 61.343 65.257 -3.914 18986 6284 1 13 . 1 1 672 672 SER H H 672 7.884 7.884 8.362 -0.478 18986 6285 1 13 . 1 1 673 673 GLY N N 673 108.029 108.029 110.205 -2.176 18986 6286 1 13 . 1 1 673 673 GLY C C 673 171.492 171.492 175.130 -3.638 18986 6287 1 13 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.084 -1.809 18986 6288 1 13 . 1 1 673 673 GLY H H 673 7.774 7.774 8.310 -0.536 18986 6289 1 13 . 1 1 674 674 ILE N N 674 116.193 116.193 120.069 -3.876 18986 6290 1 13 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.974 0.127 18986 6291 1 13 . 1 1 674 674 ILE C C 674 173.980 173.980 175.960 -1.980 18986 6292 1 13 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.445 -3.203 18986 6293 1 13 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.135 -1.331 18986 6294 1 13 . 1 1 674 674 ILE H H 674 8.026 8.026 8.293 -0.267 18986 6295 1 13 . 1 1 675 675 ILE N N 675 108.928 108.928 112.488 -3.560 18986 6296 1 13 . 1 1 675 675 ILE HA H 675 5.358 5.358 5.026 0.332 18986 6297 1 13 . 1 1 675 675 ILE C C 675 170.797 170.797 173.969 -3.172 18986 6298 1 13 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.917 -2.893 18986 6299 1 13 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.297 -2.811 18986 6300 1 13 . 1 1 675 675 ILE H H 675 7.120 7.120 7.375 -0.255 18986 6301 1 13 . 1 1 676 676 TYR N N 676 118.062 118.062 116.691 1.371 18986 6302 1 13 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.149 -0.154 18986 6303 1 13 . 1 1 676 676 TYR C C 676 170.020 170.020 174.763 -4.743 18986 6304 1 13 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.455 -3.562 18986 6305 1 13 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.693 -2.177 18986 6306 1 13 . 1 1 676 676 TYR H H 676 9.380 9.380 8.347 1.033 18986 6307 1 13 . 1 1 677 677 GLU N N 677 123.578 123.578 123.993 -0.415 18986 6308 1 13 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.780 0.046 18986 6309 1 13 . 1 1 677 677 GLU C C 677 172.146 172.146 178.449 -6.303 18986 6310 1 13 . 1 1 677 677 GLU CA C 677 52.476 52.476 58.429 -5.953 18986 6311 1 13 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.870 -3.258 18986 6312 1 13 . 1 1 677 677 GLU H H 677 8.951 8.951 8.860 0.091 18986 6313 1 13 . 1 1 678 678 ALA N N 678 133.220 133.220 120.264 12.956 18986 6314 1 13 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.054 -0.013 18986 6315 1 13 . 1 1 678 678 ALA C C 678 175.219 175.219 177.076 -1.857 18986 6316 1 13 . 1 1 678 678 ALA CA C 678 51.601 51.601 54.089 -2.488 18986 6317 1 13 . 1 1 678 678 ALA CB C 678 16.599 16.599 17.937 -1.338 18986 6318 1 13 . 1 1 678 678 ALA H H 678 7.912 7.912 8.364 -0.452 18986 6319 1 13 . 1 1 679 679 LYS N N 679 115.687 115.687 117.464 -1.777 18986 6320 1 13 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.673 -0.238 18986 6321 1 13 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.496 -1.480 18986 6322 1 13 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.464 -3.469 18986 6323 1 13 . 1 1 679 679 LYS H H 679 8.215 8.215 7.800 0.415 18986 6324 1 13 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.421 -0.402 18986 6325 1 13 . 1 1 680 680 PRO C C 680 174.504 174.504 176.713 -2.209 18986 6326 1 13 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.944 -1.426 18986 6327 1 13 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.757 -3.442 18986 6328 1 13 . 1 1 681 681 GLU N N 681 118.851 118.851 117.788 1.063 18986 6329 1 13 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.005 -0.567 18986 6330 1 13 . 1 1 681 681 GLU C C 681 172.890 172.890 175.197 -2.307 18986 6331 1 13 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.044 -3.562 18986 6332 1 13 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.113 -3.324 18986 6333 1 13 . 1 1 681 681 GLU H H 681 10.003 10.003 8.768 1.235 18986 6334 1 13 . 1 1 682 682 CYS N N 682 120.934 120.934 116.121 4.813 18986 6335 1 13 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.187 -0.160 18986 6336 1 13 . 1 1 682 682 CYS C C 682 171.905 171.905 173.404 -1.499 18986 6337 1 13 . 1 1 682 682 CYS CA C 682 54.244 54.244 58.308 -4.064 18986 6338 1 13 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.361 13.934 18986 6339 1 13 . 1 1 682 682 CYS H H 682 7.860 7.860 7.694 0.166 18986 6340 1 13 . 1 1 683 683 TYR N N 683 126.183 126.183 119.064 7.119 18986 6341 1 13 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.027 0.197 18986 6342 1 13 . 1 1 683 683 TYR C C 683 173.008 173.008 174.054 -1.046 18986 6343 1 13 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.100 -0.532 18986 6344 1 13 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.026 -2.074 18986 6345 1 13 . 1 1 683 683 TYR H H 683 9.297 9.297 8.988 0.309 18986 6346 1 13 . 1 1 684 684 LYS N N 684 118.604 118.604 120.619 -2.015 18986 6347 1 13 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.708 -0.271 18986 6348 1 13 . 1 1 684 684 LYS C C 684 171.628 171.628 174.732 -3.104 18986 6349 1 13 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.039 -0.736 18986 6350 1 13 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.653 -1.976 18986 6351 1 13 . 1 1 684 684 LYS H H 684 8.630 8.630 8.825 -0.195 18986 6352 1 13 . 1 1 685 685 LYS N N 685 122.869 122.869 125.831 -2.962 18986 6353 1 13 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.061 0.583 18986 6354 1 13 . 1 1 685 685 LYS C C 685 173.337 173.337 176.276 -2.939 18986 6355 1 13 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.764 -2.510 18986 6356 1 13 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.057 -1.131 18986 6357 1 13 . 1 1 685 685 LYS H H 685 8.969 8.969 8.559 0.410 18986 6358 1 14 . 1 1 601 601 SER HA H 601 4.475 4.475 4.244 0.231 18986 6359 1 14 . 1 1 601 601 SER CA C 601 55.508 55.508 58.870 -3.362 18986 6360 1 14 . 1 1 601 601 SER CB C 601 61.220 61.220 63.124 -1.904 18986 6361 1 14 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.639 -0.023 18986 6362 1 14 . 1 1 602 602 HIS C C 602 172.320 172.320 174.800 -2.480 18986 6363 1 14 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.697 -1.843 18986 6364 1 14 . 1 1 602 602 HIS CB C 602 28.083 28.083 27.782 0.301 18986 6365 1 14 . 1 1 603 603 MET N N 603 121.862 121.862 119.254 2.608 18986 6366 1 14 . 1 1 603 603 MET HA H 603 4.425 4.425 4.322 0.103 18986 6367 1 14 . 1 1 603 603 MET C C 603 173.948 173.948 177.044 -3.096 18986 6368 1 14 . 1 1 603 603 MET CA C 603 53.108 53.108 55.642 -2.534 18986 6369 1 14 . 1 1 603 603 MET CB C 603 30.049 30.049 32.587 -2.538 18986 6370 1 14 . 1 1 603 603 MET H H 603 8.394 8.394 8.325 0.069 18986 6371 1 14 . 1 1 604 604 GLY N N 604 110.382 110.382 107.698 2.684 18986 6372 1 14 . 1 1 604 604 GLY C C 604 171.590 171.590 172.564 -0.974 18986 6373 1 14 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.474 -1.857 18986 6374 1 14 . 1 1 604 604 GLY H H 604 8.411 8.411 7.860 0.551 18986 6375 1 14 . 1 1 605 605 GLU N N 605 120.709 120.709 118.385 2.324 18986 6376 1 14 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.933 -0.626 18986 6377 1 14 . 1 1 605 605 GLU C C 605 174.220 174.220 175.051 -0.831 18986 6378 1 14 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.572 -1.606 18986 6379 1 14 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.853 -3.242 18986 6380 1 14 . 1 1 605 605 GLU H H 605 8.282 8.282 8.207 0.075 18986 6381 1 14 . 1 1 606 606 SER N N 606 116.679 116.679 115.865 0.814 18986 6382 1 14 . 1 1 606 606 SER HA H 606 4.405 4.405 4.699 -0.294 18986 6383 1 14 . 1 1 606 606 SER C C 606 172.455 172.455 174.394 -1.939 18986 6384 1 14 . 1 1 606 606 SER CA C 606 56.028 56.028 58.554 -2.526 18986 6385 1 14 . 1 1 606 606 SER CB C 606 61.039 61.039 64.279 -3.240 18986 6386 1 14 . 1 1 606 606 SER H H 606 8.420 8.420 8.265 0.155 18986 6387 1 14 . 1 1 607 607 GLY N N 607 110.716 110.716 109.600 1.116 18986 6388 1 14 . 1 1 607 607 GLY C C 607 171.173 171.173 173.886 -2.713 18986 6389 1 14 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.602 -1.962 18986 6390 1 14 . 1 1 607 607 GLY H H 607 8.386 8.386 8.133 0.253 18986 6391 1 14 . 1 1 608 608 LYS N N 608 120.785 120.785 120.130 0.655 18986 6392 1 14 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.565 -0.226 18986 6393 1 14 . 1 1 608 608 LYS C C 608 173.673 173.673 175.373 -1.700 18986 6394 1 14 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.416 -3.051 18986 6395 1 14 . 1 1 608 608 LYS CB C 608 30.531 30.531 33.421 -2.890 18986 6396 1 14 . 1 1 608 608 LYS H H 608 8.008 8.008 8.336 -0.328 18986 6397 1 14 . 1 1 609 609 ILE N N 609 122.404 122.404 121.839 0.565 18986 6398 1 14 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.318 -0.169 18986 6399 1 14 . 1 1 609 609 ILE C C 609 172.675 172.675 175.395 -2.720 18986 6400 1 14 . 1 1 609 609 ILE CA C 609 58.003 58.003 59.409 -1.406 18986 6401 1 14 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.121 -1.917 18986 6402 1 14 . 1 1 609 609 ILE H H 609 8.186 8.186 7.891 0.295 18986 6403 1 14 . 1 1 610 610 ASP N N 610 125.357 125.357 127.622 -2.265 18986 6404 1 14 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.635 0.068 18986 6405 1 14 . 1 1 610 610 ASP C C 610 173.668 173.668 175.727 -2.059 18986 6406 1 14 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.497 -2.795 18986 6407 1 14 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.734 -3.044 18986 6408 1 14 . 1 1 610 610 ASP H H 610 8.369 8.369 8.454 -0.085 18986 6409 1 14 . 1 1 611 611 ILE N N 611 122.494 122.494 117.604 4.890 18986 6410 1 14 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.210 -0.301 18986 6411 1 14 . 1 1 611 611 ILE C C 611 173.618 173.618 177.162 -3.544 18986 6412 1 14 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.114 -2.075 18986 6413 1 14 . 1 1 611 611 ILE CB C 611 35.798 35.798 39.515 -3.717 18986 6414 1 14 . 1 1 611 611 ILE H H 611 8.284 8.284 8.003 0.281 18986 6415 1 14 . 1 1 612 612 ASP N N 612 121.440 121.440 121.166 0.274 18986 6416 1 14 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.445 -0.011 18986 6417 1 14 . 1 1 612 612 ASP C C 612 175.129 175.129 178.322 -3.193 18986 6418 1 14 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.624 -3.858 18986 6419 1 14 . 1 1 612 612 ASP CB C 612 38.138 38.138 41.106 -2.968 18986 6420 1 14 . 1 1 612 612 ASP H H 612 8.279 8.279 8.667 -0.388 18986 6421 1 14 . 1 1 613 613 THR N N 613 114.422 114.422 114.933 -0.511 18986 6422 1 14 . 1 1 613 613 THR HA H 613 4.106 4.106 4.028 0.078 18986 6423 1 14 . 1 1 613 613 THR C C 613 173.338 173.338 175.895 -2.557 18986 6424 1 14 . 1 1 613 613 THR CA C 613 61.545 61.545 65.873 -4.328 18986 6425 1 14 . 1 1 613 613 THR CB C 613 66.267 66.267 68.835 -2.568 18986 6426 1 14 . 1 1 613 613 THR H H 613 7.866 7.866 9.030 -1.164 18986 6427 1 14 . 1 1 614 614 ILE N N 614 121.654 121.654 119.157 2.497 18986 6428 1 14 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.956 0.073 18986 6429 1 14 . 1 1 614 614 ILE C C 614 174.471 174.471 177.932 -3.461 18986 6430 1 14 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.724 -3.551 18986 6431 1 14 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.539 -2.724 18986 6432 1 14 . 1 1 614 614 ILE H H 614 7.819 7.819 7.343 0.476 18986 6433 1 14 . 1 1 615 615 MET N N 615 119.713 119.713 118.977 0.736 18986 6434 1 14 . 1 1 615 615 MET HA H 615 4.478 4.478 4.357 0.121 18986 6435 1 14 . 1 1 615 615 MET C C 615 174.075 174.075 178.834 -4.759 18986 6436 1 14 . 1 1 615 615 MET CA C 615 52.764 52.764 58.720 -5.956 18986 6437 1 14 . 1 1 615 615 MET CB C 615 29.337 29.337 32.624 -3.288 18986 6438 1 14 . 1 1 615 615 MET H H 615 8.188 8.188 8.156 0.032 18986 6439 1 14 . 1 1 616 616 THR N N 616 114.770 114.770 112.899 1.871 18986 6440 1 14 . 1 1 616 616 THR HA H 616 4.099 4.099 4.179 -0.080 18986 6441 1 14 . 1 1 616 616 THR C C 616 172.535 172.535 175.568 -3.033 18986 6442 1 14 . 1 1 616 616 THR CA C 616 61.112 61.112 63.986 -2.874 18986 6443 1 14 . 1 1 616 616 THR CB C 616 66.617 66.617 68.932 -2.315 18986 6444 1 14 . 1 1 616 616 THR H H 616 7.722 7.722 8.458 -0.736 18986 6445 1 14 . 1 1 617 617 GLY N N 617 111.384 111.384 107.131 4.253 18986 6446 1 14 . 1 1 617 617 GLY C C 617 171.437 171.437 173.474 -2.037 18986 6447 1 14 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.169 -2.727 18986 6448 1 14 . 1 1 617 617 GLY H H 617 8.431 8.431 7.855 0.576 18986 6449 1 14 . 1 1 618 618 LYS N N 618 120.996 120.996 120.425 0.571 18986 6450 1 14 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.818 -0.151 18986 6451 1 14 . 1 1 618 618 LYS CA C 618 50.828 50.828 53.006 -2.178 18986 6452 1 14 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.614 -5.137 18986 6453 1 14 . 1 1 618 618 LYS H H 618 7.821 7.821 7.934 -0.113 18986 6454 1 14 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.526 -0.057 18986 6455 1 14 . 1 1 619 619 PRO C C 619 174.453 174.453 178.054 -3.601 18986 6456 1 14 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.529 -2.337 18986 6457 1 14 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.907 -3.327 18986 6458 1 14 . 1 1 620 620 LYS N N 620 123.464 123.464 122.308 1.156 18986 6459 1 14 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.918 0.128 18986 6460 1 14 . 1 1 620 620 LYS C C 620 174.895 174.895 178.796 -3.901 18986 6461 1 14 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.124 -3.835 18986 6462 1 14 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.925 -1.471 18986 6463 1 14 . 1 1 620 620 LYS H H 620 8.728 8.728 8.742 -0.014 18986 6464 1 14 . 1 1 621 621 SER N N 621 113.921 113.921 114.980 -1.059 18986 6465 1 14 . 1 1 621 621 SER HA H 621 4.336 4.336 4.350 -0.014 18986 6466 1 14 . 1 1 621 621 SER C C 621 173.149 173.149 176.322 -3.173 18986 6467 1 14 . 1 1 621 621 SER CA C 621 56.691 56.691 60.662 -3.971 18986 6468 1 14 . 1 1 621 621 SER CB C 621 60.689 60.689 62.622 -1.933 18986 6469 1 14 . 1 1 621 621 SER H H 621 8.531 8.531 8.148 0.383 18986 6470 1 14 . 1 1 622 622 ALA N N 622 124.177 124.177 125.082 -0.905 18986 6471 1 14 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.995 0.173 18986 6472 1 14 . 1 1 622 622 ALA C C 622 176.804 176.804 178.729 -1.925 18986 6473 1 14 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.538 -3.170 18986 6474 1 14 . 1 1 622 622 ALA CB C 622 15.854 15.854 17.952 -2.098 18986 6475 1 14 . 1 1 622 622 ALA H H 622 7.835 7.835 8.319 -0.484 18986 6476 1 14 . 1 1 623 623 ARG N N 623 118.263 118.263 119.796 -1.533 18986 6477 1 14 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.007 -0.057 18986 6478 1 14 . 1 1 623 623 ARG C C 623 175.683 175.683 178.239 -2.556 18986 6479 1 14 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.169 -2.006 18986 6480 1 14 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.259 -1.808 18986 6481 1 14 . 1 1 623 623 ARG H H 623 8.148 8.148 7.835 0.313 18986 6482 1 14 . 1 1 624 624 GLU N N 624 117.953 117.953 120.268 -2.315 18986 6483 1 14 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.056 -0.088 18986 6484 1 14 . 1 1 624 624 GLU C C 624 177.204 177.204 178.228 -1.024 18986 6485 1 14 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.309 -2.452 18986 6486 1 14 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.497 -2.530 18986 6487 1 14 . 1 1 624 624 GLU H H 624 8.143 8.143 8.310 -0.167 18986 6488 1 14 . 1 1 625 625 LYS N N 625 119.222 119.222 116.245 2.977 18986 6489 1 14 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.385 -0.528 18986 6490 1 14 . 1 1 625 625 LYS C C 625 175.480 175.480 178.878 -3.398 18986 6491 1 14 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.109 -0.622 18986 6492 1 14 . 1 1 625 625 LYS CB C 625 30.663 30.663 33.158 -2.495 18986 6493 1 14 . 1 1 625 625 LYS H H 625 7.772 7.772 7.766 0.006 18986 6494 1 14 . 1 1 626 626 MET N N 626 117.883 117.883 119.453 -1.570 18986 6495 1 14 . 1 1 626 626 MET HA H 626 3.807 3.807 4.223 -0.416 18986 6496 1 14 . 1 1 626 626 MET C C 626 175.278 175.278 178.511 -3.233 18986 6497 1 14 . 1 1 626 626 MET CA C 626 57.782 57.782 58.191 -0.409 18986 6498 1 14 . 1 1 626 626 MET CB C 626 30.657 30.657 32.140 -1.483 18986 6499 1 14 . 1 1 626 626 MET H H 626 8.367 8.367 8.698 -0.331 18986 6500 1 14 . 1 1 627 627 MET N N 627 116.185 116.185 117.650 -1.465 18986 6501 1 14 . 1 1 627 627 MET HA H 627 4.152 4.152 4.254 -0.102 18986 6502 1 14 . 1 1 627 627 MET C C 627 176.393 176.393 176.950 -0.557 18986 6503 1 14 . 1 1 627 627 MET CA C 627 55.359 55.359 59.183 -3.824 18986 6504 1 14 . 1 1 627 627 MET CB C 627 28.803 28.803 31.904 -3.101 18986 6505 1 14 . 1 1 627 627 MET H H 627 8.197 8.197 8.580 -0.383 18986 6506 1 14 . 1 1 628 628 LYS N N 628 119.859 119.859 120.243 -0.384 18986 6507 1 14 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.113 0.087 18986 6508 1 14 . 1 1 628 628 LYS C C 628 175.885 175.885 178.636 -2.751 18986 6509 1 14 . 1 1 628 628 LYS CA C 628 55.077 55.077 58.706 -3.630 18986 6510 1 14 . 1 1 628 628 LYS CB C 628 28.531 28.531 31.821 -3.290 18986 6511 1 14 . 1 1 628 628 LYS H H 628 7.700 7.700 7.405 0.295 18986 6512 1 14 . 1 1 629 629 ILE N N 629 119.001 119.001 121.763 -2.762 18986 6513 1 14 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.619 -0.071 18986 6514 1 14 . 1 1 629 629 ILE C C 629 174.891 174.891 178.022 -3.131 18986 6515 1 14 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.679 -3.414 18986 6516 1 14 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.960 -4.111 18986 6517 1 14 . 1 1 629 629 ILE H H 629 7.970 7.970 7.994 -0.024 18986 6518 1 14 . 1 1 630 630 ILE N N 630 120.737 120.737 116.829 3.908 18986 6519 1 14 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.630 -0.163 18986 6520 1 14 . 1 1 630 630 ILE C C 630 173.875 173.875 177.821 -3.946 18986 6521 1 14 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.255 -2.501 18986 6522 1 14 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.976 -2.699 18986 6523 1 14 . 1 1 630 630 ILE H H 630 8.213 8.213 8.487 -0.274 18986 6524 1 14 . 1 1 631 631 GLU N N 631 119.546 119.546 120.558 -1.012 18986 6525 1 14 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.088 -0.023 18986 6526 1 14 . 1 1 631 631 GLU C C 631 177.300 177.300 179.337 -2.037 18986 6527 1 14 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.061 -2.081 18986 6528 1 14 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.226 -2.233 18986 6529 1 14 . 1 1 631 631 GLU H H 631 7.742 7.742 7.437 0.305 18986 6530 1 14 . 1 1 632 632 ILE N N 632 121.547 121.547 121.301 0.246 18986 6531 1 14 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.667 0.016 18986 6532 1 14 . 1 1 632 632 ILE C C 632 175.454 175.454 178.129 -2.675 18986 6533 1 14 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.751 -3.095 18986 6534 1 14 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.843 -2.013 18986 6535 1 14 . 1 1 632 632 ILE H H 632 8.013 8.013 8.206 -0.193 18986 6536 1 14 . 1 1 633 633 ILE N N 633 121.605 121.605 120.090 1.515 18986 6537 1 14 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.534 -0.199 18986 6538 1 14 . 1 1 633 633 ILE C C 633 174.558 174.558 177.855 -3.297 18986 6539 1 14 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.634 -1.715 18986 6540 1 14 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.097 -1.813 18986 6541 1 14 . 1 1 633 633 ILE H H 633 8.594 8.594 8.312 0.282 18986 6542 1 14 . 1 1 634 634 ASP N N 634 118.706 118.706 119.929 -1.223 18986 6543 1 14 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.318 0.117 18986 6544 1 14 . 1 1 634 634 ASP C C 634 176.574 176.574 178.889 -2.315 18986 6545 1 14 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.503 -2.932 18986 6546 1 14 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.827 -2.913 18986 6547 1 14 . 1 1 634 634 ASP H H 634 8.724 8.724 8.348 0.376 18986 6548 1 14 . 1 1 635 635 SER N N 635 114.064 114.064 115.735 -1.671 18986 6549 1 14 . 1 1 635 635 SER HA H 635 4.232 4.232 4.207 0.025 18986 6550 1 14 . 1 1 635 635 SER C C 635 174.487 174.487 177.050 -2.563 18986 6551 1 14 . 1 1 635 635 SER CA C 635 58.540 58.540 61.554 -3.014 18986 6552 1 14 . 1 1 635 635 SER CB C 635 60.319 60.319 63.090 -2.771 18986 6553 1 14 . 1 1 635 635 SER H H 635 7.992 7.992 8.189 -0.197 18986 6554 1 14 . 1 1 636 636 LEU N N 636 122.493 122.493 122.018 0.475 18986 6555 1 14 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.341 -0.087 18986 6556 1 14 . 1 1 636 636 LEU C C 636 176.194 176.194 179.176 -2.982 18986 6557 1 14 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.461 -3.366 18986 6558 1 14 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.880 -2.174 18986 6559 1 14 . 1 1 636 636 LEU H H 636 8.169 8.169 8.360 -0.191 18986 6560 1 14 . 1 1 637 637 ALA N N 637 121.891 121.891 118.974 2.917 18986 6561 1 14 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.174 -0.085 18986 6562 1 14 . 1 1 637 637 ALA C C 637 175.131 175.131 178.075 -2.944 18986 6563 1 14 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.060 -3.724 18986 6564 1 14 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.287 -2.799 18986 6565 1 14 . 1 1 637 637 ALA H H 637 8.482 8.482 8.311 0.171 18986 6566 1 14 . 1 1 638 638 VAL N N 638 117.140 117.140 118.053 -0.913 18986 6567 1 14 . 1 1 638 638 VAL HA H 638 3.935 3.935 4.069 -0.134 18986 6568 1 14 . 1 1 638 638 VAL C C 638 174.712 174.712 177.447 -2.735 18986 6569 1 14 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.492 -2.491 18986 6570 1 14 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.383 -3.033 18986 6571 1 14 . 1 1 638 638 VAL H H 638 7.291 7.291 7.803 -0.512 18986 6572 1 14 . 1 1 639 639 SER N N 639 114.143 114.143 115.233 -1.090 18986 6573 1 14 . 1 1 639 639 SER HA H 639 4.481 4.481 4.413 0.068 18986 6574 1 14 . 1 1 639 639 SER C C 639 172.122 172.122 174.717 -2.595 18986 6575 1 14 . 1 1 639 639 SER CA C 639 56.002 56.002 60.127 -4.125 18986 6576 1 14 . 1 1 639 639 SER CB C 639 60.921 60.921 63.647 -2.726 18986 6577 1 14 . 1 1 639 639 SER H H 639 7.918 7.918 8.490 -0.572 18986 6578 1 14 . 1 1 640 640 SER N N 640 115.370 115.370 114.544 0.826 18986 6579 1 14 . 1 1 640 640 SER HA H 640 4.711 4.711 4.602 0.109 18986 6580 1 14 . 1 1 640 640 SER C C 640 171.185 171.185 173.803 -2.618 18986 6581 1 14 . 1 1 640 640 SER CA C 640 55.009 55.009 56.831 -1.822 18986 6582 1 14 . 1 1 640 640 SER CB C 640 61.974 61.974 64.068 -2.094 18986 6583 1 14 . 1 1 640 640 SER H H 640 7.765 7.765 7.552 0.213 18986 6584 1 14 . 1 1 641 641 GLU N N 641 119.994 119.994 119.215 0.779 18986 6585 1 14 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.154 -0.110 18986 6586 1 14 . 1 1 641 641 GLU C C 641 173.167 173.167 175.916 -2.749 18986 6587 1 14 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.091 -2.440 18986 6588 1 14 . 1 1 641 641 GLU CB C 641 27.484 27.484 30.060 -2.576 18986 6589 1 14 . 1 1 641 641 GLU H H 641 8.363 8.363 8.639 -0.276 18986 6590 1 14 . 1 1 642 642 CYS N N 642 110.257 110.257 112.692 -2.435 18986 6591 1 14 . 1 1 642 642 CYS HA H 642 4.459 4.459 5.053 -0.594 18986 6592 1 14 . 1 1 642 642 CYS C C 642 168.058 168.058 173.297 -5.239 18986 6593 1 14 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.806 -4.860 18986 6594 1 14 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.595 9.766 18986 6595 1 14 . 1 1 642 642 CYS H H 642 7.881 7.881 7.527 0.354 18986 6596 1 14 . 1 1 643 643 ALA N N 643 123.922 123.922 124.557 -0.635 18986 6597 1 14 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.391 0.247 18986 6598 1 14 . 1 1 643 643 ALA C C 643 172.517 172.517 176.757 -4.240 18986 6599 1 14 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.378 -3.758 18986 6600 1 14 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.591 0.853 18986 6601 1 14 . 1 1 643 643 ALA H H 643 9.787 9.787 9.019 0.768 18986 6602 1 14 . 1 1 644 644 LYS N N 644 128.479 128.479 126.888 1.591 18986 6603 1 14 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.267 0.244 18986 6604 1 14 . 1 1 644 644 LYS C C 644 176.945 176.945 177.591 -0.646 18986 6605 1 14 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.432 -2.094 18986 6606 1 14 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.704 -1.762 18986 6607 1 14 . 1 1 644 644 LYS H H 644 9.809 9.809 8.477 1.332 18986 6608 1 14 . 1 1 645 645 VAL N N 645 124.257 124.257 126.308 -2.051 18986 6609 1 14 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.777 -0.129 18986 6610 1 14 . 1 1 645 645 VAL C C 645 173.996 173.996 176.698 -2.702 18986 6611 1 14 . 1 1 645 645 VAL CA C 645 64.862 64.862 64.746 0.116 18986 6612 1 14 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.846 -2.645 18986 6613 1 14 . 1 1 645 645 VAL H H 645 8.458 8.458 9.076 -0.618 18986 6614 1 14 . 1 1 646 646 LYS N N 646 117.598 117.598 120.490 -2.892 18986 6615 1 14 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.911 0.096 18986 6616 1 14 . 1 1 646 646 LYS C C 646 176.047 176.047 178.348 -2.301 18986 6617 1 14 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.360 -3.115 18986 6618 1 14 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.957 -2.559 18986 6619 1 14 . 1 1 646 646 LYS H H 646 8.706 8.706 8.528 0.178 18986 6620 1 14 . 1 1 647 647 ASP N N 647 119.229 119.229 119.286 -0.057 18986 6621 1 14 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.500 0.118 18986 6622 1 14 . 1 1 647 647 ASP C C 647 175.211 175.211 178.768 -3.557 18986 6623 1 14 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.608 -3.285 18986 6624 1 14 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.514 -1.776 18986 6625 1 14 . 1 1 647 647 ASP H H 647 7.012 7.012 7.935 -0.923 18986 6626 1 14 . 1 1 648 648 ILE N N 648 121.939 121.939 120.743 1.196 18986 6627 1 14 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.576 -0.195 18986 6628 1 14 . 1 1 648 648 ILE C C 648 175.243 175.243 177.888 -2.645 18986 6629 1 14 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.556 -2.515 18986 6630 1 14 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.771 -1.809 18986 6631 1 14 . 1 1 648 648 ILE H H 648 8.152 8.152 7.369 0.783 18986 6632 1 14 . 1 1 649 649 LEU N N 649 117.310 117.310 120.284 -2.974 18986 6633 1 14 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.790 0.083 18986 6634 1 14 . 1 1 649 649 LEU C C 649 176.439 176.439 178.899 -2.460 18986 6635 1 14 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.503 -2.618 18986 6636 1 14 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.389 -2.083 18986 6637 1 14 . 1 1 649 649 LEU H H 649 8.638 8.638 8.590 0.048 18986 6638 1 14 . 1 1 650 650 LYS N N 650 118.810 118.810 119.878 -1.068 18986 6639 1 14 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.865 0.181 18986 6640 1 14 . 1 1 650 650 LYS C C 650 176.801 176.801 178.737 -1.936 18986 6641 1 14 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.821 -2.770 18986 6642 1 14 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.289 -2.225 18986 6643 1 14 . 1 1 650 650 LYS H H 650 7.296 7.296 8.197 -0.901 18986 6644 1 14 . 1 1 651 651 GLU N N 651 117.713 117.713 118.115 -0.402 18986 6645 1 14 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.114 -0.006 18986 6646 1 14 . 1 1 651 651 GLU C C 651 176.903 176.903 179.204 -2.301 18986 6647 1 14 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.420 -2.610 18986 6648 1 14 . 1 1 651 651 GLU CB C 651 27.448 27.448 28.949 -1.501 18986 6649 1 14 . 1 1 651 651 GLU H H 651 8.036 8.036 8.296 -0.260 18986 6650 1 14 . 1 1 652 652 ALA N N 652 121.206 121.206 123.280 -2.074 18986 6651 1 14 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.116 -0.118 18986 6652 1 14 . 1 1 652 652 ALA C C 652 176.766 176.766 179.866 -3.100 18986 6653 1 14 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.258 -3.524 18986 6654 1 14 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.180 -2.864 18986 6655 1 14 . 1 1 652 652 ALA H H 652 8.973 8.973 8.438 0.535 18986 6656 1 14 . 1 1 653 653 GLN N N 653 117.768 117.768 118.340 -0.572 18986 6657 1 14 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.345 0.132 18986 6658 1 14 . 1 1 653 653 GLN C C 653 177.388 177.388 179.044 -1.656 18986 6659 1 14 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.587 -2.527 18986 6660 1 14 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.566 -1.797 18986 6661 1 14 . 1 1 653 653 GLN H H 653 8.059 8.059 8.274 -0.215 18986 6662 1 14 . 1 1 654 654 GLN N N 654 117.979 117.979 118.737 -0.758 18986 6663 1 14 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.081 0.096 18986 6664 1 14 . 1 1 654 654 GLN C C 654 174.834 174.834 178.276 -3.442 18986 6665 1 14 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.536 -3.119 18986 6666 1 14 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.732 -2.755 18986 6667 1 14 . 1 1 654 654 GLN H H 654 7.495 7.495 8.378 -0.883 18986 6668 1 14 . 1 1 655 655 VAL N N 655 110.080 110.080 117.214 -7.134 18986 6669 1 14 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.809 0.718 18986 6670 1 14 . 1 1 655 655 VAL C C 655 173.369 173.369 176.945 -3.576 18986 6671 1 14 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.595 -6.528 18986 6672 1 14 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.457 -4.273 18986 6673 1 14 . 1 1 655 655 VAL H H 655 7.197 7.197 7.829 -0.632 18986 6674 1 14 . 1 1 656 656 GLY N N 656 107.089 107.089 106.271 0.818 18986 6675 1 14 . 1 1 656 656 GLY C C 656 171.639 171.639 174.549 -2.910 18986 6676 1 14 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.572 -1.261 18986 6677 1 14 . 1 1 656 656 GLY H H 656 7.541 7.541 7.893 -0.352 18986 6678 1 14 . 1 1 657 657 ILE N N 657 121.266 121.266 121.803 -0.537 18986 6679 1 14 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.069 0.065 18986 6680 1 14 . 1 1 657 657 ILE C C 657 171.885 171.885 175.711 -3.826 18986 6681 1 14 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.800 -3.570 18986 6682 1 14 . 1 1 657 657 ILE CB C 657 35.191 35.191 38.989 -3.798 18986 6683 1 14 . 1 1 657 657 ILE H H 657 7.633 7.633 8.262 -0.629 18986 6684 1 14 . 1 1 658 658 GLU N N 658 127.252 127.252 125.288 1.964 18986 6685 1 14 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.512 -0.309 18986 6686 1 14 . 1 1 658 658 GLU C C 658 175.316 175.316 177.937 -2.621 18986 6687 1 14 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.079 -1.719 18986 6688 1 14 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.338 -3.728 18986 6689 1 14 . 1 1 658 658 GLU H H 658 8.690 8.690 8.286 0.404 18986 6690 1 14 . 1 1 659 659 LYS N N 659 124.533 124.533 125.300 -0.767 18986 6691 1 14 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.857 -0.069 18986 6692 1 14 . 1 1 659 659 LYS C C 659 175.170 175.170 178.389 -3.219 18986 6693 1 14 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.381 -2.210 18986 6694 1 14 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.357 -2.240 18986 6695 1 14 . 1 1 659 659 LYS H H 659 8.706 8.706 9.168 -0.462 18986 6696 1 14 . 1 1 660 660 SER N N 660 113.137 113.137 113.240 -0.103 18986 6697 1 14 . 1 1 660 660 SER HA H 660 4.273 4.273 4.509 -0.236 18986 6698 1 14 . 1 1 660 660 SER C C 660 173.939 173.939 176.511 -2.572 18986 6699 1 14 . 1 1 660 660 SER CA C 660 58.350 58.350 60.526 -2.176 18986 6700 1 14 . 1 1 660 660 SER CB C 660 59.504 59.504 63.153 -3.649 18986 6701 1 14 . 1 1 660 660 SER H H 660 8.777 8.777 8.744 0.033 18986 6702 1 14 . 1 1 661 661 ASN N N 661 119.986 119.986 120.941 -0.955 18986 6703 1 14 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.424 0.282 18986 6704 1 14 . 1 1 661 661 ASN C C 661 174.516 174.516 177.558 -3.042 18986 6705 1 14 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.814 -4.766 18986 6706 1 14 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.567 -1.824 18986 6707 1 14 . 1 1 661 661 ASN H H 661 7.486 7.486 8.533 -1.047 18986 6708 1 14 . 1 1 662 662 ILE N N 662 120.639 120.639 120.517 0.122 18986 6709 1 14 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.689 -0.243 18986 6710 1 14 . 1 1 662 662 ILE C C 662 174.252 174.252 177.528 -3.276 18986 6711 1 14 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.224 -2.618 18986 6712 1 14 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.906 -3.483 18986 6713 1 14 . 1 1 662 662 ILE H H 662 7.999 7.999 8.087 -0.088 18986 6714 1 14 . 1 1 663 663 GLU N N 663 117.706 117.706 120.606 -2.900 18986 6715 1 14 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.872 -0.082 18986 6716 1 14 . 1 1 663 663 GLU C C 663 176.509 176.509 179.038 -2.529 18986 6717 1 14 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.168 -2.460 18986 6718 1 14 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.314 -2.559 18986 6719 1 14 . 1 1 663 663 GLU H H 663 8.190 8.190 8.184 0.006 18986 6720 1 14 . 1 1 664 664 LYS N N 664 119.586 119.586 119.563 0.023 18986 6721 1 14 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.135 -0.082 18986 6722 1 14 . 1 1 664 664 LYS C C 664 175.941 175.941 178.937 -2.996 18986 6723 1 14 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.255 -2.674 18986 6724 1 14 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.303 -2.479 18986 6725 1 14 . 1 1 664 664 LYS H H 664 7.590 7.590 8.265 -0.675 18986 6726 1 14 . 1 1 665 665 LEU N N 665 119.756 119.756 121.748 -1.992 18986 6727 1 14 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.997 0.083 18986 6728 1 14 . 1 1 665 665 LEU C C 665 176.700 176.700 179.265 -2.565 18986 6729 1 14 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.010 -2.625 18986 6730 1 14 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.869 -2.677 18986 6731 1 14 . 1 1 665 665 LEU H H 665 8.075 8.075 8.213 -0.138 18986 6732 1 14 . 1 1 666 666 LEU N N 666 118.788 118.788 119.103 -0.315 18986 6733 1 14 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.602 0.162 18986 6734 1 14 . 1 1 666 666 LEU C C 666 176.484 176.484 178.910 -2.426 18986 6735 1 14 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.337 -2.679 18986 6736 1 14 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.134 -2.523 18986 6737 1 14 . 1 1 666 666 LEU H H 666 8.550 8.550 8.576 -0.026 18986 6738 1 14 . 1 1 667 667 THR N N 667 115.244 115.244 116.115 -0.871 18986 6739 1 14 . 1 1 667 667 THR HA H 667 3.839 3.839 3.857 -0.018 18986 6740 1 14 . 1 1 667 667 THR C C 667 173.740 173.740 175.947 -2.207 18986 6741 1 14 . 1 1 667 667 THR CA C 667 64.378 64.378 67.910 -3.533 18986 6742 1 14 . 1 1 667 667 THR CB C 667 65.748 65.748 68.402 -2.654 18986 6743 1 14 . 1 1 667 667 THR H H 667 7.662 7.662 8.169 -0.507 18986 6744 1 14 . 1 1 668 668 ASP N N 668 122.862 122.862 121.824 1.038 18986 6745 1 14 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.354 0.029 18986 6746 1 14 . 1 1 668 668 ASP C C 668 177.192 177.192 178.662 -1.470 18986 6747 1 14 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.316 -2.185 18986 6748 1 14 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.961 -3.075 18986 6749 1 14 . 1 1 668 668 ASP H H 668 8.291 8.291 8.185 0.106 18986 6750 1 14 . 1 1 669 669 MET N N 669 119.640 119.640 118.931 0.709 18986 6751 1 14 . 1 1 669 669 MET HA H 669 3.917 3.917 4.061 -0.144 18986 6752 1 14 . 1 1 669 669 MET C C 669 175.414 175.414 178.538 -3.124 18986 6753 1 14 . 1 1 669 669 MET CA C 669 57.234 57.234 59.337 -2.103 18986 6754 1 14 . 1 1 669 669 MET CB C 669 32.088 32.088 32.506 -0.418 18986 6755 1 14 . 1 1 669 669 MET H H 669 8.809 8.809 8.350 0.459 18986 6756 1 14 . 1 1 670 670 ARG N N 670 122.614 122.614 118.371 4.243 18986 6757 1 14 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.639 -0.122 18986 6758 1 14 . 1 1 670 670 ARG C C 670 177.928 177.928 178.926 -0.998 18986 6759 1 14 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.387 -2.165 18986 6760 1 14 . 1 1 670 670 ARG CB C 670 27.304 27.304 30.231 -2.927 18986 6761 1 14 . 1 1 670 670 ARG H H 670 8.450 8.450 8.429 0.021 18986 6762 1 14 . 1 1 671 671 LYS N N 671 121.976 121.976 119.133 2.843 18986 6763 1 14 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.220 -0.107 18986 6764 1 14 . 1 1 671 671 LYS C C 671 176.143 176.143 178.428 -2.285 18986 6765 1 14 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.508 -1.422 18986 6766 1 14 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.100 -2.596 18986 6767 1 14 . 1 1 671 671 LYS H H 671 8.609 8.609 8.430 0.179 18986 6768 1 14 . 1 1 672 672 SER N N 672 111.655 111.655 113.530 -1.875 18986 6769 1 14 . 1 1 672 672 SER HA H 672 4.469 4.469 4.555 -0.086 18986 6770 1 14 . 1 1 672 672 SER C C 672 171.692 171.692 175.326 -3.634 18986 6771 1 14 . 1 1 672 672 SER CA C 672 56.790 56.790 58.543 -1.753 18986 6772 1 14 . 1 1 672 672 SER CB C 672 61.343 61.343 64.299 -2.956 18986 6773 1 14 . 1 1 672 672 SER H H 672 7.884 7.884 7.930 -0.046 18986 6774 1 14 . 1 1 673 673 GLY N N 673 108.029 108.029 108.709 -0.680 18986 6775 1 14 . 1 1 673 673 GLY C C 673 171.492 171.492 175.276 -3.784 18986 6776 1 14 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.391 -2.116 18986 6777 1 14 . 1 1 673 673 GLY H H 673 7.774 7.774 8.185 -0.411 18986 6778 1 14 . 1 1 674 674 ILE N N 674 116.193 116.193 120.239 -4.046 18986 6779 1 14 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.013 0.088 18986 6780 1 14 . 1 1 674 674 ILE C C 674 173.980 173.980 176.080 -2.100 18986 6781 1 14 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.739 -3.497 18986 6782 1 14 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.661 -1.857 18986 6783 1 14 . 1 1 674 674 ILE H H 674 8.026 8.026 8.438 -0.412 18986 6784 1 14 . 1 1 675 675 ILE N N 675 108.928 108.928 113.425 -4.497 18986 6785 1 14 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.802 0.556 18986 6786 1 14 . 1 1 675 675 ILE C C 675 170.797 170.797 173.917 -3.120 18986 6787 1 14 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.789 -2.765 18986 6788 1 14 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.961 -2.475 18986 6789 1 14 . 1 1 675 675 ILE H H 675 7.120 7.120 7.394 -0.274 18986 6790 1 14 . 1 1 676 676 TYR N N 676 118.062 118.062 115.536 2.526 18986 6791 1 14 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.096 -0.101 18986 6792 1 14 . 1 1 676 676 TYR C C 676 170.020 170.020 173.841 -3.821 18986 6793 1 14 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.492 -2.599 18986 6794 1 14 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.709 -2.193 18986 6795 1 14 . 1 1 676 676 TYR H H 676 9.380 9.380 8.817 0.563 18986 6796 1 14 . 1 1 677 677 GLU N N 677 123.578 123.578 123.311 0.267 18986 6797 1 14 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.816 0.010 18986 6798 1 14 . 1 1 677 677 GLU C C 677 172.146 172.146 175.907 -3.761 18986 6799 1 14 . 1 1 677 677 GLU CA C 677 52.476 52.476 57.345 -4.869 18986 6800 1 14 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.344 -2.732 18986 6801 1 14 . 1 1 677 677 GLU H H 677 8.951 8.951 9.073 -0.122 18986 6802 1 14 . 1 1 678 678 ALA N N 678 133.220 133.220 130.206 3.014 18986 6803 1 14 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.641 -0.600 18986 6804 1 14 . 1 1 678 678 ALA C C 678 175.219 175.219 176.895 -1.676 18986 6805 1 14 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.425 -1.824 18986 6806 1 14 . 1 1 678 678 ALA CB C 678 16.599 16.599 20.636 -4.037 18986 6807 1 14 . 1 1 678 678 ALA H H 678 7.912 7.912 8.906 -0.994 18986 6808 1 14 . 1 1 679 679 LYS N N 679 115.687 115.687 117.201 -1.514 18986 6809 1 14 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.761 -0.326 18986 6810 1 14 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.724 -1.708 18986 6811 1 14 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.029 -3.034 18986 6812 1 14 . 1 1 679 679 LYS H H 679 8.215 8.215 7.766 0.449 18986 6813 1 14 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.243 -0.224 18986 6814 1 14 . 1 1 680 680 PRO C C 680 174.504 174.504 177.313 -2.809 18986 6815 1 14 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.887 -1.369 18986 6816 1 14 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.632 -3.317 18986 6817 1 14 . 1 1 681 681 GLU N N 681 118.851 118.851 116.750 2.101 18986 6818 1 14 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.910 -0.472 18986 6819 1 14 . 1 1 681 681 GLU C C 681 172.890 172.890 174.797 -1.907 18986 6820 1 14 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.098 -3.617 18986 6821 1 14 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.042 -4.253 18986 6822 1 14 . 1 1 681 681 GLU H H 681 10.003 10.003 8.869 1.134 18986 6823 1 14 . 1 1 682 682 CYS N N 682 120.934 120.934 115.280 5.654 18986 6824 1 14 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.347 -0.320 18986 6825 1 14 . 1 1 682 682 CYS C C 682 171.905 171.905 173.752 -1.847 18986 6826 1 14 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.939 -3.695 18986 6827 1 14 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.037 14.258 18986 6828 1 14 . 1 1 682 682 CYS H H 682 7.860 7.860 7.808 0.052 18986 6829 1 14 . 1 1 683 683 TYR N N 683 126.183 126.183 120.989 5.194 18986 6830 1 14 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.382 -0.158 18986 6831 1 14 . 1 1 683 683 TYR C C 683 173.008 173.008 175.078 -2.070 18986 6832 1 14 . 1 1 683 683 TYR CA C 683 56.568 56.568 56.611 -0.043 18986 6833 1 14 . 1 1 683 683 TYR CB C 683 40.952 40.952 42.592 -1.640 18986 6834 1 14 . 1 1 683 683 TYR H H 683 9.297 9.297 9.310 -0.013 18986 6835 1 14 . 1 1 684 684 LYS N N 684 118.604 118.604 117.130 1.474 18986 6836 1 14 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.702 -0.265 18986 6837 1 14 . 1 1 684 684 LYS C C 684 171.628 171.628 175.067 -3.439 18986 6838 1 14 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.089 -1.786 18986 6839 1 14 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.962 -2.285 18986 6840 1 14 . 1 1 684 684 LYS H H 684 8.630 8.630 8.920 -0.290 18986 6841 1 14 . 1 1 685 685 LYS N N 685 122.869 122.869 121.895 0.974 18986 6842 1 14 . 1 1 685 685 LYS HA H 685 4.644 4.644 3.933 0.711 18986 6843 1 14 . 1 1 685 685 LYS C C 685 173.337 173.337 176.370 -3.033 18986 6844 1 14 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.275 -3.022 18986 6845 1 14 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.609 -1.682 18986 6846 1 14 . 1 1 685 685 LYS H H 685 8.969 8.969 8.516 0.453 18986 6847 1 15 . 1 1 601 601 SER HA H 601 4.475 4.475 3.830 0.645 18986 6848 1 15 . 1 1 601 601 SER CA C 601 55.508 55.508 58.305 -2.797 18986 6849 1 15 . 1 1 601 601 SER CB C 601 61.220 61.220 62.572 -1.352 18986 6850 1 15 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.240 0.376 18986 6851 1 15 . 1 1 602 602 HIS C C 602 172.320 172.320 176.447 -4.127 18986 6852 1 15 . 1 1 602 602 HIS CA C 602 53.854 53.854 59.289 -5.435 18986 6853 1 15 . 1 1 602 602 HIS CB C 602 28.083 28.083 29.925 -1.842 18986 6854 1 15 . 1 1 603 603 MET N N 603 121.862 121.862 117.232 4.630 18986 6855 1 15 . 1 1 603 603 MET HA H 603 4.425 4.425 4.887 -0.462 18986 6856 1 15 . 1 1 603 603 MET C C 603 173.948 173.948 175.538 -1.590 18986 6857 1 15 . 1 1 603 603 MET CA C 603 53.108 53.108 54.700 -1.591 18986 6858 1 15 . 1 1 603 603 MET CB C 603 30.049 30.049 34.637 -4.588 18986 6859 1 15 . 1 1 603 603 MET H H 603 8.394 8.394 7.814 0.580 18986 6860 1 15 . 1 1 604 604 GLY N N 604 110.382 110.382 115.827 -5.445 18986 6861 1 15 . 1 1 604 604 GLY C C 604 171.590 171.590 173.948 -2.358 18986 6862 1 15 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.587 -2.970 18986 6863 1 15 . 1 1 604 604 GLY H H 604 8.411 8.411 9.141 -0.730 18986 6864 1 15 . 1 1 605 605 GLU N N 605 120.709 120.709 122.762 -2.053 18986 6865 1 15 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.210 0.097 18986 6866 1 15 . 1 1 605 605 GLU C C 605 174.220 174.220 177.222 -3.002 18986 6867 1 15 . 1 1 605 605 GLU CA C 605 53.966 53.966 57.555 -3.589 18986 6868 1 15 . 1 1 605 605 GLU CB C 605 27.611 27.611 30.748 -3.137 18986 6869 1 15 . 1 1 605 605 GLU H H 605 8.282 8.282 8.283 -0.001 18986 6870 1 15 . 1 1 606 606 SER N N 606 116.679 116.679 116.363 0.316 18986 6871 1 15 . 1 1 606 606 SER HA H 606 4.405 4.405 4.395 0.010 18986 6872 1 15 . 1 1 606 606 SER C C 606 172.455 172.455 174.625 -2.170 18986 6873 1 15 . 1 1 606 606 SER CA C 606 56.028 56.028 59.258 -3.230 18986 6874 1 15 . 1 1 606 606 SER CB C 606 61.039 61.039 63.322 -2.283 18986 6875 1 15 . 1 1 606 606 SER H H 606 8.420 8.420 7.399 1.021 18986 6876 1 15 . 1 1 607 607 GLY N N 607 110.716 110.716 113.345 -2.629 18986 6877 1 15 . 1 1 607 607 GLY C C 607 171.173 171.173 174.311 -3.138 18986 6878 1 15 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.378 -1.737 18986 6879 1 15 . 1 1 607 607 GLY H H 607 8.386 8.386 8.314 0.072 18986 6880 1 15 . 1 1 608 608 LYS N N 608 120.785 120.785 118.715 2.070 18986 6881 1 15 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.138 0.201 18986 6882 1 15 . 1 1 608 608 LYS C C 608 173.673 173.673 177.324 -3.651 18986 6883 1 15 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.736 -3.371 18986 6884 1 15 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.373 -1.842 18986 6885 1 15 . 1 1 608 608 LYS H H 608 8.008 8.008 8.326 -0.318 18986 6886 1 15 . 1 1 609 609 ILE N N 609 122.404 122.404 122.904 -0.500 18986 6887 1 15 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.062 0.087 18986 6888 1 15 . 1 1 609 609 ILE C C 609 172.675 172.675 174.689 -2.014 18986 6889 1 15 . 1 1 609 609 ILE CA C 609 58.003 58.003 59.768 -1.765 18986 6890 1 15 . 1 1 609 609 ILE CB C 609 36.204 36.204 37.377 -1.173 18986 6891 1 15 . 1 1 609 609 ILE H H 609 8.186 8.186 7.752 0.434 18986 6892 1 15 . 1 1 610 610 ASP N N 610 125.357 125.357 127.486 -2.129 18986 6893 1 15 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.679 0.024 18986 6894 1 15 . 1 1 610 610 ASP C C 610 173.668 173.668 176.787 -3.119 18986 6895 1 15 . 1 1 610 610 ASP CA C 610 50.702 50.702 54.339 -3.637 18986 6896 1 15 . 1 1 610 610 ASP CB C 610 38.690 38.690 41.572 -2.882 18986 6897 1 15 . 1 1 610 610 ASP H H 610 8.369 8.369 7.858 0.511 18986 6898 1 15 . 1 1 611 611 ILE N N 611 122.494 122.494 119.598 2.896 18986 6899 1 15 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.879 0.030 18986 6900 1 15 . 1 1 611 611 ILE C C 611 173.618 173.618 177.142 -3.524 18986 6901 1 15 . 1 1 611 611 ILE CA C 611 60.040 60.040 64.866 -4.826 18986 6902 1 15 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.431 -2.633 18986 6903 1 15 . 1 1 611 611 ILE H H 611 8.284 8.284 8.485 -0.201 18986 6904 1 15 . 1 1 612 612 ASP N N 612 121.440 121.440 120.063 1.377 18986 6905 1 15 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.334 0.100 18986 6906 1 15 . 1 1 612 612 ASP C C 612 175.129 175.129 178.113 -2.984 18986 6907 1 15 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.332 -4.566 18986 6908 1 15 . 1 1 612 612 ASP CB C 612 38.138 38.138 40.436 -2.298 18986 6909 1 15 . 1 1 612 612 ASP H H 612 8.279 8.279 8.310 -0.031 18986 6910 1 15 . 1 1 613 613 THR N N 613 114.422 114.422 112.437 1.985 18986 6911 1 15 . 1 1 613 613 THR HA H 613 4.106 4.106 4.036 0.070 18986 6912 1 15 . 1 1 613 613 THR C C 613 173.338 173.338 175.521 -2.183 18986 6913 1 15 . 1 1 613 613 THR CA C 613 61.545 61.545 64.970 -3.425 18986 6914 1 15 . 1 1 613 613 THR CB C 613 66.267 66.267 68.528 -2.261 18986 6915 1 15 . 1 1 613 613 THR H H 613 7.866 7.866 8.275 -0.409 18986 6916 1 15 . 1 1 614 614 ILE N N 614 121.654 121.654 119.251 2.403 18986 6917 1 15 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.954 0.075 18986 6918 1 15 . 1 1 614 614 ILE C C 614 174.471 174.471 177.891 -3.420 18986 6919 1 15 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.953 -3.780 18986 6920 1 15 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.534 -2.719 18986 6921 1 15 . 1 1 614 614 ILE H H 614 7.819 7.819 7.240 0.579 18986 6922 1 15 . 1 1 615 615 MET N N 615 119.713 119.713 117.953 1.760 18986 6923 1 15 . 1 1 615 615 MET HA H 615 4.478 4.478 4.466 0.012 18986 6924 1 15 . 1 1 615 615 MET C C 615 174.075 174.075 178.294 -4.219 18986 6925 1 15 . 1 1 615 615 MET CA C 615 52.764 52.764 57.773 -5.010 18986 6926 1 15 . 1 1 615 615 MET CB C 615 29.337 29.337 32.156 -2.819 18986 6927 1 15 . 1 1 615 615 MET H H 615 8.188 8.188 8.343 -0.155 18986 6928 1 15 . 1 1 616 616 THR N N 616 114.770 114.770 112.177 2.593 18986 6929 1 15 . 1 1 616 616 THR HA H 616 4.099 4.099 4.226 -0.127 18986 6930 1 15 . 1 1 616 616 THR C C 616 172.535 172.535 175.452 -2.917 18986 6931 1 15 . 1 1 616 616 THR CA C 616 61.112 61.112 64.407 -3.295 18986 6932 1 15 . 1 1 616 616 THR CB C 616 66.617 66.617 69.386 -2.769 18986 6933 1 15 . 1 1 616 616 THR H H 616 7.722 7.722 8.268 -0.546 18986 6934 1 15 . 1 1 617 617 GLY N N 617 111.384 111.384 107.235 4.149 18986 6935 1 15 . 1 1 617 617 GLY C C 617 171.437 171.437 173.375 -1.938 18986 6936 1 15 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.284 -2.842 18986 6937 1 15 . 1 1 617 617 GLY H H 617 8.431 8.431 7.923 0.508 18986 6938 1 15 . 1 1 618 618 LYS N N 618 120.996 120.996 120.625 0.371 18986 6939 1 15 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.840 -0.173 18986 6940 1 15 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.987 -2.159 18986 6941 1 15 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.584 -5.107 18986 6942 1 15 . 1 1 618 618 LYS H H 618 7.821 7.821 7.933 -0.112 18986 6943 1 15 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.668 -0.199 18986 6944 1 15 . 1 1 619 619 PRO C C 619 174.453 174.453 177.736 -3.283 18986 6945 1 15 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.477 -2.285 18986 6946 1 15 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.846 -3.266 18986 6947 1 15 . 1 1 620 620 LYS N N 620 123.464 123.464 121.014 2.450 18986 6948 1 15 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.944 0.102 18986 6949 1 15 . 1 1 620 620 LYS C C 620 174.895 174.895 178.949 -4.054 18986 6950 1 15 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.142 -3.853 18986 6951 1 15 . 1 1 620 620 LYS CB C 620 30.454 30.454 32.073 -1.619 18986 6952 1 15 . 1 1 620 620 LYS H H 620 8.728 8.728 8.614 0.114 18986 6953 1 15 . 1 1 621 621 SER N N 621 113.921 113.921 114.018 -0.097 18986 6954 1 15 . 1 1 621 621 SER HA H 621 4.336 4.336 4.486 -0.150 18986 6955 1 15 . 1 1 621 621 SER C C 621 173.149 173.149 176.241 -3.092 18986 6956 1 15 . 1 1 621 621 SER CA C 621 56.691 56.691 60.560 -3.869 18986 6957 1 15 . 1 1 621 621 SER CB C 621 60.689 60.689 62.590 -1.901 18986 6958 1 15 . 1 1 621 621 SER H H 621 8.531 8.531 8.316 0.215 18986 6959 1 15 . 1 1 622 622 ALA N N 622 124.177 124.177 125.234 -1.057 18986 6960 1 15 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.957 0.211 18986 6961 1 15 . 1 1 622 622 ALA C C 622 176.804 176.804 179.034 -2.230 18986 6962 1 15 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.505 -3.137 18986 6963 1 15 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.566 -2.712 18986 6964 1 15 . 1 1 622 622 ALA H H 622 7.835 7.835 8.036 -0.201 18986 6965 1 15 . 1 1 623 623 ARG N N 623 118.263 118.263 119.081 -0.818 18986 6966 1 15 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.066 -0.116 18986 6967 1 15 . 1 1 623 623 ARG C C 623 175.683 175.683 178.125 -2.442 18986 6968 1 15 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.889 -1.726 18986 6969 1 15 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.458 -2.007 18986 6970 1 15 . 1 1 623 623 ARG H H 623 8.148 8.148 7.793 0.355 18986 6971 1 15 . 1 1 624 624 GLU N N 624 117.953 117.953 120.605 -2.652 18986 6972 1 15 . 1 1 624 624 GLU HA H 624 3.968 3.968 3.987 -0.019 18986 6973 1 15 . 1 1 624 624 GLU C C 624 177.204 177.204 178.919 -1.715 18986 6974 1 15 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.598 -2.741 18986 6975 1 15 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.392 -2.425 18986 6976 1 15 . 1 1 624 624 GLU H H 624 8.143 8.143 8.611 -0.468 18986 6977 1 15 . 1 1 625 625 LYS N N 625 119.222 119.222 118.804 0.418 18986 6978 1 15 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.148 -0.291 18986 6979 1 15 . 1 1 625 625 LYS C C 625 175.480 175.480 179.229 -3.749 18986 6980 1 15 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.954 -1.467 18986 6981 1 15 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.692 -2.029 18986 6982 1 15 . 1 1 625 625 LYS H H 625 7.772 7.772 7.831 -0.059 18986 6983 1 15 . 1 1 626 626 MET N N 626 117.883 117.883 119.552 -1.669 18986 6984 1 15 . 1 1 626 626 MET HA H 626 3.807 3.807 4.031 -0.224 18986 6985 1 15 . 1 1 626 626 MET C C 626 175.278 175.278 178.554 -3.276 18986 6986 1 15 . 1 1 626 626 MET CA C 626 57.782 57.782 59.834 -2.052 18986 6987 1 15 . 1 1 626 626 MET CB C 626 30.657 30.657 32.725 -2.068 18986 6988 1 15 . 1 1 626 626 MET H H 626 8.367 8.367 8.579 -0.212 18986 6989 1 15 . 1 1 627 627 MET N N 627 116.185 116.185 116.909 -0.724 18986 6990 1 15 . 1 1 627 627 MET HA H 627 4.152 4.152 4.292 -0.140 18986 6991 1 15 . 1 1 627 627 MET C C 627 176.393 176.393 178.053 -1.660 18986 6992 1 15 . 1 1 627 627 MET CA C 627 55.359 55.359 57.520 -2.161 18986 6993 1 15 . 1 1 627 627 MET CB C 627 28.803 28.803 31.418 -2.615 18986 6994 1 15 . 1 1 627 627 MET H H 627 8.197 8.197 8.629 -0.432 18986 6995 1 15 . 1 1 628 628 LYS N N 628 119.859 119.859 121.823 -1.964 18986 6996 1 15 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.229 -0.029 18986 6997 1 15 . 1 1 628 628 LYS C C 628 175.885 175.885 179.183 -3.298 18986 6998 1 15 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.423 -4.346 18986 6999 1 15 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.089 -3.558 18986 7000 1 15 . 1 1 628 628 LYS H H 628 7.700 7.700 7.533 0.167 18986 7001 1 15 . 1 1 629 629 ILE N N 629 119.001 119.001 119.456 -0.455 18986 7002 1 15 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.619 -0.071 18986 7003 1 15 . 1 1 629 629 ILE C C 629 174.891 174.891 178.030 -3.139 18986 7004 1 15 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.483 -3.218 18986 7005 1 15 . 1 1 629 629 ILE CB C 629 33.849 33.849 38.076 -4.227 18986 7006 1 15 . 1 1 629 629 ILE H H 629 7.970 7.970 8.186 -0.216 18986 7007 1 15 . 1 1 630 630 ILE N N 630 120.737 120.737 117.646 3.091 18986 7008 1 15 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.655 -0.188 18986 7009 1 15 . 1 1 630 630 ILE C C 630 173.875 173.875 177.703 -3.828 18986 7010 1 15 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.028 -2.274 18986 7011 1 15 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.877 -2.600 18986 7012 1 15 . 1 1 630 630 ILE H H 630 8.213 8.213 8.286 -0.073 18986 7013 1 15 . 1 1 631 631 GLU N N 631 119.546 119.546 121.324 -1.778 18986 7014 1 15 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.008 0.057 18986 7015 1 15 . 1 1 631 631 GLU C C 631 177.300 177.300 179.407 -2.107 18986 7016 1 15 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.763 -2.783 18986 7017 1 15 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.444 -2.451 18986 7018 1 15 . 1 1 631 631 GLU H H 631 7.742 7.742 8.283 -0.541 18986 7019 1 15 . 1 1 632 632 ILE N N 632 121.547 121.547 121.561 -0.014 18986 7020 1 15 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.786 -0.103 18986 7021 1 15 . 1 1 632 632 ILE C C 632 175.454 175.454 178.387 -2.933 18986 7022 1 15 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.614 -2.958 18986 7023 1 15 . 1 1 632 632 ILE CB C 632 35.830 35.830 38.054 -2.224 18986 7024 1 15 . 1 1 632 632 ILE H H 632 8.013 8.013 7.962 0.051 18986 7025 1 15 . 1 1 633 633 ILE N N 633 121.605 121.605 120.983 0.622 18986 7026 1 15 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.517 -0.182 18986 7027 1 15 . 1 1 633 633 ILE C C 633 174.558 174.558 178.070 -3.512 18986 7028 1 15 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.942 -2.022 18986 7029 1 15 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.269 -1.985 18986 7030 1 15 . 1 1 633 633 ILE H H 633 8.594 8.594 8.256 0.338 18986 7031 1 15 . 1 1 634 634 ASP N N 634 118.706 118.706 120.270 -1.564 18986 7032 1 15 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.389 0.046 18986 7033 1 15 . 1 1 634 634 ASP C C 634 176.574 176.574 178.710 -2.136 18986 7034 1 15 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.732 -3.161 18986 7035 1 15 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.803 -2.889 18986 7036 1 15 . 1 1 634 634 ASP H H 634 8.724 8.724 8.626 0.098 18986 7037 1 15 . 1 1 635 635 SER N N 635 114.064 114.064 115.213 -1.149 18986 7038 1 15 . 1 1 635 635 SER HA H 635 4.232 4.232 4.260 -0.028 18986 7039 1 15 . 1 1 635 635 SER C C 635 174.487 174.487 176.149 -1.662 18986 7040 1 15 . 1 1 635 635 SER CA C 635 58.540 58.540 61.558 -3.018 18986 7041 1 15 . 1 1 635 635 SER CB C 635 60.319 60.319 63.011 -2.692 18986 7042 1 15 . 1 1 635 635 SER H H 635 7.992 7.992 8.247 -0.255 18986 7043 1 15 . 1 1 636 636 LEU N N 636 122.493 122.493 121.578 0.915 18986 7044 1 15 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.273 -0.019 18986 7045 1 15 . 1 1 636 636 LEU C C 636 176.194 176.194 179.068 -2.874 18986 7046 1 15 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.102 -3.007 18986 7047 1 15 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.125 -2.419 18986 7048 1 15 . 1 1 636 636 LEU H H 636 8.169 8.169 7.929 0.240 18986 7049 1 15 . 1 1 637 637 ALA N N 637 121.891 121.891 122.661 -0.770 18986 7050 1 15 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.232 -0.143 18986 7051 1 15 . 1 1 637 637 ALA C C 637 175.131 175.131 180.340 -5.209 18986 7052 1 15 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.611 -4.275 18986 7053 1 15 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.320 -2.832 18986 7054 1 15 . 1 1 637 637 ALA H H 637 8.482 8.482 8.521 -0.039 18986 7055 1 15 . 1 1 638 638 VAL N N 638 117.140 117.140 117.103 0.037 18986 7056 1 15 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.812 0.123 18986 7057 1 15 . 1 1 638 638 VAL C C 638 174.712 174.712 176.324 -1.612 18986 7058 1 15 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.350 -2.349 18986 7059 1 15 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.011 -2.660 18986 7060 1 15 . 1 1 638 638 VAL H H 638 7.291 7.291 8.600 -1.309 18986 7061 1 15 . 1 1 639 639 SER N N 639 114.143 114.143 114.432 -0.289 18986 7062 1 15 . 1 1 639 639 SER HA H 639 4.481 4.481 4.730 -0.249 18986 7063 1 15 . 1 1 639 639 SER C C 639 172.122 172.122 172.953 -0.831 18986 7064 1 15 . 1 1 639 639 SER CA C 639 56.002 56.002 58.415 -2.413 18986 7065 1 15 . 1 1 639 639 SER CB C 639 60.921 60.921 64.225 -3.304 18986 7066 1 15 . 1 1 639 639 SER H H 639 7.918 7.918 8.048 -0.130 18986 7067 1 15 . 1 1 640 640 SER N N 640 115.370 115.370 115.669 -0.299 18986 7068 1 15 . 1 1 640 640 SER HA H 640 4.711 4.711 4.686 0.025 18986 7069 1 15 . 1 1 640 640 SER C C 640 171.185 171.185 174.160 -2.975 18986 7070 1 15 . 1 1 640 640 SER CA C 640 55.009 55.009 56.880 -1.871 18986 7071 1 15 . 1 1 640 640 SER CB C 640 61.974 61.974 64.189 -2.215 18986 7072 1 15 . 1 1 640 640 SER H H 640 7.765 7.765 7.713 0.052 18986 7073 1 15 . 1 1 641 641 GLU N N 641 119.994 119.994 121.016 -1.022 18986 7074 1 15 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.219 -0.175 18986 7075 1 15 . 1 1 641 641 GLU C C 641 173.167 173.167 175.739 -2.572 18986 7076 1 15 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.246 -1.595 18986 7077 1 15 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.845 -2.361 18986 7078 1 15 . 1 1 641 641 GLU H H 641 8.363 8.363 8.796 -0.433 18986 7079 1 15 . 1 1 642 642 CYS N N 642 110.257 110.257 112.927 -2.670 18986 7080 1 15 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.664 -0.205 18986 7081 1 15 . 1 1 642 642 CYS C C 642 168.058 168.058 172.937 -4.879 18986 7082 1 15 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.931 -5.985 18986 7083 1 15 . 1 1 642 642 CYS CB C 642 41.361 41.361 30.527 10.834 18986 7084 1 15 . 1 1 642 642 CYS H H 642 7.881 7.881 7.648 0.233 18986 7085 1 15 . 1 1 643 643 ALA N N 643 123.922 123.922 123.518 0.404 18986 7086 1 15 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.568 0.070 18986 7087 1 15 . 1 1 643 643 ALA C C 643 172.517 172.517 176.369 -3.852 18986 7088 1 15 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.170 -3.550 18986 7089 1 15 . 1 1 643 643 ALA CB C 643 19.444 19.444 20.063 -0.619 18986 7090 1 15 . 1 1 643 643 ALA H H 643 9.787 9.787 9.136 0.651 18986 7091 1 15 . 1 1 644 644 LYS N N 644 128.479 128.479 124.117 4.362 18986 7092 1 15 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.395 0.116 18986 7093 1 15 . 1 1 644 644 LYS C C 644 176.945 176.945 177.862 -0.917 18986 7094 1 15 . 1 1 644 644 LYS CA C 644 54.338 54.338 55.684 -1.345 18986 7095 1 15 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.796 -2.854 18986 7096 1 15 . 1 1 644 644 LYS H H 644 9.809 9.809 8.850 0.959 18986 7097 1 15 . 1 1 645 645 VAL N N 645 124.257 124.257 124.743 -0.486 18986 7098 1 15 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.606 0.042 18986 7099 1 15 . 1 1 645 645 VAL C C 645 173.996 173.996 177.399 -3.403 18986 7100 1 15 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.878 -2.016 18986 7101 1 15 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.569 -2.368 18986 7102 1 15 . 1 1 645 645 VAL H H 645 8.458 8.458 8.885 -0.427 18986 7103 1 15 . 1 1 646 646 LYS N N 646 117.598 117.598 120.091 -2.493 18986 7104 1 15 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.970 0.037 18986 7105 1 15 . 1 1 646 646 LYS C C 646 176.047 176.047 178.465 -2.418 18986 7106 1 15 . 1 1 646 646 LYS CA C 646 57.245 57.245 59.316 -2.071 18986 7107 1 15 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.569 -2.171 18986 7108 1 15 . 1 1 646 646 LYS H H 646 8.706 8.706 8.112 0.594 18986 7109 1 15 . 1 1 647 647 ASP N N 647 119.229 119.229 120.098 -0.869 18986 7110 1 15 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.406 0.212 18986 7111 1 15 . 1 1 647 647 ASP C C 647 175.211 175.211 178.761 -3.550 18986 7112 1 15 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.388 -3.065 18986 7113 1 15 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.613 -1.875 18986 7114 1 15 . 1 1 647 647 ASP H H 647 7.012 7.012 7.821 -0.809 18986 7115 1 15 . 1 1 648 648 ILE N N 648 121.939 121.939 120.534 1.405 18986 7116 1 15 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.639 -0.258 18986 7117 1 15 . 1 1 648 648 ILE C C 648 175.243 175.243 177.988 -2.745 18986 7118 1 15 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.378 -2.337 18986 7119 1 15 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.766 -1.804 18986 7120 1 15 . 1 1 648 648 ILE H H 648 8.152 8.152 7.476 0.676 18986 7121 1 15 . 1 1 649 649 LEU N N 649 117.310 117.310 120.954 -3.644 18986 7122 1 15 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.786 0.087 18986 7123 1 15 . 1 1 649 649 LEU C C 649 176.439 176.439 178.842 -2.403 18986 7124 1 15 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.750 -2.865 18986 7125 1 15 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.387 -2.081 18986 7126 1 15 . 1 1 649 649 LEU H H 649 8.638 8.638 8.734 -0.096 18986 7127 1 15 . 1 1 650 650 LYS N N 650 118.810 118.810 119.251 -0.441 18986 7128 1 15 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.866 0.180 18986 7129 1 15 . 1 1 650 650 LYS C C 650 176.801 176.801 178.934 -2.133 18986 7130 1 15 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.770 -2.719 18986 7131 1 15 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.186 -2.122 18986 7132 1 15 . 1 1 650 650 LYS H H 650 7.296 7.296 7.886 -0.590 18986 7133 1 15 . 1 1 651 651 GLU N N 651 117.713 117.713 118.630 -0.917 18986 7134 1 15 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.046 0.062 18986 7135 1 15 . 1 1 651 651 GLU C C 651 176.903 176.903 179.053 -2.150 18986 7136 1 15 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.194 -3.384 18986 7137 1 15 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.519 -2.071 18986 7138 1 15 . 1 1 651 651 GLU H H 651 8.036 8.036 8.101 -0.065 18986 7139 1 15 . 1 1 652 652 ALA N N 652 121.206 121.206 121.815 -0.609 18986 7140 1 15 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.082 -0.084 18986 7141 1 15 . 1 1 652 652 ALA C C 652 176.766 176.766 179.556 -2.790 18986 7142 1 15 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.419 -3.685 18986 7143 1 15 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.478 -3.162 18986 7144 1 15 . 1 1 652 652 ALA H H 652 8.973 8.973 8.411 0.562 18986 7145 1 15 . 1 1 653 653 GLN N N 653 117.768 117.768 117.447 0.321 18986 7146 1 15 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.357 0.120 18986 7147 1 15 . 1 1 653 653 GLN C C 653 177.388 177.388 178.490 -1.102 18986 7148 1 15 . 1 1 653 653 GLN CA C 653 56.060 56.060 57.741 -1.681 18986 7149 1 15 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.043 -1.274 18986 7150 1 15 . 1 1 653 653 GLN H H 653 8.059 8.059 8.337 -0.278 18986 7151 1 15 . 1 1 654 654 GLN N N 654 117.979 117.979 119.155 -1.176 18986 7152 1 15 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.104 0.073 18986 7153 1 15 . 1 1 654 654 GLN C C 654 174.834 174.834 177.836 -3.002 18986 7154 1 15 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.073 -2.655 18986 7155 1 15 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.953 -2.976 18986 7156 1 15 . 1 1 654 654 GLN H H 654 7.495 7.495 7.920 -0.425 18986 7157 1 15 . 1 1 655 655 VAL N N 655 110.080 110.080 117.446 -7.366 18986 7158 1 15 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.916 0.611 18986 7159 1 15 . 1 1 655 655 VAL C C 655 173.369 173.369 176.080 -2.711 18986 7160 1 15 . 1 1 655 655 VAL CA C 655 58.067 58.067 63.263 -5.196 18986 7161 1 15 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.816 -4.632 18986 7162 1 15 . 1 1 655 655 VAL H H 655 7.197 7.197 7.667 -0.470 18986 7163 1 15 . 1 1 656 656 GLY N N 656 107.089 107.089 108.404 -1.315 18986 7164 1 15 . 1 1 656 656 GLY C C 656 171.639 171.639 172.778 -1.139 18986 7165 1 15 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.784 -1.473 18986 7166 1 15 . 1 1 656 656 GLY H H 656 7.541 7.541 7.969 -0.428 18986 7167 1 15 . 1 1 657 657 ILE N N 657 121.266 121.266 118.779 2.487 18986 7168 1 15 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.448 -0.314 18986 7169 1 15 . 1 1 657 657 ILE C C 657 171.885 171.885 174.933 -3.048 18986 7170 1 15 . 1 1 657 657 ILE CA C 657 58.230 58.230 58.559 -0.329 18986 7171 1 15 . 1 1 657 657 ILE CB C 657 35.191 35.191 41.012 -5.821 18986 7172 1 15 . 1 1 657 657 ILE H H 657 7.633 7.633 7.534 0.099 18986 7173 1 15 . 1 1 658 658 GLU N N 658 127.252 127.252 124.732 2.520 18986 7174 1 15 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.246 -0.043 18986 7175 1 15 . 1 1 658 658 GLU C C 658 175.316 175.316 177.141 -1.825 18986 7176 1 15 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.860 -2.500 18986 7177 1 15 . 1 1 658 658 GLU CB C 658 27.610 27.610 30.601 -2.991 18986 7178 1 15 . 1 1 658 658 GLU H H 658 8.690 8.690 8.815 -0.125 18986 7179 1 15 . 1 1 659 659 LYS N N 659 124.533 124.533 127.473 -2.940 18986 7180 1 15 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.964 -0.176 18986 7181 1 15 . 1 1 659 659 LYS C C 659 175.170 175.170 178.506 -3.336 18986 7182 1 15 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.408 -1.237 18986 7183 1 15 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.436 -1.319 18986 7184 1 15 . 1 1 659 659 LYS H H 659 8.706 8.706 8.914 -0.208 18986 7185 1 15 . 1 1 660 660 SER N N 660 113.137 113.137 114.383 -1.246 18986 7186 1 15 . 1 1 660 660 SER HA H 660 4.273 4.273 4.414 -0.141 18986 7187 1 15 . 1 1 660 660 SER C C 660 173.939 173.939 176.273 -2.334 18986 7188 1 15 . 1 1 660 660 SER CA C 660 58.350 58.350 60.348 -1.998 18986 7189 1 15 . 1 1 660 660 SER CB C 660 59.504 59.504 62.359 -2.855 18986 7190 1 15 . 1 1 660 660 SER H H 660 8.777 8.777 8.255 0.522 18986 7191 1 15 . 1 1 661 661 ASN N N 661 119.986 119.986 120.672 -0.686 18986 7192 1 15 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.461 0.245 18986 7193 1 15 . 1 1 661 661 ASN C C 661 174.516 174.516 177.349 -2.833 18986 7194 1 15 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.370 -4.322 18986 7195 1 15 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.593 -1.851 18986 7196 1 15 . 1 1 661 661 ASN H H 661 7.486 7.486 8.207 -0.721 18986 7197 1 15 . 1 1 662 662 ILE N N 662 120.639 120.639 119.929 0.710 18986 7198 1 15 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.718 -0.272 18986 7199 1 15 . 1 1 662 662 ILE C C 662 174.252 174.252 177.478 -3.226 18986 7200 1 15 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.024 -2.418 18986 7201 1 15 . 1 1 662 662 ILE CB C 662 34.423 34.423 38.009 -3.586 18986 7202 1 15 . 1 1 662 662 ILE H H 662 7.999 7.999 7.941 0.058 18986 7203 1 15 . 1 1 663 663 GLU N N 663 117.706 117.706 120.484 -2.778 18986 7204 1 15 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.892 -0.102 18986 7205 1 15 . 1 1 663 663 GLU C C 663 176.509 176.509 179.017 -2.508 18986 7206 1 15 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.332 -2.624 18986 7207 1 15 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.313 -2.558 18986 7208 1 15 . 1 1 663 663 GLU H H 663 8.190 8.190 8.156 0.034 18986 7209 1 15 . 1 1 664 664 LYS N N 664 119.586 119.586 119.384 0.202 18986 7210 1 15 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.079 -0.026 18986 7211 1 15 . 1 1 664 664 LYS C C 664 175.941 175.941 178.824 -2.883 18986 7212 1 15 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.570 -2.989 18986 7213 1 15 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.288 -2.465 18986 7214 1 15 . 1 1 664 664 LYS H H 664 7.590 7.590 8.441 -0.851 18986 7215 1 15 . 1 1 665 665 LEU N N 665 119.756 119.756 121.663 -1.907 18986 7216 1 15 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.060 0.020 18986 7217 1 15 . 1 1 665 665 LEU C C 665 176.700 176.700 178.831 -2.131 18986 7218 1 15 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.433 -3.048 18986 7219 1 15 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.517 -2.325 18986 7220 1 15 . 1 1 665 665 LEU H H 665 8.075 8.075 8.291 -0.216 18986 7221 1 15 . 1 1 666 666 LEU N N 666 118.788 118.788 118.501 0.287 18986 7222 1 15 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.789 -0.025 18986 7223 1 15 . 1 1 666 666 LEU C C 666 176.484 176.484 179.217 -2.733 18986 7224 1 15 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.091 -2.433 18986 7225 1 15 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.489 -1.877 18986 7226 1 15 . 1 1 666 666 LEU H H 666 8.550 8.550 8.491 0.059 18986 7227 1 15 . 1 1 667 667 THR N N 667 115.244 115.244 115.975 -0.731 18986 7228 1 15 . 1 1 667 667 THR HA H 667 3.839 3.839 3.958 -0.119 18986 7229 1 15 . 1 1 667 667 THR C C 667 173.740 173.740 176.234 -2.494 18986 7230 1 15 . 1 1 667 667 THR CA C 667 64.378 64.378 67.254 -2.876 18986 7231 1 15 . 1 1 667 667 THR CB C 667 65.748 65.748 68.280 -2.532 18986 7232 1 15 . 1 1 667 667 THR H H 667 7.662 7.662 8.133 -0.471 18986 7233 1 15 . 1 1 668 668 ASP N N 668 122.862 122.862 122.941 -0.079 18986 7234 1 15 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.320 0.063 18986 7235 1 15 . 1 1 668 668 ASP C C 668 177.192 177.192 178.231 -1.039 18986 7236 1 15 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.041 -1.910 18986 7237 1 15 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.706 -2.820 18986 7238 1 15 . 1 1 668 668 ASP H H 668 8.291 8.291 8.038 0.253 18986 7239 1 15 . 1 1 669 669 MET N N 669 119.640 119.640 117.496 2.144 18986 7240 1 15 . 1 1 669 669 MET HA H 669 3.917 3.917 3.998 -0.081 18986 7241 1 15 . 1 1 669 669 MET C C 669 175.414 175.414 178.459 -3.045 18986 7242 1 15 . 1 1 669 669 MET CA C 669 57.234 57.234 59.090 -1.856 18986 7243 1 15 . 1 1 669 669 MET CB C 669 32.088 32.088 32.056 0.033 18986 7244 1 15 . 1 1 669 669 MET H H 669 8.809 8.809 8.427 0.382 18986 7245 1 15 . 1 1 670 670 ARG N N 670 122.614 122.614 118.851 3.763 18986 7246 1 15 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.511 0.006 18986 7247 1 15 . 1 1 670 670 ARG C C 670 177.928 177.928 178.635 -0.707 18986 7248 1 15 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.202 -1.980 18986 7249 1 15 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.701 -2.397 18986 7250 1 15 . 1 1 670 670 ARG H H 670 8.450 8.450 8.037 0.413 18986 7251 1 15 . 1 1 671 671 LYS N N 671 121.976 121.976 120.422 1.554 18986 7252 1 15 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.203 -0.090 18986 7253 1 15 . 1 1 671 671 LYS C C 671 176.143 176.143 178.270 -2.127 18986 7254 1 15 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.548 -1.462 18986 7255 1 15 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.615 -3.111 18986 7256 1 15 . 1 1 671 671 LYS H H 671 8.609 8.609 7.923 0.686 18986 7257 1 15 . 1 1 672 672 SER N N 672 111.655 111.655 112.465 -0.810 18986 7258 1 15 . 1 1 672 672 SER HA H 672 4.469 4.469 4.443 0.026 18986 7259 1 15 . 1 1 672 672 SER C C 672 171.692 171.692 174.987 -3.295 18986 7260 1 15 . 1 1 672 672 SER CA C 672 56.790 56.790 59.541 -2.752 18986 7261 1 15 . 1 1 672 672 SER CB C 672 61.343 61.343 64.265 -2.922 18986 7262 1 15 . 1 1 672 672 SER H H 672 7.884 7.884 8.454 -0.570 18986 7263 1 15 . 1 1 673 673 GLY N N 673 108.029 108.029 108.146 -0.117 18986 7264 1 15 . 1 1 673 673 GLY C C 673 171.492 171.492 175.302 -3.810 18986 7265 1 15 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.490 -2.215 18986 7266 1 15 . 1 1 673 673 GLY H H 673 7.774 7.774 8.027 -0.253 18986 7267 1 15 . 1 1 674 674 ILE N N 674 116.193 116.193 120.774 -4.581 18986 7268 1 15 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.049 0.052 18986 7269 1 15 . 1 1 674 674 ILE C C 674 173.980 173.980 175.988 -2.008 18986 7270 1 15 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.536 -3.294 18986 7271 1 15 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.679 -1.875 18986 7272 1 15 . 1 1 674 674 ILE H H 674 8.026 8.026 8.317 -0.291 18986 7273 1 15 . 1 1 675 675 ILE N N 675 108.928 108.928 113.498 -4.570 18986 7274 1 15 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.917 0.441 18986 7275 1 15 . 1 1 675 675 ILE C C 675 170.797 170.797 174.056 -3.259 18986 7276 1 15 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.672 -2.647 18986 7277 1 15 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.981 -2.495 18986 7278 1 15 . 1 1 675 675 ILE H H 675 7.120 7.120 7.489 -0.369 18986 7279 1 15 . 1 1 676 676 TYR N N 676 118.062 118.062 116.549 1.513 18986 7280 1 15 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.199 -0.204 18986 7281 1 15 . 1 1 676 676 TYR C C 676 170.020 170.020 174.099 -4.079 18986 7282 1 15 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.065 -3.172 18986 7283 1 15 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.664 -3.148 18986 7284 1 15 . 1 1 676 676 TYR H H 676 9.380 9.380 8.737 0.643 18986 7285 1 15 . 1 1 677 677 GLU N N 677 123.578 123.578 124.103 -0.525 18986 7286 1 15 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.388 -0.562 18986 7287 1 15 . 1 1 677 677 GLU C C 677 172.146 172.146 175.905 -3.759 18986 7288 1 15 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.408 -2.932 18986 7289 1 15 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.383 -1.771 18986 7290 1 15 . 1 1 677 677 GLU H H 677 8.951 8.951 8.971 -0.020 18986 7291 1 15 . 1 1 678 678 ALA N N 678 133.220 133.220 126.782 6.438 18986 7292 1 15 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.301 -0.260 18986 7293 1 15 . 1 1 678 678 ALA C C 678 175.219 175.219 177.204 -1.985 18986 7294 1 15 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.675 -2.074 18986 7295 1 15 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.395 -2.796 18986 7296 1 15 . 1 1 678 678 ALA H H 678 7.912 7.912 8.164 -0.252 18986 7297 1 15 . 1 1 679 679 LYS N N 679 115.687 115.687 115.931 -0.244 18986 7298 1 15 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.721 -0.286 18986 7299 1 15 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.949 -1.933 18986 7300 1 15 . 1 1 679 679 LYS CB C 679 30.995 30.995 35.105 -4.110 18986 7301 1 15 . 1 1 679 679 LYS H H 679 8.215 8.215 7.427 0.788 18986 7302 1 15 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.206 -0.187 18986 7303 1 15 . 1 1 680 680 PRO C C 680 174.504 174.504 177.440 -2.936 18986 7304 1 15 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.662 -1.144 18986 7305 1 15 . 1 1 680 680 PRO CB C 680 28.315 28.315 32.150 -3.835 18986 7306 1 15 . 1 1 681 681 GLU N N 681 118.851 118.851 117.576 1.275 18986 7307 1 15 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.734 -0.296 18986 7308 1 15 . 1 1 681 681 GLU C C 681 172.890 172.890 174.699 -1.809 18986 7309 1 15 . 1 1 681 681 GLU CA C 681 54.481 54.481 57.849 -3.368 18986 7310 1 15 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.212 -4.423 18986 7311 1 15 . 1 1 681 681 GLU H H 681 10.003 10.003 8.762 1.241 18986 7312 1 15 . 1 1 682 682 CYS N N 682 120.934 120.934 114.411 6.523 18986 7313 1 15 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.148 -0.121 18986 7314 1 15 . 1 1 682 682 CYS C C 682 171.905 171.905 173.115 -1.210 18986 7315 1 15 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.492 -3.248 18986 7316 1 15 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.704 13.591 18986 7317 1 15 . 1 1 682 682 CYS H H 682 7.860 7.860 7.445 0.415 18986 7318 1 15 . 1 1 683 683 TYR N N 683 126.183 126.183 117.186 8.997 18986 7319 1 15 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.023 0.201 18986 7320 1 15 . 1 1 683 683 TYR C C 683 173.008 173.008 173.918 -0.910 18986 7321 1 15 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.074 -0.506 18986 7322 1 15 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.238 -2.286 18986 7323 1 15 . 1 1 683 683 TYR H H 683 9.297 9.297 9.359 -0.062 18986 7324 1 15 . 1 1 684 684 LYS N N 684 118.604 118.604 118.829 -0.225 18986 7325 1 15 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.607 -0.170 18986 7326 1 15 . 1 1 684 684 LYS C C 684 171.628 171.628 174.510 -2.882 18986 7327 1 15 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.064 -0.761 18986 7328 1 15 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.373 -1.696 18986 7329 1 15 . 1 1 684 684 LYS H H 684 8.630 8.630 8.771 -0.141 18986 7330 1 15 . 1 1 685 685 LYS N N 685 122.869 122.869 125.416 -2.547 18986 7331 1 15 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.123 0.521 18986 7332 1 15 . 1 1 685 685 LYS C C 685 173.337 173.337 177.105 -3.768 18986 7333 1 15 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.717 -2.464 18986 7334 1 15 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.209 -1.282 18986 7335 1 15 . 1 1 685 685 LYS H H 685 8.969 8.969 8.483 0.486 18986 7336 1 16 . 1 1 601 601 SER HA H 601 4.475 4.475 4.689 -0.214 18986 7337 1 16 . 1 1 601 601 SER CA C 601 55.508 55.508 57.904 -2.396 18986 7338 1 16 . 1 1 601 601 SER CB C 601 61.220 61.220 65.145 -3.925 18986 7339 1 16 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.860 -0.244 18986 7340 1 16 . 1 1 602 602 HIS C C 602 172.320 172.320 174.196 -1.876 18986 7341 1 16 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.901 -2.046 18986 7342 1 16 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.307 -2.224 18986 7343 1 16 . 1 1 603 603 MET N N 603 121.862 121.862 123.139 -1.277 18986 7344 1 16 . 1 1 603 603 MET HA H 603 4.425 4.425 4.641 -0.216 18986 7345 1 16 . 1 1 603 603 MET C C 603 173.948 173.948 175.493 -1.545 18986 7346 1 16 . 1 1 603 603 MET CA C 603 53.108 53.108 55.261 -2.153 18986 7347 1 16 . 1 1 603 603 MET CB C 603 30.049 30.049 33.206 -3.158 18986 7348 1 16 . 1 1 603 603 MET H H 603 8.394 8.394 8.383 0.011 18986 7349 1 16 . 1 1 604 604 GLY N N 604 110.382 110.382 107.801 2.581 18986 7350 1 16 . 1 1 604 604 GLY C C 604 171.590 171.590 174.622 -3.032 18986 7351 1 16 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.276 -2.659 18986 7352 1 16 . 1 1 604 604 GLY H H 604 8.411 8.411 8.405 0.006 18986 7353 1 16 . 1 1 605 605 GLU N N 605 120.709 120.709 119.562 1.147 18986 7354 1 16 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.168 0.139 18986 7355 1 16 . 1 1 605 605 GLU C C 605 174.220 174.220 175.821 -1.601 18986 7356 1 16 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.309 -2.343 18986 7357 1 16 . 1 1 605 605 GLU CB C 605 27.611 27.611 29.425 -1.814 18986 7358 1 16 . 1 1 605 605 GLU H H 605 8.282 8.282 8.532 -0.250 18986 7359 1 16 . 1 1 606 606 SER N N 606 116.679 116.679 112.984 3.695 18986 7360 1 16 . 1 1 606 606 SER HA H 606 4.405 4.405 4.680 -0.275 18986 7361 1 16 . 1 1 606 606 SER C C 606 172.455 172.455 174.844 -2.389 18986 7362 1 16 . 1 1 606 606 SER CA C 606 56.028 56.028 57.887 -1.859 18986 7363 1 16 . 1 1 606 606 SER CB C 606 61.039 61.039 64.042 -3.003 18986 7364 1 16 . 1 1 606 606 SER H H 606 8.420 8.420 7.968 0.452 18986 7365 1 16 . 1 1 607 607 GLY N N 607 110.716 110.716 108.812 1.904 18986 7366 1 16 . 1 1 607 607 GLY C C 607 171.173 171.173 172.856 -1.683 18986 7367 1 16 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.886 -2.244 18986 7368 1 16 . 1 1 607 607 GLY H H 607 8.386 8.386 8.343 0.043 18986 7369 1 16 . 1 1 608 608 LYS N N 608 120.785 120.785 121.031 -0.246 18986 7370 1 16 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.007 0.332 18986 7371 1 16 . 1 1 608 608 LYS C C 608 173.673 173.673 175.201 -1.528 18986 7372 1 16 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.675 -3.310 18986 7373 1 16 . 1 1 608 608 LYS CB C 608 30.531 30.531 30.617 -0.086 18986 7374 1 16 . 1 1 608 608 LYS H H 608 8.008 8.008 8.248 -0.240 18986 7375 1 16 . 1 1 609 609 ILE N N 609 122.404 122.404 120.571 1.833 18986 7376 1 16 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.074 0.075 18986 7377 1 16 . 1 1 609 609 ILE C C 609 172.675 172.675 175.568 -2.893 18986 7378 1 16 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.544 -2.542 18986 7379 1 16 . 1 1 609 609 ILE CB C 609 36.204 36.204 37.221 -1.017 18986 7380 1 16 . 1 1 609 609 ILE H H 609 8.186 8.186 8.262 -0.076 18986 7381 1 16 . 1 1 610 610 ASP N N 610 125.357 125.357 128.102 -2.745 18986 7382 1 16 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.874 -0.171 18986 7383 1 16 . 1 1 610 610 ASP C C 610 173.668 173.668 175.776 -2.108 18986 7384 1 16 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.361 -2.659 18986 7385 1 16 . 1 1 610 610 ASP CB C 610 38.690 38.690 44.006 -5.316 18986 7386 1 16 . 1 1 610 610 ASP H H 610 8.369 8.369 8.212 0.157 18986 7387 1 16 . 1 1 611 611 ILE N N 611 122.494 122.494 120.012 2.482 18986 7388 1 16 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.276 -0.367 18986 7389 1 16 . 1 1 611 611 ILE C C 611 173.618 173.618 177.183 -3.565 18986 7390 1 16 . 1 1 611 611 ILE CA C 611 60.040 60.040 61.946 -1.906 18986 7391 1 16 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.936 -3.138 18986 7392 1 16 . 1 1 611 611 ILE H H 611 8.284 8.284 8.052 0.232 18986 7393 1 16 . 1 1 612 612 ASP N N 612 121.440 121.440 120.789 0.651 18986 7394 1 16 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.324 0.110 18986 7395 1 16 . 1 1 612 612 ASP C C 612 175.129 175.129 178.409 -3.280 18986 7396 1 16 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.840 -4.074 18986 7397 1 16 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.443 -1.305 18986 7398 1 16 . 1 1 612 612 ASP H H 612 8.279 8.279 8.746 -0.467 18986 7399 1 16 . 1 1 613 613 THR N N 613 114.422 114.422 112.803 1.619 18986 7400 1 16 . 1 1 613 613 THR HA H 613 4.106 4.106 4.093 0.013 18986 7401 1 16 . 1 1 613 613 THR C C 613 173.338 173.338 175.681 -2.343 18986 7402 1 16 . 1 1 613 613 THR CA C 613 61.545 61.545 64.521 -2.976 18986 7403 1 16 . 1 1 613 613 THR CB C 613 66.267 66.267 68.653 -2.386 18986 7404 1 16 . 1 1 613 613 THR H H 613 7.866 7.866 8.157 -0.291 18986 7405 1 16 . 1 1 614 614 ILE N N 614 121.654 121.654 119.527 2.127 18986 7406 1 16 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.936 0.093 18986 7407 1 16 . 1 1 614 614 ILE C C 614 174.471 174.471 178.290 -3.819 18986 7408 1 16 . 1 1 614 614 ILE CA C 614 60.173 60.173 62.899 -2.726 18986 7409 1 16 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.767 -1.952 18986 7410 1 16 . 1 1 614 614 ILE H H 614 7.819 7.819 7.300 0.519 18986 7411 1 16 . 1 1 615 615 MET N N 615 119.713 119.713 118.152 1.561 18986 7412 1 16 . 1 1 615 615 MET HA H 615 4.478 4.478 4.492 -0.014 18986 7413 1 16 . 1 1 615 615 MET C C 615 174.075 174.075 177.891 -3.816 18986 7414 1 16 . 1 1 615 615 MET CA C 615 52.764 52.764 57.931 -5.167 18986 7415 1 16 . 1 1 615 615 MET CB C 615 29.337 29.337 31.767 -2.430 18986 7416 1 16 . 1 1 615 615 MET H H 615 8.188 8.188 8.520 -0.332 18986 7417 1 16 . 1 1 616 616 THR N N 616 114.770 114.770 113.963 0.807 18986 7418 1 16 . 1 1 616 616 THR HA H 616 4.099 4.099 4.177 -0.078 18986 7419 1 16 . 1 1 616 616 THR C C 616 172.535 172.535 176.044 -3.509 18986 7420 1 16 . 1 1 616 616 THR CA C 616 61.112 61.112 65.117 -4.005 18986 7421 1 16 . 1 1 616 616 THR CB C 616 66.617 66.617 68.901 -2.284 18986 7422 1 16 . 1 1 616 616 THR H H 616 7.722 7.722 8.229 -0.507 18986 7423 1 16 . 1 1 617 617 GLY N N 617 111.384 111.384 107.445 3.939 18986 7424 1 16 . 1 1 617 617 GLY C C 617 171.437 171.437 173.865 -2.428 18986 7425 1 16 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.120 -2.678 18986 7426 1 16 . 1 1 617 617 GLY H H 617 8.431 8.431 7.784 0.647 18986 7427 1 16 . 1 1 618 618 LYS N N 618 120.996 120.996 121.299 -0.303 18986 7428 1 16 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.865 -0.198 18986 7429 1 16 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.541 -1.713 18986 7430 1 16 . 1 1 618 618 LYS CB C 618 29.477 29.477 32.487 -3.010 18986 7431 1 16 . 1 1 618 618 LYS H H 618 7.821 7.821 7.753 0.068 18986 7432 1 16 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.107 0.362 18986 7433 1 16 . 1 1 619 619 PRO C C 619 174.453 174.453 177.313 -2.860 18986 7434 1 16 . 1 1 619 619 PRO CA C 619 60.192 60.192 65.507 -5.314 18986 7435 1 16 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.264 -2.684 18986 7436 1 16 . 1 1 620 620 LYS N N 620 123.464 123.464 117.327 6.137 18986 7437 1 16 . 1 1 620 620 LYS HA H 620 4.046 4.046 4.372 -0.326 18986 7438 1 16 . 1 1 620 620 LYS C C 620 174.895 174.895 178.385 -3.490 18986 7439 1 16 . 1 1 620 620 LYS CA C 620 56.289 56.289 56.017 0.272 18986 7440 1 16 . 1 1 620 620 LYS CB C 620 30.454 30.454 33.407 -2.953 18986 7441 1 16 . 1 1 620 620 LYS H H 620 8.728 8.728 7.737 0.991 18986 7442 1 16 . 1 1 621 621 SER N N 621 113.921 113.921 115.382 -1.461 18986 7443 1 16 . 1 1 621 621 SER HA H 621 4.336 4.336 4.106 0.230 18986 7444 1 16 . 1 1 621 621 SER C C 621 173.149 173.149 176.282 -3.133 18986 7445 1 16 . 1 1 621 621 SER CA C 621 56.691 56.691 60.915 -4.224 18986 7446 1 16 . 1 1 621 621 SER CB C 621 60.689 60.689 62.443 -1.754 18986 7447 1 16 . 1 1 621 621 SER H H 621 8.531 8.531 8.679 -0.148 18986 7448 1 16 . 1 1 622 622 ALA N N 622 124.177 124.177 126.882 -2.705 18986 7449 1 16 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.996 0.172 18986 7450 1 16 . 1 1 622 622 ALA C C 622 176.804 176.804 179.327 -2.523 18986 7451 1 16 . 1 1 622 622 ALA CA C 622 52.368 52.368 54.835 -2.467 18986 7452 1 16 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.044 -2.190 18986 7453 1 16 . 1 1 622 622 ALA H H 622 7.835 7.835 8.182 -0.347 18986 7454 1 16 . 1 1 623 623 ARG N N 623 118.263 118.263 118.792 -0.529 18986 7455 1 16 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.011 -0.061 18986 7456 1 16 . 1 1 623 623 ARG C C 623 175.683 175.683 178.583 -2.900 18986 7457 1 16 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.745 -1.581 18986 7458 1 16 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.428 -1.977 18986 7459 1 16 . 1 1 623 623 ARG H H 623 8.148 8.148 7.758 0.390 18986 7460 1 16 . 1 1 624 624 GLU N N 624 117.953 117.953 119.593 -1.640 18986 7461 1 16 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.086 -0.118 18986 7462 1 16 . 1 1 624 624 GLU C C 624 177.204 177.204 177.681 -0.477 18986 7463 1 16 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.561 -1.704 18986 7464 1 16 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.144 -2.177 18986 7465 1 16 . 1 1 624 624 GLU H H 624 8.143 8.143 8.652 -0.509 18986 7466 1 16 . 1 1 625 625 LYS N N 625 119.222 119.222 118.896 0.326 18986 7467 1 16 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.427 -0.570 18986 7468 1 16 . 1 1 625 625 LYS C C 625 175.480 175.480 178.854 -3.374 18986 7469 1 16 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.788 -1.301 18986 7470 1 16 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.657 -1.994 18986 7471 1 16 . 1 1 625 625 LYS H H 625 7.772 7.772 7.950 -0.178 18986 7472 1 16 . 1 1 626 626 MET N N 626 117.883 117.883 119.741 -1.858 18986 7473 1 16 . 1 1 626 626 MET HA H 626 3.807 3.807 4.326 -0.519 18986 7474 1 16 . 1 1 626 626 MET C C 626 175.278 175.278 178.438 -3.160 18986 7475 1 16 . 1 1 626 626 MET CA C 626 57.782 57.782 57.557 0.225 18986 7476 1 16 . 1 1 626 626 MET CB C 626 30.657 30.657 32.002 -1.345 18986 7477 1 16 . 1 1 626 626 MET H H 626 8.367 8.367 8.346 0.021 18986 7478 1 16 . 1 1 627 627 MET N N 627 116.185 116.185 118.945 -2.760 18986 7479 1 16 . 1 1 627 627 MET HA H 627 4.152 4.152 3.987 0.165 18986 7480 1 16 . 1 1 627 627 MET C C 627 176.393 176.393 178.502 -2.109 18986 7481 1 16 . 1 1 627 627 MET CA C 627 55.359 55.359 59.352 -3.993 18986 7482 1 16 . 1 1 627 627 MET CB C 627 28.803 28.803 31.234 -2.431 18986 7483 1 16 . 1 1 627 627 MET H H 627 8.197 8.197 8.824 -0.627 18986 7484 1 16 . 1 1 628 628 LYS N N 628 119.859 119.859 119.699 0.160 18986 7485 1 16 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.206 -0.006 18986 7486 1 16 . 1 1 628 628 LYS C C 628 175.885 175.885 179.575 -3.690 18986 7487 1 16 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.351 -4.274 18986 7488 1 16 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.262 -3.731 18986 7489 1 16 . 1 1 628 628 LYS H H 628 7.700 7.700 7.634 0.066 18986 7490 1 16 . 1 1 629 629 ILE N N 629 119.001 119.001 120.010 -1.009 18986 7491 1 16 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.653 -0.105 18986 7492 1 16 . 1 1 629 629 ILE C C 629 174.891 174.891 177.983 -3.092 18986 7493 1 16 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.423 -3.158 18986 7494 1 16 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.922 -4.073 18986 7495 1 16 . 1 1 629 629 ILE H H 629 7.970 7.970 8.006 -0.036 18986 7496 1 16 . 1 1 630 630 ILE N N 630 120.737 120.737 117.757 2.980 18986 7497 1 16 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.665 -0.198 18986 7498 1 16 . 1 1 630 630 ILE C C 630 173.875 173.875 177.719 -3.844 18986 7499 1 16 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.037 -2.283 18986 7500 1 16 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.859 -2.582 18986 7501 1 16 . 1 1 630 630 ILE H H 630 8.213 8.213 8.236 -0.023 18986 7502 1 16 . 1 1 631 631 GLU N N 631 119.546 119.546 121.342 -1.796 18986 7503 1 16 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.988 0.077 18986 7504 1 16 . 1 1 631 631 GLU C C 631 177.300 177.300 179.227 -1.927 18986 7505 1 16 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.661 -2.681 18986 7506 1 16 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.588 -2.595 18986 7507 1 16 . 1 1 631 631 GLU H H 631 7.742 7.742 8.299 -0.557 18986 7508 1 16 . 1 1 632 632 ILE N N 632 121.547 121.547 121.011 0.536 18986 7509 1 16 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.629 0.054 18986 7510 1 16 . 1 1 632 632 ILE C C 632 175.454 175.454 178.146 -2.692 18986 7511 1 16 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.735 -3.079 18986 7512 1 16 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.783 -1.953 18986 7513 1 16 . 1 1 632 632 ILE H H 632 8.013 8.013 8.307 -0.294 18986 7514 1 16 . 1 1 633 633 ILE N N 633 121.605 121.605 120.595 1.010 18986 7515 1 16 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.564 -0.229 18986 7516 1 16 . 1 1 633 633 ILE C C 633 174.558 174.558 178.212 -3.654 18986 7517 1 16 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.811 -1.892 18986 7518 1 16 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.224 -1.940 18986 7519 1 16 . 1 1 633 633 ILE H H 633 8.594 8.594 8.479 0.115 18986 7520 1 16 . 1 1 634 634 ASP N N 634 118.706 118.706 119.743 -1.037 18986 7521 1 16 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.394 0.041 18986 7522 1 16 . 1 1 634 634 ASP C C 634 176.574 176.574 178.708 -2.134 18986 7523 1 16 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.382 -2.811 18986 7524 1 16 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.376 -2.462 18986 7525 1 16 . 1 1 634 634 ASP H H 634 8.724 8.724 8.387 0.337 18986 7526 1 16 . 1 1 635 635 SER N N 635 114.064 114.064 116.613 -2.549 18986 7527 1 16 . 1 1 635 635 SER HA H 635 4.232 4.232 4.213 0.019 18986 7528 1 16 . 1 1 635 635 SER C C 635 174.487 174.487 176.603 -2.116 18986 7529 1 16 . 1 1 635 635 SER CA C 635 58.540 58.540 61.930 -3.390 18986 7530 1 16 . 1 1 635 635 SER CB C 635 60.319 60.319 62.943 -2.624 18986 7531 1 16 . 1 1 635 635 SER H H 635 7.992 7.992 8.421 -0.429 18986 7532 1 16 . 1 1 636 636 LEU N N 636 122.493 122.493 121.625 0.868 18986 7533 1 16 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.068 0.186 18986 7534 1 16 . 1 1 636 636 LEU C C 636 176.194 176.194 178.806 -2.612 18986 7535 1 16 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.852 -3.757 18986 7536 1 16 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.601 -1.895 18986 7537 1 16 . 1 1 636 636 LEU H H 636 8.169 8.169 8.535 -0.366 18986 7538 1 16 . 1 1 637 637 ALA N N 637 121.891 121.891 122.400 -0.509 18986 7539 1 16 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.302 -0.213 18986 7540 1 16 . 1 1 637 637 ALA C C 637 175.131 175.131 179.750 -4.619 18986 7541 1 16 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.627 -4.290 18986 7542 1 16 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.624 -3.136 18986 7543 1 16 . 1 1 637 637 ALA H H 637 8.482 8.482 8.197 0.285 18986 7544 1 16 . 1 1 638 638 VAL N N 638 117.140 117.140 116.945 0.195 18986 7545 1 16 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.927 0.008 18986 7546 1 16 . 1 1 638 638 VAL C C 638 174.712 174.712 176.717 -2.005 18986 7547 1 16 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.556 -2.555 18986 7548 1 16 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.454 -2.103 18986 7549 1 16 . 1 1 638 638 VAL H H 638 7.291 7.291 8.476 -1.185 18986 7550 1 16 . 1 1 639 639 SER N N 639 114.143 114.143 114.248 -0.105 18986 7551 1 16 . 1 1 639 639 SER HA H 639 4.481 4.481 4.560 -0.079 18986 7552 1 16 . 1 1 639 639 SER C C 639 172.122 172.122 173.601 -1.479 18986 7553 1 16 . 1 1 639 639 SER CA C 639 56.002 56.002 58.943 -2.941 18986 7554 1 16 . 1 1 639 639 SER CB C 639 60.921 60.921 64.224 -3.303 18986 7555 1 16 . 1 1 639 639 SER H H 639 7.918 7.918 7.956 -0.038 18986 7556 1 16 . 1 1 640 640 SER N N 640 115.370 115.370 115.655 -0.285 18986 7557 1 16 . 1 1 640 640 SER HA H 640 4.711 4.711 4.613 0.098 18986 7558 1 16 . 1 1 640 640 SER C C 640 171.185 171.185 174.558 -3.373 18986 7559 1 16 . 1 1 640 640 SER CA C 640 55.009 55.009 57.100 -2.091 18986 7560 1 16 . 1 1 640 640 SER CB C 640 61.974 61.974 63.972 -1.998 18986 7561 1 16 . 1 1 640 640 SER H H 640 7.765 7.765 7.624 0.141 18986 7562 1 16 . 1 1 641 641 GLU N N 641 119.994 119.994 120.936 -0.942 18986 7563 1 16 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.151 -0.107 18986 7564 1 16 . 1 1 641 641 GLU C C 641 173.167 173.167 176.230 -3.063 18986 7565 1 16 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.162 -2.511 18986 7566 1 16 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.973 -2.489 18986 7567 1 16 . 1 1 641 641 GLU H H 641 8.363 8.363 8.729 -0.366 18986 7568 1 16 . 1 1 642 642 CYS N N 642 110.257 110.257 114.208 -3.951 18986 7569 1 16 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.579 -0.120 18986 7570 1 16 . 1 1 642 642 CYS C C 642 168.058 168.058 173.165 -5.107 18986 7571 1 16 . 1 1 642 642 CYS CA C 642 50.946 50.946 57.016 -6.070 18986 7572 1 16 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.300 10.061 18986 7573 1 16 . 1 1 642 642 CYS H H 642 7.881 7.881 7.820 0.061 18986 7574 1 16 . 1 1 643 643 ALA N N 643 123.922 123.922 124.139 -0.217 18986 7575 1 16 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.452 0.186 18986 7576 1 16 . 1 1 643 643 ALA C C 643 172.517 172.517 176.795 -4.278 18986 7577 1 16 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.145 -3.526 18986 7578 1 16 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.366 0.078 18986 7579 1 16 . 1 1 643 643 ALA H H 643 9.787 9.787 8.806 0.981 18986 7580 1 16 . 1 1 644 644 LYS N N 644 128.479 128.479 126.351 2.128 18986 7581 1 16 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.311 0.200 18986 7582 1 16 . 1 1 644 644 LYS C C 644 176.945 176.945 177.513 -0.568 18986 7583 1 16 . 1 1 644 644 LYS CA C 644 54.338 54.338 57.068 -2.730 18986 7584 1 16 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.035 -2.094 18986 7585 1 16 . 1 1 644 644 LYS H H 644 9.809 9.809 8.633 1.176 18986 7586 1 16 . 1 1 645 645 VAL N N 645 124.257 124.257 127.698 -3.441 18986 7587 1 16 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.375 0.273 18986 7588 1 16 . 1 1 645 645 VAL C C 645 173.996 173.996 177.214 -3.218 18986 7589 1 16 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.268 -1.406 18986 7590 1 16 . 1 1 645 645 VAL CB C 645 29.201 29.201 30.909 -1.708 18986 7591 1 16 . 1 1 645 645 VAL H H 645 8.458 8.458 9.035 -0.577 18986 7592 1 16 . 1 1 646 646 LYS N N 646 117.598 117.598 120.303 -2.705 18986 7593 1 16 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.816 0.191 18986 7594 1 16 . 1 1 646 646 LYS C C 646 176.047 176.047 178.332 -2.285 18986 7595 1 16 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.231 -2.986 18986 7596 1 16 . 1 1 646 646 LYS CB C 646 29.398 29.398 32.097 -2.699 18986 7597 1 16 . 1 1 646 646 LYS H H 646 8.706 8.706 8.899 -0.193 18986 7598 1 16 . 1 1 647 647 ASP N N 647 119.229 119.229 119.081 0.148 18986 7599 1 16 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.520 0.098 18986 7600 1 16 . 1 1 647 647 ASP C C 647 175.211 175.211 178.720 -3.509 18986 7601 1 16 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.203 -2.881 18986 7602 1 16 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.605 -1.867 18986 7603 1 16 . 1 1 647 647 ASP H H 647 7.012 7.012 7.764 -0.752 18986 7604 1 16 . 1 1 648 648 ILE N N 648 121.939 121.939 120.903 1.036 18986 7605 1 16 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.633 -0.252 18986 7606 1 16 . 1 1 648 648 ILE C C 648 175.243 175.243 177.935 -2.692 18986 7607 1 16 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.374 -2.333 18986 7608 1 16 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.781 -1.819 18986 7609 1 16 . 1 1 648 648 ILE H H 648 8.152 8.152 7.845 0.307 18986 7610 1 16 . 1 1 649 649 LEU N N 649 117.310 117.310 120.439 -3.129 18986 7611 1 16 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.782 0.091 18986 7612 1 16 . 1 1 649 649 LEU C C 649 176.439 176.439 179.057 -2.618 18986 7613 1 16 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.428 -2.542 18986 7614 1 16 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.254 -1.948 18986 7615 1 16 . 1 1 649 649 LEU H H 649 8.638 8.638 8.459 0.179 18986 7616 1 16 . 1 1 650 650 LYS N N 650 118.810 118.810 119.915 -1.105 18986 7617 1 16 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.875 0.171 18986 7618 1 16 . 1 1 650 650 LYS C C 650 176.801 176.801 179.135 -2.334 18986 7619 1 16 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.911 -2.861 18986 7620 1 16 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.338 -2.274 18986 7621 1 16 . 1 1 650 650 LYS H H 650 7.296 7.296 8.056 -0.760 18986 7622 1 16 . 1 1 651 651 GLU N N 651 117.713 117.713 118.000 -0.287 18986 7623 1 16 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.146 -0.038 18986 7624 1 16 . 1 1 651 651 GLU C C 651 176.903 176.903 179.060 -2.157 18986 7625 1 16 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.493 -2.683 18986 7626 1 16 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.294 -1.847 18986 7627 1 16 . 1 1 651 651 GLU H H 651 8.036 8.036 8.333 -0.297 18986 7628 1 16 . 1 1 652 652 ALA N N 652 121.206 121.206 122.469 -1.263 18986 7629 1 16 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.092 -0.094 18986 7630 1 16 . 1 1 652 652 ALA C C 652 176.766 176.766 179.761 -2.995 18986 7631 1 16 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.101 -3.367 18986 7632 1 16 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.188 -2.872 18986 7633 1 16 . 1 1 652 652 ALA H H 652 8.973 8.973 8.664 0.309 18986 7634 1 16 . 1 1 653 653 GLN N N 653 117.768 117.768 118.484 -0.716 18986 7635 1 16 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.225 0.252 18986 7636 1 16 . 1 1 653 653 GLN C C 653 177.388 177.388 178.899 -1.511 18986 7637 1 16 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.614 -2.554 18986 7638 1 16 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.745 -1.976 18986 7639 1 16 . 1 1 653 653 GLN H H 653 8.059 8.059 8.076 -0.017 18986 7640 1 16 . 1 1 654 654 GLN N N 654 117.979 117.979 118.520 -0.541 18986 7641 1 16 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.103 0.074 18986 7642 1 16 . 1 1 654 654 GLN C C 654 174.834 174.834 178.185 -3.351 18986 7643 1 16 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.419 -3.001 18986 7644 1 16 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.834 -2.857 18986 7645 1 16 . 1 1 654 654 GLN H H 654 7.495 7.495 8.009 -0.514 18986 7646 1 16 . 1 1 655 655 VAL N N 655 110.080 110.080 111.261 -1.181 18986 7647 1 16 . 1 1 655 655 VAL HA H 655 4.527 4.527 4.134 0.393 18986 7648 1 16 . 1 1 655 655 VAL C C 655 173.369 173.369 176.709 -3.340 18986 7649 1 16 . 1 1 655 655 VAL CA C 655 58.067 58.067 62.441 -4.374 18986 7650 1 16 . 1 1 655 655 VAL CB C 655 28.184 28.184 31.730 -3.546 18986 7651 1 16 . 1 1 655 655 VAL H H 655 7.197 7.197 7.706 -0.509 18986 7652 1 16 . 1 1 656 656 GLY N N 656 107.089 107.089 108.071 -0.982 18986 7653 1 16 . 1 1 656 656 GLY C C 656 171.639 171.639 174.894 -3.255 18986 7654 1 16 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.737 -1.426 18986 7655 1 16 . 1 1 656 656 GLY H H 656 7.541 7.541 7.754 -0.213 18986 7656 1 16 . 1 1 657 657 ILE N N 657 121.266 121.266 121.633 -0.367 18986 7657 1 16 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.075 0.059 18986 7658 1 16 . 1 1 657 657 ILE C C 657 171.885 171.885 176.094 -4.209 18986 7659 1 16 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.984 -1.754 18986 7660 1 16 . 1 1 657 657 ILE CB C 657 35.191 35.191 37.679 -2.488 18986 7661 1 16 . 1 1 657 657 ILE H H 657 7.633 7.633 8.168 -0.535 18986 7662 1 16 . 1 1 658 658 GLU N N 658 127.252 127.252 125.286 1.966 18986 7663 1 16 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.206 -0.003 18986 7664 1 16 . 1 1 658 658 GLU C C 658 175.316 175.316 177.060 -1.744 18986 7665 1 16 . 1 1 658 658 GLU CA C 658 54.360 54.360 56.135 -1.774 18986 7666 1 16 . 1 1 658 658 GLU CB C 658 27.610 27.610 30.982 -3.372 18986 7667 1 16 . 1 1 658 658 GLU H H 658 8.690 8.690 8.653 0.037 18986 7668 1 16 . 1 1 659 659 LYS N N 659 124.533 124.533 126.281 -1.748 18986 7669 1 16 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.840 -0.052 18986 7670 1 16 . 1 1 659 659 LYS C C 659 175.170 175.170 178.215 -3.045 18986 7671 1 16 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.837 -2.666 18986 7672 1 16 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.798 -1.681 18986 7673 1 16 . 1 1 659 659 LYS H H 659 8.706 8.706 8.847 -0.141 18986 7674 1 16 . 1 1 660 660 SER N N 660 113.137 113.137 114.842 -1.705 18986 7675 1 16 . 1 1 660 660 SER HA H 660 4.273 4.273 4.294 -0.021 18986 7676 1 16 . 1 1 660 660 SER C C 660 173.939 173.939 176.632 -2.693 18986 7677 1 16 . 1 1 660 660 SER CA C 660 58.350 58.350 61.473 -3.123 18986 7678 1 16 . 1 1 660 660 SER CB C 660 59.504 59.504 62.551 -3.047 18986 7679 1 16 . 1 1 660 660 SER H H 660 8.777 8.777 8.564 0.213 18986 7680 1 16 . 1 1 661 661 ASN N N 661 119.986 119.986 118.717 1.269 18986 7681 1 16 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.543 0.163 18986 7682 1 16 . 1 1 661 661 ASN C C 661 174.516 174.516 177.875 -3.359 18986 7683 1 16 . 1 1 661 661 ASN CA C 661 52.048 52.048 55.947 -3.899 18986 7684 1 16 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.194 -1.451 18986 7685 1 16 . 1 1 661 661 ASN H H 661 7.486 7.486 7.545 -0.059 18986 7686 1 16 . 1 1 662 662 ILE N N 662 120.639 120.639 121.095 -0.456 18986 7687 1 16 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.703 -0.257 18986 7688 1 16 . 1 1 662 662 ILE C C 662 174.252 174.252 177.559 -3.307 18986 7689 1 16 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.407 -2.801 18986 7690 1 16 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.927 -3.504 18986 7691 1 16 . 1 1 662 662 ILE H H 662 7.999 7.999 8.081 -0.082 18986 7692 1 16 . 1 1 663 663 GLU N N 663 117.706 117.706 120.732 -3.026 18986 7693 1 16 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.917 -0.127 18986 7694 1 16 . 1 1 663 663 GLU C C 663 176.509 176.509 179.043 -2.534 18986 7695 1 16 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.534 -2.826 18986 7696 1 16 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.460 -2.705 18986 7697 1 16 . 1 1 663 663 GLU H H 663 8.190 8.190 8.439 -0.249 18986 7698 1 16 . 1 1 664 664 LYS N N 664 119.586 119.586 120.189 -0.603 18986 7699 1 16 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.077 -0.024 18986 7700 1 16 . 1 1 664 664 LYS C C 664 175.941 175.941 178.935 -2.994 18986 7701 1 16 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.367 -2.786 18986 7702 1 16 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.224 -2.401 18986 7703 1 16 . 1 1 664 664 LYS H H 664 7.590 7.590 8.191 -0.601 18986 7704 1 16 . 1 1 665 665 LEU N N 665 119.756 119.756 121.550 -1.794 18986 7705 1 16 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.043 0.037 18986 7706 1 16 . 1 1 665 665 LEU C C 665 176.700 176.700 179.124 -2.424 18986 7707 1 16 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.016 -2.631 18986 7708 1 16 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.886 -2.694 18986 7709 1 16 . 1 1 665 665 LEU H H 665 8.075 8.075 8.261 -0.186 18986 7710 1 16 . 1 1 666 666 LEU N N 666 118.788 118.788 119.055 -0.267 18986 7711 1 16 . 1 1 666 666 LEU HA H 666 3.764 3.764 4.096 -0.332 18986 7712 1 16 . 1 1 666 666 LEU C C 666 176.484 176.484 179.356 -2.872 18986 7713 1 16 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.189 -2.531 18986 7714 1 16 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.666 -2.055 18986 7715 1 16 . 1 1 666 666 LEU H H 666 8.550 8.550 8.705 -0.155 18986 7716 1 16 . 1 1 667 667 THR N N 667 115.244 115.244 116.185 -0.941 18986 7717 1 16 . 1 1 667 667 THR HA H 667 3.839 3.839 3.941 -0.102 18986 7718 1 16 . 1 1 667 667 THR C C 667 173.740 173.740 176.476 -2.736 18986 7719 1 16 . 1 1 667 667 THR CA C 667 64.378 64.378 67.455 -3.077 18986 7720 1 16 . 1 1 667 667 THR CB C 667 65.748 65.748 68.271 -2.523 18986 7721 1 16 . 1 1 667 667 THR H H 667 7.662 7.662 8.193 -0.531 18986 7722 1 16 . 1 1 668 668 ASP N N 668 122.862 122.862 123.036 -0.174 18986 7723 1 16 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.326 0.057 18986 7724 1 16 . 1 1 668 668 ASP C C 668 177.192 177.192 178.232 -1.040 18986 7725 1 16 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.077 -1.946 18986 7726 1 16 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.770 -2.884 18986 7727 1 16 . 1 1 668 668 ASP H H 668 8.291 8.291 8.267 0.024 18986 7728 1 16 . 1 1 669 669 MET N N 669 119.640 119.640 118.447 1.193 18986 7729 1 16 . 1 1 669 669 MET HA H 669 3.917 3.917 3.987 -0.070 18986 7730 1 16 . 1 1 669 669 MET C C 669 175.414 175.414 178.780 -3.366 18986 7731 1 16 . 1 1 669 669 MET CA C 669 57.234 57.234 59.516 -2.282 18986 7732 1 16 . 1 1 669 669 MET CB C 669 32.088 32.088 32.450 -0.362 18986 7733 1 16 . 1 1 669 669 MET H H 669 8.809 8.809 8.506 0.303 18986 7734 1 16 . 1 1 670 670 ARG N N 670 122.614 122.614 116.581 6.033 18986 7735 1 16 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.496 0.021 18986 7736 1 16 . 1 1 670 670 ARG C C 670 177.928 177.928 178.840 -0.912 18986 7737 1 16 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.153 -1.931 18986 7738 1 16 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.767 -2.463 18986 7739 1 16 . 1 1 670 670 ARG H H 670 8.450 8.450 8.003 0.447 18986 7740 1 16 . 1 1 671 671 LYS N N 671 121.976 121.976 120.037 1.939 18986 7741 1 16 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.241 -0.128 18986 7742 1 16 . 1 1 671 671 LYS C C 671 176.143 176.143 178.281 -2.138 18986 7743 1 16 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.171 -1.085 18986 7744 1 16 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.645 -3.141 18986 7745 1 16 . 1 1 671 671 LYS H H 671 8.609 8.609 7.928 0.681 18986 7746 1 16 . 1 1 672 672 SER N N 672 111.655 111.655 112.591 -0.936 18986 7747 1 16 . 1 1 672 672 SER HA H 672 4.469 4.469 4.480 -0.011 18986 7748 1 16 . 1 1 672 672 SER C C 672 171.692 171.692 175.137 -3.445 18986 7749 1 16 . 1 1 672 672 SER CA C 672 56.790 56.790 59.322 -2.532 18986 7750 1 16 . 1 1 672 672 SER CB C 672 61.343 61.343 64.278 -2.935 18986 7751 1 16 . 1 1 672 672 SER H H 672 7.884 7.884 8.542 -0.658 18986 7752 1 16 . 1 1 673 673 GLY N N 673 108.029 108.029 108.277 -0.248 18986 7753 1 16 . 1 1 673 673 GLY C C 673 171.492 171.492 175.132 -3.640 18986 7754 1 16 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.425 -2.150 18986 7755 1 16 . 1 1 673 673 GLY H H 673 7.774 7.774 8.037 -0.263 18986 7756 1 16 . 1 1 674 674 ILE N N 674 116.193 116.193 120.389 -4.196 18986 7757 1 16 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.072 0.029 18986 7758 1 16 . 1 1 674 674 ILE C C 674 173.980 173.980 175.769 -1.789 18986 7759 1 16 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.336 -3.094 18986 7760 1 16 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.745 -1.941 18986 7761 1 16 . 1 1 674 674 ILE H H 674 8.026 8.026 8.347 -0.321 18986 7762 1 16 . 1 1 675 675 ILE N N 675 108.928 108.928 113.650 -4.722 18986 7763 1 16 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.343 1.015 18986 7764 1 16 . 1 1 675 675 ILE C C 675 170.797 170.797 173.759 -2.962 18986 7765 1 16 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.984 -2.960 18986 7766 1 16 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.446 -1.960 18986 7767 1 16 . 1 1 675 675 ILE H H 675 7.120 7.120 7.410 -0.290 18986 7768 1 16 . 1 1 676 676 TYR N N 676 118.062 118.062 116.205 1.857 18986 7769 1 16 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.032 -0.037 18986 7770 1 16 . 1 1 676 676 TYR C C 676 170.020 170.020 173.641 -3.621 18986 7771 1 16 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.725 -2.832 18986 7772 1 16 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.326 -2.810 18986 7773 1 16 . 1 1 676 676 TYR H H 676 9.380 9.380 8.570 0.810 18986 7774 1 16 . 1 1 677 677 GLU N N 677 123.578 123.578 123.056 0.522 18986 7775 1 16 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.262 -0.436 18986 7776 1 16 . 1 1 677 677 GLU C C 677 172.146 172.146 175.796 -3.650 18986 7777 1 16 . 1 1 677 677 GLU CA C 677 52.476 52.476 54.640 -2.164 18986 7778 1 16 . 1 1 677 677 GLU CB C 677 26.612 26.612 29.065 -2.453 18986 7779 1 16 . 1 1 677 677 GLU H H 677 8.951 8.951 8.630 0.321 18986 7780 1 16 . 1 1 678 678 ALA N N 678 133.220 133.220 130.555 2.665 18986 7781 1 16 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.300 -0.259 18986 7782 1 16 . 1 1 678 678 ALA C C 678 175.219 175.219 177.228 -2.009 18986 7783 1 16 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.968 -2.367 18986 7784 1 16 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.908 -3.309 18986 7785 1 16 . 1 1 678 678 ALA H H 678 7.912 7.912 8.778 -0.866 18986 7786 1 16 . 1 1 679 679 LYS N N 679 115.687 115.687 115.658 0.029 18986 7787 1 16 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.751 -0.316 18986 7788 1 16 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.815 -1.799 18986 7789 1 16 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.051 -3.056 18986 7790 1 16 . 1 1 679 679 LYS H H 679 8.215 8.215 7.737 0.478 18986 7791 1 16 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.858 -0.839 18986 7792 1 16 . 1 1 680 680 PRO C C 680 174.504 174.504 176.409 -1.905 18986 7793 1 16 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.559 -2.041 18986 7794 1 16 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.283 -2.968 18986 7795 1 16 . 1 1 681 681 GLU N N 681 118.851 118.851 116.818 2.033 18986 7796 1 16 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.420 -0.982 18986 7797 1 16 . 1 1 681 681 GLU C C 681 172.890 172.890 174.390 -1.500 18986 7798 1 16 . 1 1 681 681 GLU CA C 681 54.481 54.481 56.437 -1.956 18986 7799 1 16 . 1 1 681 681 GLU CB C 681 24.789 24.789 32.312 -7.523 18986 7800 1 16 . 1 1 681 681 GLU H H 681 10.003 10.003 8.524 1.479 18986 7801 1 16 . 1 1 682 682 CYS N N 682 120.934 120.934 121.838 -0.904 18986 7802 1 16 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.053 -0.026 18986 7803 1 16 . 1 1 682 682 CYS C C 682 171.905 171.905 173.173 -1.268 18986 7804 1 16 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.723 -3.479 18986 7805 1 16 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.339 16.956 18986 7806 1 16 . 1 1 682 682 CYS H H 682 7.860 7.860 8.800 -0.940 18986 7807 1 16 . 1 1 683 683 TYR N N 683 126.183 126.183 125.268 0.915 18986 7808 1 16 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.341 -0.117 18986 7809 1 16 . 1 1 683 683 TYR C C 683 173.008 173.008 174.529 -1.521 18986 7810 1 16 . 1 1 683 683 TYR CA C 683 56.568 56.568 54.648 1.920 18986 7811 1 16 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.845 0.107 18986 7812 1 16 . 1 1 683 683 TYR H H 683 9.297 9.297 9.420 -0.123 18986 7813 1 16 . 1 1 684 684 LYS N N 684 118.604 118.604 122.146 -3.542 18986 7814 1 16 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.849 -0.412 18986 7815 1 16 . 1 1 684 684 LYS C C 684 171.628 171.628 175.167 -3.539 18986 7816 1 16 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.512 -1.209 18986 7817 1 16 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.303 -1.626 18986 7818 1 16 . 1 1 684 684 LYS H H 684 8.630 8.630 9.146 -0.516 18986 7819 1 16 . 1 1 685 685 LYS N N 685 122.869 122.869 123.222 -0.353 18986 7820 1 16 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.282 0.362 18986 7821 1 16 . 1 1 685 685 LYS C C 685 173.337 173.337 176.122 -2.785 18986 7822 1 16 . 1 1 685 685 LYS CA C 685 54.253 54.253 55.576 -1.323 18986 7823 1 16 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.715 -1.788 18986 7824 1 16 . 1 1 685 685 LYS H H 685 8.969 8.969 8.411 0.558 18986 7825 1 17 . 1 1 601 601 SER HA H 601 4.475 4.475 4.419 0.056 18986 7826 1 17 . 1 1 601 601 SER CA C 601 55.508 55.508 59.372 -3.864 18986 7827 1 17 . 1 1 601 601 SER CB C 601 61.220 61.220 63.239 -2.019 18986 7828 1 17 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.695 -0.079 18986 7829 1 17 . 1 1 602 602 HIS C C 602 172.320 172.320 173.443 -1.123 18986 7830 1 17 . 1 1 602 602 HIS CA C 602 53.854 53.854 55.797 -1.942 18986 7831 1 17 . 1 1 602 602 HIS CB C 602 28.083 28.083 32.260 -4.177 18986 7832 1 17 . 1 1 603 603 MET N N 603 121.862 121.862 120.155 1.707 18986 7833 1 17 . 1 1 603 603 MET HA H 603 4.425 4.425 4.772 -0.347 18986 7834 1 17 . 1 1 603 603 MET C C 603 173.948 173.948 177.016 -3.068 18986 7835 1 17 . 1 1 603 603 MET CA C 603 53.108 53.108 53.882 -0.774 18986 7836 1 17 . 1 1 603 603 MET CB C 603 30.049 30.049 34.442 -4.393 18986 7837 1 17 . 1 1 603 603 MET H H 603 8.394 8.394 9.370 -0.976 18986 7838 1 17 . 1 1 604 604 GLY N N 604 110.382 110.382 109.205 1.177 18986 7839 1 17 . 1 1 604 604 GLY C C 604 171.590 171.590 173.789 -2.199 18986 7840 1 17 . 1 1 604 604 GLY CA C 604 42.617 42.617 45.404 -2.787 18986 7841 1 17 . 1 1 604 604 GLY H H 604 8.411 8.411 8.707 -0.296 18986 7842 1 17 . 1 1 605 605 GLU N N 605 120.709 120.709 122.883 -2.174 18986 7843 1 17 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.660 -0.353 18986 7844 1 17 . 1 1 605 605 GLU C C 605 174.220 174.220 175.797 -1.577 18986 7845 1 17 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.202 -2.236 18986 7846 1 17 . 1 1 605 605 GLU CB C 605 27.611 27.611 32.416 -4.804 18986 7847 1 17 . 1 1 605 605 GLU H H 605 8.282 8.282 8.292 -0.010 18986 7848 1 17 . 1 1 606 606 SER N N 606 116.679 116.679 116.654 0.025 18986 7849 1 17 . 1 1 606 606 SER HA H 606 4.405 4.405 4.666 -0.261 18986 7850 1 17 . 1 1 606 606 SER C C 606 172.455 172.455 173.551 -1.096 18986 7851 1 17 . 1 1 606 606 SER CA C 606 56.028 56.028 57.974 -1.946 18986 7852 1 17 . 1 1 606 606 SER CB C 606 61.039 61.039 64.793 -3.754 18986 7853 1 17 . 1 1 606 606 SER H H 606 8.420 8.420 8.556 -0.136 18986 7854 1 17 . 1 1 607 607 GLY N N 607 110.716 110.716 109.397 1.319 18986 7855 1 17 . 1 1 607 607 GLY C C 607 171.173 171.173 173.364 -2.191 18986 7856 1 17 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.720 -3.079 18986 7857 1 17 . 1 1 607 607 GLY H H 607 8.386 8.386 8.574 -0.188 18986 7858 1 17 . 1 1 608 608 LYS N N 608 120.785 120.785 120.816 -0.031 18986 7859 1 17 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.453 -0.114 18986 7860 1 17 . 1 1 608 608 LYS C C 608 173.673 173.673 175.321 -1.648 18986 7861 1 17 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.641 -2.276 18986 7862 1 17 . 1 1 608 608 LYS CB C 608 30.531 30.531 30.556 -0.025 18986 7863 1 17 . 1 1 608 608 LYS H H 608 8.008 8.008 8.314 -0.306 18986 7864 1 17 . 1 1 609 609 ILE N N 609 122.404 122.404 122.376 0.028 18986 7865 1 17 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.292 -0.143 18986 7866 1 17 . 1 1 609 609 ILE C C 609 172.675 172.675 174.644 -1.969 18986 7867 1 17 . 1 1 609 609 ILE CA C 609 58.003 58.003 61.045 -3.042 18986 7868 1 17 . 1 1 609 609 ILE CB C 609 36.204 36.204 41.622 -5.418 18986 7869 1 17 . 1 1 609 609 ILE H H 609 8.186 8.186 7.904 0.282 18986 7870 1 17 . 1 1 610 610 ASP N N 610 125.357 125.357 126.856 -1.499 18986 7871 1 17 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.937 -0.234 18986 7872 1 17 . 1 1 610 610 ASP C C 610 173.668 173.668 175.409 -1.741 18986 7873 1 17 . 1 1 610 610 ASP CA C 610 50.702 50.702 52.728 -2.026 18986 7874 1 17 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.666 -4.976 18986 7875 1 17 . 1 1 610 610 ASP H H 610 8.369 8.369 8.193 0.176 18986 7876 1 17 . 1 1 611 611 ILE N N 611 122.494 122.494 121.853 0.641 18986 7877 1 17 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.101 -0.192 18986 7878 1 17 . 1 1 611 611 ILE C C 611 173.618 173.618 178.027 -4.409 18986 7879 1 17 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.864 -2.824 18986 7880 1 17 . 1 1 611 611 ILE CB C 611 35.798 35.798 37.453 -1.655 18986 7881 1 17 . 1 1 611 611 ILE H H 611 8.284 8.284 8.221 0.063 18986 7882 1 17 . 1 1 612 612 ASP N N 612 121.440 121.440 120.001 1.439 18986 7883 1 17 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.396 0.038 18986 7884 1 17 . 1 1 612 612 ASP C C 612 175.129 175.129 178.272 -3.143 18986 7885 1 17 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.532 -3.767 18986 7886 1 17 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.258 -1.120 18986 7887 1 17 . 1 1 612 612 ASP H H 612 8.279 8.279 8.538 -0.259 18986 7888 1 17 . 1 1 613 613 THR N N 613 114.422 114.422 112.643 1.779 18986 7889 1 17 . 1 1 613 613 THR HA H 613 4.106 4.106 4.117 -0.011 18986 7890 1 17 . 1 1 613 613 THR C C 613 173.338 173.338 175.249 -1.911 18986 7891 1 17 . 1 1 613 613 THR CA C 613 61.545 61.545 64.235 -2.690 18986 7892 1 17 . 1 1 613 613 THR CB C 613 66.267 66.267 68.522 -2.255 18986 7893 1 17 . 1 1 613 613 THR H H 613 7.866 7.866 8.168 -0.302 18986 7894 1 17 . 1 1 614 614 ILE N N 614 121.654 121.654 118.621 3.033 18986 7895 1 17 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.093 -0.064 18986 7896 1 17 . 1 1 614 614 ILE C C 614 174.471 174.471 177.028 -2.557 18986 7897 1 17 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.037 -2.864 18986 7898 1 17 . 1 1 614 614 ILE CB C 614 35.815 35.815 39.380 -3.565 18986 7899 1 17 . 1 1 614 614 ILE H H 614 7.819 7.819 7.356 0.463 18986 7900 1 17 . 1 1 615 615 MET N N 615 119.713 119.713 119.133 0.580 18986 7901 1 17 . 1 1 615 615 MET HA H 615 4.478 4.478 4.651 -0.173 18986 7902 1 17 . 1 1 615 615 MET C C 615 174.075 174.075 177.812 -3.737 18986 7903 1 17 . 1 1 615 615 MET CA C 615 52.764 52.764 57.501 -4.737 18986 7904 1 17 . 1 1 615 615 MET CB C 615 29.337 29.337 32.200 -2.863 18986 7905 1 17 . 1 1 615 615 MET H H 615 8.188 8.188 8.375 -0.187 18986 7906 1 17 . 1 1 616 616 THR N N 616 114.770 114.770 115.057 -0.287 18986 7907 1 17 . 1 1 616 616 THR HA H 616 4.099 4.099 4.126 -0.027 18986 7908 1 17 . 1 1 616 616 THR C C 616 172.535 172.535 176.151 -3.616 18986 7909 1 17 . 1 1 616 616 THR CA C 616 61.112 61.112 65.364 -4.252 18986 7910 1 17 . 1 1 616 616 THR CB C 616 66.617 66.617 69.177 -2.560 18986 7911 1 17 . 1 1 616 616 THR H H 616 7.722 7.722 8.026 -0.304 18986 7912 1 17 . 1 1 617 617 GLY N N 617 111.384 111.384 106.404 4.980 18986 7913 1 17 . 1 1 617 617 GLY C C 617 171.437 171.437 173.801 -2.364 18986 7914 1 17 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.081 -2.639 18986 7915 1 17 . 1 1 617 617 GLY H H 617 8.431 8.431 7.840 0.592 18986 7916 1 17 . 1 1 618 618 LYS N N 618 120.996 120.996 121.423 -0.427 18986 7917 1 17 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.855 -0.188 18986 7918 1 17 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.867 -2.039 18986 7919 1 17 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.624 -5.147 18986 7920 1 17 . 1 1 618 618 LYS H H 618 7.821 7.821 8.087 -0.266 18986 7921 1 17 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.526 -0.057 18986 7922 1 17 . 1 1 619 619 PRO C C 619 174.453 174.453 178.471 -4.018 18986 7923 1 17 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.374 -2.182 18986 7924 1 17 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.791 -3.211 18986 7925 1 17 . 1 1 620 620 LYS N N 620 123.464 123.464 120.694 2.770 18986 7926 1 17 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.854 0.192 18986 7927 1 17 . 1 1 620 620 LYS C C 620 174.895 174.895 178.451 -3.556 18986 7928 1 17 . 1 1 620 620 LYS CA C 620 56.289 56.289 60.656 -4.367 18986 7929 1 17 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.788 -1.334 18986 7930 1 17 . 1 1 620 620 LYS H H 620 8.728 8.728 8.614 0.114 18986 7931 1 17 . 1 1 621 621 SER N N 621 113.921 113.921 112.362 1.559 18986 7932 1 17 . 1 1 621 621 SER HA H 621 4.336 4.336 4.446 -0.110 18986 7933 1 17 . 1 1 621 621 SER C C 621 173.149 173.149 176.200 -3.051 18986 7934 1 17 . 1 1 621 621 SER CA C 621 56.691 56.691 60.910 -4.220 18986 7935 1 17 . 1 1 621 621 SER CB C 621 60.689 60.689 62.600 -1.911 18986 7936 1 17 . 1 1 621 621 SER H H 621 8.531 8.531 8.291 0.240 18986 7937 1 17 . 1 1 622 622 ALA N N 622 124.177 124.177 126.299 -2.122 18986 7938 1 17 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.988 0.180 18986 7939 1 17 . 1 1 622 622 ALA C C 622 176.804 176.804 178.910 -2.106 18986 7940 1 17 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.353 -2.985 18986 7941 1 17 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.671 -2.817 18986 7942 1 17 . 1 1 622 622 ALA H H 622 7.835 7.835 7.944 -0.109 18986 7943 1 17 . 1 1 623 623 ARG N N 623 118.263 118.263 119.289 -1.026 18986 7944 1 17 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.981 -0.031 18986 7945 1 17 . 1 1 623 623 ARG C C 623 175.683 175.683 178.205 -2.522 18986 7946 1 17 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.074 -1.911 18986 7947 1 17 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.631 -2.180 18986 7948 1 17 . 1 1 623 623 ARG H H 623 8.148 8.148 7.706 0.442 18986 7949 1 17 . 1 1 624 624 GLU N N 624 117.953 117.953 120.967 -3.014 18986 7950 1 17 . 1 1 624 624 GLU HA H 624 3.968 3.968 3.898 0.070 18986 7951 1 17 . 1 1 624 624 GLU C C 624 177.204 177.204 178.572 -1.368 18986 7952 1 17 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.888 -3.031 18986 7953 1 17 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.491 -2.523 18986 7954 1 17 . 1 1 624 624 GLU H H 624 8.143 8.143 8.595 -0.452 18986 7955 1 17 . 1 1 625 625 LYS N N 625 119.222 119.222 118.383 0.839 18986 7956 1 17 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.085 -0.228 18986 7957 1 17 . 1 1 625 625 LYS C C 625 175.480 175.480 179.524 -4.044 18986 7958 1 17 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.029 -1.542 18986 7959 1 17 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.624 -1.961 18986 7960 1 17 . 1 1 625 625 LYS H H 625 7.772 7.772 7.852 -0.080 18986 7961 1 17 . 1 1 626 626 MET N N 626 117.883 117.883 119.666 -1.783 18986 7962 1 17 . 1 1 626 626 MET HA H 626 3.807 3.807 4.069 -0.262 18986 7963 1 17 . 1 1 626 626 MET C C 626 175.278 175.278 178.052 -2.774 18986 7964 1 17 . 1 1 626 626 MET CA C 626 57.782 57.782 59.660 -1.879 18986 7965 1 17 . 1 1 626 626 MET CB C 626 30.657 30.657 32.739 -2.082 18986 7966 1 17 . 1 1 626 626 MET H H 626 8.367 8.367 8.710 -0.343 18986 7967 1 17 . 1 1 627 627 MET N N 627 116.185 116.185 117.936 -1.751 18986 7968 1 17 . 1 1 627 627 MET HA H 627 4.152 4.152 4.050 0.102 18986 7969 1 17 . 1 1 627 627 MET C C 627 176.393 176.393 178.299 -1.906 18986 7970 1 17 . 1 1 627 627 MET CA C 627 55.359 55.359 57.657 -2.298 18986 7971 1 17 . 1 1 627 627 MET CB C 627 28.803 28.803 31.047 -2.244 18986 7972 1 17 . 1 1 627 627 MET H H 627 8.197 8.197 8.645 -0.448 18986 7973 1 17 . 1 1 628 628 LYS N N 628 119.859 119.859 120.743 -0.884 18986 7974 1 17 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.338 -0.138 18986 7975 1 17 . 1 1 628 628 LYS C C 628 175.885 175.885 179.471 -3.586 18986 7976 1 17 . 1 1 628 628 LYS CA C 628 55.077 55.077 58.887 -3.810 18986 7977 1 17 . 1 1 628 628 LYS CB C 628 28.531 28.531 31.937 -3.406 18986 7978 1 17 . 1 1 628 628 LYS H H 628 7.700 7.700 7.494 0.206 18986 7979 1 17 . 1 1 629 629 ILE N N 629 119.001 119.001 119.578 -0.577 18986 7980 1 17 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.654 -0.106 18986 7981 1 17 . 1 1 629 629 ILE C C 629 174.891 174.891 177.947 -3.056 18986 7982 1 17 . 1 1 629 629 ILE CA C 629 62.265 62.265 66.020 -3.755 18986 7983 1 17 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.915 -4.066 18986 7984 1 17 . 1 1 629 629 ILE H H 629 7.970 7.970 8.060 -0.090 18986 7985 1 17 . 1 1 630 630 ILE N N 630 120.737 120.737 117.692 3.045 18986 7986 1 17 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.621 -0.154 18986 7987 1 17 . 1 1 630 630 ILE C C 630 173.875 173.875 177.703 -3.828 18986 7988 1 17 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.831 -2.077 18986 7989 1 17 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.860 -2.583 18986 7990 1 17 . 1 1 630 630 ILE H H 630 8.213 8.213 8.098 0.115 18986 7991 1 17 . 1 1 631 631 GLU N N 631 119.546 119.546 121.950 -2.404 18986 7992 1 17 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.309 -0.244 18986 7993 1 17 . 1 1 631 631 GLU C C 631 177.300 177.300 179.422 -2.122 18986 7994 1 17 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.498 -2.518 18986 7995 1 17 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.693 -2.700 18986 7996 1 17 . 1 1 631 631 GLU H H 631 7.742 7.742 8.176 -0.434 18986 7997 1 17 . 1 1 632 632 ILE N N 632 121.547 121.547 120.670 0.877 18986 7998 1 17 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.669 0.014 18986 7999 1 17 . 1 1 632 632 ILE C C 632 175.454 175.454 178.151 -2.697 18986 8000 1 17 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.612 -2.956 18986 8001 1 17 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.714 -1.884 18986 8002 1 17 . 1 1 632 632 ILE H H 632 8.013 8.013 8.048 -0.035 18986 8003 1 17 . 1 1 633 633 ILE N N 633 121.605 121.605 120.862 0.743 18986 8004 1 17 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.598 -0.263 18986 8005 1 17 . 1 1 633 633 ILE C C 633 174.558 174.558 177.917 -3.359 18986 8006 1 17 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.440 -1.521 18986 8007 1 17 . 1 1 633 633 ILE CB C 633 35.284 35.284 36.843 -1.559 18986 8008 1 17 . 1 1 633 633 ILE H H 633 8.594 8.594 8.383 0.211 18986 8009 1 17 . 1 1 634 634 ASP N N 634 118.706 118.706 120.123 -1.417 18986 8010 1 17 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.333 0.102 18986 8011 1 17 . 1 1 634 634 ASP C C 634 176.574 176.574 178.585 -2.011 18986 8012 1 17 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.612 -3.041 18986 8013 1 17 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.172 -2.258 18986 8014 1 17 . 1 1 634 634 ASP H H 634 8.724 8.724 8.592 0.132 18986 8015 1 17 . 1 1 635 635 SER N N 635 114.064 114.064 114.624 -0.560 18986 8016 1 17 . 1 1 635 635 SER HA H 635 4.232 4.232 4.274 -0.042 18986 8017 1 17 . 1 1 635 635 SER C C 635 174.487 174.487 176.296 -1.809 18986 8018 1 17 . 1 1 635 635 SER CA C 635 58.540 58.540 61.012 -2.472 18986 8019 1 17 . 1 1 635 635 SER CB C 635 60.319 60.319 63.269 -2.950 18986 8020 1 17 . 1 1 635 635 SER H H 635 7.992 7.992 8.050 -0.058 18986 8021 1 17 . 1 1 636 636 LEU N N 636 122.493 122.493 121.494 0.999 18986 8022 1 17 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.137 0.117 18986 8023 1 17 . 1 1 636 636 LEU C C 636 176.194 176.194 178.727 -2.533 18986 8024 1 17 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.877 -3.782 18986 8025 1 17 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.558 -1.852 18986 8026 1 17 . 1 1 636 636 LEU H H 636 8.169 8.169 8.150 0.019 18986 8027 1 17 . 1 1 637 637 ALA N N 637 121.891 121.891 122.598 -0.707 18986 8028 1 17 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.092 -0.003 18986 8029 1 17 . 1 1 637 637 ALA C C 637 175.131 175.131 180.135 -5.004 18986 8030 1 17 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.768 -4.432 18986 8031 1 17 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.291 -2.803 18986 8032 1 17 . 1 1 637 637 ALA H H 637 8.482 8.482 8.588 -0.106 18986 8033 1 17 . 1 1 638 638 VAL N N 638 117.140 117.140 116.811 0.329 18986 8034 1 17 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.896 0.039 18986 8035 1 17 . 1 1 638 638 VAL C C 638 174.712 174.712 176.564 -1.852 18986 8036 1 17 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.414 -2.413 18986 8037 1 17 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.101 -2.750 18986 8038 1 17 . 1 1 638 638 VAL H H 638 7.291 7.291 8.517 -1.226 18986 8039 1 17 . 1 1 639 639 SER N N 639 114.143 114.143 113.962 0.181 18986 8040 1 17 . 1 1 639 639 SER HA H 639 4.481 4.481 4.658 -0.177 18986 8041 1 17 . 1 1 639 639 SER C C 639 172.122 172.122 173.246 -1.124 18986 8042 1 17 . 1 1 639 639 SER CA C 639 56.002 56.002 58.267 -2.265 18986 8043 1 17 . 1 1 639 639 SER CB C 639 60.921 60.921 63.704 -2.783 18986 8044 1 17 . 1 1 639 639 SER H H 639 7.918 7.918 7.952 -0.033 18986 8045 1 17 . 1 1 640 640 SER N N 640 115.370 115.370 116.126 -0.756 18986 8046 1 17 . 1 1 640 640 SER HA H 640 4.711 4.711 4.683 0.028 18986 8047 1 17 . 1 1 640 640 SER C C 640 171.185 171.185 173.881 -2.696 18986 8048 1 17 . 1 1 640 640 SER CA C 640 55.009 55.009 56.997 -1.988 18986 8049 1 17 . 1 1 640 640 SER CB C 640 61.974 61.974 64.587 -2.613 18986 8050 1 17 . 1 1 640 640 SER H H 640 7.765 7.765 7.405 0.360 18986 8051 1 17 . 1 1 641 641 GLU N N 641 119.994 119.994 120.564 -0.570 18986 8052 1 17 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.147 -0.103 18986 8053 1 17 . 1 1 641 641 GLU C C 641 173.167 173.167 176.213 -3.046 18986 8054 1 17 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.026 -2.375 18986 8055 1 17 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.944 -2.460 18986 8056 1 17 . 1 1 641 641 GLU H H 641 8.363 8.363 8.765 -0.402 18986 8057 1 17 . 1 1 642 642 CYS N N 642 110.257 110.257 112.777 -2.520 18986 8058 1 17 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.905 -0.446 18986 8059 1 17 . 1 1 642 642 CYS C C 642 168.058 168.058 172.791 -4.733 18986 8060 1 17 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.984 -6.038 18986 8061 1 17 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.140 10.221 18986 8062 1 17 . 1 1 642 642 CYS H H 642 7.881 7.881 7.717 0.164 18986 8063 1 17 . 1 1 643 643 ALA N N 643 123.922 123.922 123.766 0.156 18986 8064 1 17 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.557 0.081 18986 8065 1 17 . 1 1 643 643 ALA C C 643 172.517 172.517 176.413 -3.896 18986 8066 1 17 . 1 1 643 643 ALA CA C 643 47.620 47.620 50.957 -3.337 18986 8067 1 17 . 1 1 643 643 ALA CB C 643 19.444 19.444 18.650 0.794 18986 8068 1 17 . 1 1 643 643 ALA H H 643 9.787 9.787 9.090 0.697 18986 8069 1 17 . 1 1 644 644 LYS N N 644 128.479 128.479 126.425 2.054 18986 8070 1 17 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.357 0.154 18986 8071 1 17 . 1 1 644 644 LYS C C 644 176.945 176.945 177.777 -0.832 18986 8072 1 17 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.431 -2.093 18986 8073 1 17 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.454 -1.512 18986 8074 1 17 . 1 1 644 644 LYS H H 644 9.809 9.809 8.518 1.291 18986 8075 1 17 . 1 1 645 645 VAL N N 645 124.257 124.257 126.768 -2.511 18986 8076 1 17 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.619 0.029 18986 8077 1 17 . 1 1 645 645 VAL C C 645 173.996 173.996 177.327 -3.331 18986 8078 1 17 . 1 1 645 645 VAL CA C 645 64.862 64.862 67.415 -2.553 18986 8079 1 17 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.399 -2.198 18986 8080 1 17 . 1 1 645 645 VAL H H 645 8.458 8.458 9.051 -0.593 18986 8081 1 17 . 1 1 646 646 LYS N N 646 117.598 117.598 120.365 -2.767 18986 8082 1 17 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.888 0.119 18986 8083 1 17 . 1 1 646 646 LYS C C 646 176.047 176.047 178.484 -2.437 18986 8084 1 17 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.342 -3.097 18986 8085 1 17 . 1 1 646 646 LYS CB C 646 29.398 29.398 32.105 -2.707 18986 8086 1 17 . 1 1 646 646 LYS H H 646 8.706 8.706 8.414 0.292 18986 8087 1 17 . 1 1 647 647 ASP N N 647 119.229 119.229 119.859 -0.630 18986 8088 1 17 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.440 0.178 18986 8089 1 17 . 1 1 647 647 ASP C C 647 175.211 175.211 178.722 -3.511 18986 8090 1 17 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.641 -3.318 18986 8091 1 17 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.484 -1.746 18986 8092 1 17 . 1 1 647 647 ASP H H 647 7.012 7.012 7.857 -0.845 18986 8093 1 17 . 1 1 648 648 ILE N N 648 121.939 121.939 120.706 1.233 18986 8094 1 17 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.558 -0.177 18986 8095 1 17 . 1 1 648 648 ILE C C 648 175.243 175.243 177.853 -2.610 18986 8096 1 17 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.620 -2.579 18986 8097 1 17 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.740 -1.778 18986 8098 1 17 . 1 1 648 648 ILE H H 648 8.152 8.152 7.529 0.623 18986 8099 1 17 . 1 1 649 649 LEU N N 649 117.310 117.310 120.009 -2.699 18986 8100 1 17 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.842 0.031 18986 8101 1 17 . 1 1 649 649 LEU C C 649 176.439 176.439 178.942 -2.503 18986 8102 1 17 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.516 -2.631 18986 8103 1 17 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.352 -2.046 18986 8104 1 17 . 1 1 649 649 LEU H H 649 8.638 8.638 8.718 -0.080 18986 8105 1 17 . 1 1 650 650 LYS N N 650 118.810 118.810 119.621 -0.811 18986 8106 1 17 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.919 0.127 18986 8107 1 17 . 1 1 650 650 LYS C C 650 176.801 176.801 178.903 -2.102 18986 8108 1 17 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.723 -2.672 18986 8109 1 17 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.140 -2.076 18986 8110 1 17 . 1 1 650 650 LYS H H 650 7.296 7.296 7.916 -0.620 18986 8111 1 17 . 1 1 651 651 GLU N N 651 117.713 117.713 119.287 -1.574 18986 8112 1 17 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.064 0.044 18986 8113 1 17 . 1 1 651 651 GLU C C 651 176.903 176.903 178.903 -2.000 18986 8114 1 17 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.360 -3.550 18986 8115 1 17 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.685 -2.237 18986 8116 1 17 . 1 1 651 651 GLU H H 651 8.036 8.036 8.165 -0.129 18986 8117 1 17 . 1 1 652 652 ALA N N 652 121.206 121.206 121.209 -0.003 18986 8118 1 17 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.128 -0.130 18986 8119 1 17 . 1 1 652 652 ALA C C 652 176.766 176.766 179.958 -3.192 18986 8120 1 17 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.069 -3.336 18986 8121 1 17 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.302 -2.986 18986 8122 1 17 . 1 1 652 652 ALA H H 652 8.973 8.973 8.536 0.437 18986 8123 1 17 . 1 1 653 653 GLN N N 653 117.768 117.768 118.059 -0.291 18986 8124 1 17 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.349 0.128 18986 8125 1 17 . 1 1 653 653 GLN C C 653 177.388 177.388 178.930 -1.542 18986 8126 1 17 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.779 -2.719 18986 8127 1 17 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.582 -1.813 18986 8128 1 17 . 1 1 653 653 GLN H H 653 8.059 8.059 8.276 -0.217 18986 8129 1 17 . 1 1 654 654 GLN N N 654 117.979 117.979 118.507 -0.528 18986 8130 1 17 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.155 0.022 18986 8131 1 17 . 1 1 654 654 GLN C C 654 174.834 174.834 178.345 -3.511 18986 8132 1 17 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.268 -2.850 18986 8133 1 17 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.585 -2.608 18986 8134 1 17 . 1 1 654 654 GLN H H 654 7.495 7.495 7.954 -0.459 18986 8135 1 17 . 1 1 655 655 VAL N N 655 110.080 110.080 113.530 -3.450 18986 8136 1 17 . 1 1 655 655 VAL HA H 655 4.527 4.527 4.082 0.445 18986 8137 1 17 . 1 1 655 655 VAL C C 655 173.369 173.369 176.964 -3.595 18986 8138 1 17 . 1 1 655 655 VAL CA C 655 58.067 58.067 63.620 -5.553 18986 8139 1 17 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.084 -3.900 18986 8140 1 17 . 1 1 655 655 VAL H H 655 7.197 7.197 8.067 -0.870 18986 8141 1 17 . 1 1 656 656 GLY N N 656 107.089 107.089 107.578 -0.489 18986 8142 1 17 . 1 1 656 656 GLY C C 656 171.639 171.639 174.357 -2.718 18986 8143 1 17 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.847 -1.536 18986 8144 1 17 . 1 1 656 656 GLY H H 656 7.541 7.541 7.961 -0.420 18986 8145 1 17 . 1 1 657 657 ILE N N 657 121.266 121.266 121.365 -0.099 18986 8146 1 17 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.167 -0.033 18986 8147 1 17 . 1 1 657 657 ILE C C 657 171.885 171.885 175.514 -3.629 18986 8148 1 17 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.440 -3.210 18986 8149 1 17 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.164 -3.974 18986 8150 1 17 . 1 1 657 657 ILE H H 657 7.633 7.633 8.508 -0.875 18986 8151 1 17 . 1 1 658 658 GLU N N 658 127.252 127.252 123.361 3.891 18986 8152 1 17 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.782 -0.579 18986 8153 1 17 . 1 1 658 658 GLU C C 658 175.316 175.316 177.959 -2.643 18986 8154 1 17 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.428 -1.068 18986 8155 1 17 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.575 -3.965 18986 8156 1 17 . 1 1 658 658 GLU H H 658 8.690 8.690 8.331 0.359 18986 8157 1 17 . 1 1 659 659 LYS N N 659 124.533 124.533 126.013 -1.480 18986 8158 1 17 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.885 -0.097 18986 8159 1 17 . 1 1 659 659 LYS C C 659 175.170 175.170 178.495 -3.325 18986 8160 1 17 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.024 -1.853 18986 8161 1 17 . 1 1 659 659 LYS CB C 659 30.117 30.117 32.023 -1.906 18986 8162 1 17 . 1 1 659 659 LYS H H 659 8.706 8.706 9.345 -0.639 18986 8163 1 17 . 1 1 660 660 SER N N 660 113.137 113.137 114.996 -1.859 18986 8164 1 17 . 1 1 660 660 SER HA H 660 4.273 4.273 4.290 -0.017 18986 8165 1 17 . 1 1 660 660 SER C C 660 173.939 173.939 176.515 -2.576 18986 8166 1 17 . 1 1 660 660 SER CA C 660 58.350 58.350 60.547 -2.197 18986 8167 1 17 . 1 1 660 660 SER CB C 660 59.504 59.504 62.799 -3.295 18986 8168 1 17 . 1 1 660 660 SER H H 660 8.777 8.777 8.602 0.175 18986 8169 1 17 . 1 1 661 661 ASN N N 661 119.986 119.986 120.180 -0.194 18986 8170 1 17 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.454 0.252 18986 8171 1 17 . 1 1 661 661 ASN C C 661 174.516 174.516 177.776 -3.260 18986 8172 1 17 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.651 -4.604 18986 8173 1 17 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.575 -1.832 18986 8174 1 17 . 1 1 661 661 ASN H H 661 7.486 7.486 8.839 -1.353 18986 8175 1 17 . 1 1 662 662 ILE N N 662 120.639 120.639 120.709 -0.070 18986 8176 1 17 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.733 -0.287 18986 8177 1 17 . 1 1 662 662 ILE C C 662 174.252 174.252 177.590 -3.338 18986 8178 1 17 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.211 -2.605 18986 8179 1 17 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.977 -3.554 18986 8180 1 17 . 1 1 662 662 ILE H H 662 7.999 7.999 8.141 -0.142 18986 8181 1 17 . 1 1 663 663 GLU N N 663 117.706 117.706 120.749 -3.043 18986 8182 1 17 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.931 -0.141 18986 8183 1 17 . 1 1 663 663 GLU C C 663 176.509 176.509 178.994 -2.485 18986 8184 1 17 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.505 -2.797 18986 8185 1 17 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.519 -2.764 18986 8186 1 17 . 1 1 663 663 GLU H H 663 8.190 8.190 8.341 -0.151 18986 8187 1 17 . 1 1 664 664 LYS N N 664 119.586 119.586 120.304 -0.718 18986 8188 1 17 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.142 -0.089 18986 8189 1 17 . 1 1 664 664 LYS C C 664 175.941 175.941 178.819 -2.878 18986 8190 1 17 . 1 1 664 664 LYS CA C 664 56.581 56.581 58.897 -2.316 18986 8191 1 17 . 1 1 664 664 LYS CB C 664 29.823 29.823 31.755 -1.932 18986 8192 1 17 . 1 1 664 664 LYS H H 664 7.590 7.590 8.546 -0.956 18986 8193 1 17 . 1 1 665 665 LEU N N 665 119.756 119.756 121.314 -1.558 18986 8194 1 17 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.016 0.064 18986 8195 1 17 . 1 1 665 665 LEU C C 665 176.700 176.700 178.743 -2.043 18986 8196 1 17 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.999 -2.614 18986 8197 1 17 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.805 -2.613 18986 8198 1 17 . 1 1 665 665 LEU H H 665 8.075 8.075 8.093 -0.018 18986 8199 1 17 . 1 1 666 666 LEU N N 666 118.788 118.788 119.157 -0.369 18986 8200 1 17 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.617 0.147 18986 8201 1 17 . 1 1 666 666 LEU C C 666 176.484 176.484 178.855 -2.371 18986 8202 1 17 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.378 -2.720 18986 8203 1 17 . 1 1 666 666 LEU CB C 666 38.611 38.611 41.150 -2.539 18986 8204 1 17 . 1 1 666 666 LEU H H 666 8.550 8.550 8.665 -0.115 18986 8205 1 17 . 1 1 667 667 THR N N 667 115.244 115.244 115.959 -0.715 18986 8206 1 17 . 1 1 667 667 THR HA H 667 3.839 3.839 3.889 -0.050 18986 8207 1 17 . 1 1 667 667 THR C C 667 173.740 173.740 176.067 -2.327 18986 8208 1 17 . 1 1 667 667 THR CA C 667 64.378 64.378 67.694 -3.316 18986 8209 1 17 . 1 1 667 667 THR CB C 667 65.748 65.748 68.441 -2.693 18986 8210 1 17 . 1 1 667 667 THR H H 667 7.662 7.662 8.072 -0.410 18986 8211 1 17 . 1 1 668 668 ASP N N 668 122.862 122.862 122.444 0.418 18986 8212 1 17 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.305 0.078 18986 8213 1 17 . 1 1 668 668 ASP C C 668 177.192 177.192 178.405 -1.213 18986 8214 1 17 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.508 -2.377 18986 8215 1 17 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.971 -3.084 18986 8216 1 17 . 1 1 668 668 ASP H H 668 8.291 8.291 8.212 0.079 18986 8217 1 17 . 1 1 669 669 MET N N 669 119.640 119.640 119.027 0.613 18986 8218 1 17 . 1 1 669 669 MET HA H 669 3.917 3.917 4.013 -0.096 18986 8219 1 17 . 1 1 669 669 MET C C 669 175.414 175.414 178.597 -3.183 18986 8220 1 17 . 1 1 669 669 MET CA C 669 57.234 57.234 59.621 -2.387 18986 8221 1 17 . 1 1 669 669 MET CB C 669 32.088 32.088 32.423 -0.335 18986 8222 1 17 . 1 1 669 669 MET H H 669 8.809 8.809 8.309 0.500 18986 8223 1 17 . 1 1 670 670 ARG N N 670 122.614 122.614 118.166 4.448 18986 8224 1 17 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.590 -0.073 18986 8225 1 17 . 1 1 670 670 ARG C C 670 177.928 177.928 178.993 -1.065 18986 8226 1 17 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.388 -2.166 18986 8227 1 17 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.850 -2.546 18986 8228 1 17 . 1 1 670 670 ARG H H 670 8.450 8.450 8.484 -0.034 18986 8229 1 17 . 1 1 671 671 LYS N N 671 121.976 121.976 119.672 2.304 18986 8230 1 17 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.179 -0.066 18986 8231 1 17 . 1 1 671 671 LYS C C 671 176.143 176.143 178.266 -2.123 18986 8232 1 17 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.524 -1.438 18986 8233 1 17 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.644 -3.140 18986 8234 1 17 . 1 1 671 671 LYS H H 671 8.609 8.609 8.176 0.433 18986 8235 1 17 . 1 1 672 672 SER N N 672 111.655 111.655 112.847 -1.192 18986 8236 1 17 . 1 1 672 672 SER HA H 672 4.469 4.469 4.430 0.039 18986 8237 1 17 . 1 1 672 672 SER C C 672 171.692 171.692 175.317 -3.625 18986 8238 1 17 . 1 1 672 672 SER CA C 672 56.790 56.790 58.781 -1.991 18986 8239 1 17 . 1 1 672 672 SER CB C 672 61.343 61.343 64.082 -2.739 18986 8240 1 17 . 1 1 672 672 SER H H 672 7.884 7.884 7.944 -0.061 18986 8241 1 17 . 1 1 673 673 GLY N N 673 108.029 108.029 108.841 -0.812 18986 8242 1 17 . 1 1 673 673 GLY C C 673 171.492 171.492 174.709 -3.217 18986 8243 1 17 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.602 -2.327 18986 8244 1 17 . 1 1 673 673 GLY H H 673 7.774 7.774 8.046 -0.272 18986 8245 1 17 . 1 1 674 674 ILE N N 674 116.193 116.193 119.109 -2.916 18986 8246 1 17 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.085 0.016 18986 8247 1 17 . 1 1 674 674 ILE C C 674 173.980 173.980 175.936 -1.956 18986 8248 1 17 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.030 -2.788 18986 8249 1 17 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.878 -2.074 18986 8250 1 17 . 1 1 674 674 ILE H H 674 8.026 8.026 8.294 -0.268 18986 8251 1 17 . 1 1 675 675 ILE N N 675 108.928 108.928 113.655 -4.727 18986 8252 1 17 . 1 1 675 675 ILE HA H 675 5.358 5.358 5.082 0.276 18986 8253 1 17 . 1 1 675 675 ILE C C 675 170.797 170.797 174.005 -3.208 18986 8254 1 17 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.764 -2.740 18986 8255 1 17 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.299 -2.813 18986 8256 1 17 . 1 1 675 675 ILE H H 675 7.120 7.120 7.380 -0.260 18986 8257 1 17 . 1 1 676 676 TYR N N 676 118.062 118.062 115.849 2.213 18986 8258 1 17 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.118 -0.123 18986 8259 1 17 . 1 1 676 676 TYR C C 676 170.020 170.020 173.649 -3.629 18986 8260 1 17 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.940 -3.047 18986 8261 1 17 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.240 -2.724 18986 8262 1 17 . 1 1 676 676 TYR H H 676 9.380 9.380 9.103 0.277 18986 8263 1 17 . 1 1 677 677 GLU N N 677 123.578 123.578 122.916 0.662 18986 8264 1 17 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.781 0.045 18986 8265 1 17 . 1 1 677 677 GLU C C 677 172.146 172.146 175.637 -3.491 18986 8266 1 17 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.011 -2.535 18986 8267 1 17 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.314 -1.702 18986 8268 1 17 . 1 1 677 677 GLU H H 677 8.951 8.951 9.125 -0.174 18986 8269 1 17 . 1 1 678 678 ALA N N 678 133.220 133.220 127.782 5.438 18986 8270 1 17 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.193 -0.152 18986 8271 1 17 . 1 1 678 678 ALA C C 678 175.219 175.219 177.874 -2.655 18986 8272 1 17 . 1 1 678 678 ALA CA C 678 51.601 51.601 54.034 -2.433 18986 8273 1 17 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.022 -2.423 18986 8274 1 17 . 1 1 678 678 ALA H H 678 7.912 7.912 7.835 0.078 18986 8275 1 17 . 1 1 679 679 LYS N N 679 115.687 115.687 116.954 -1.267 18986 8276 1 17 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.720 -0.285 18986 8277 1 17 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.931 -1.915 18986 8278 1 17 . 1 1 679 679 LYS CB C 679 30.995 30.995 33.887 -2.892 18986 8279 1 17 . 1 1 679 679 LYS H H 679 8.215 8.215 7.673 0.542 18986 8280 1 17 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.276 -0.257 18986 8281 1 17 . 1 1 680 680 PRO C C 680 174.504 174.504 177.829 -3.325 18986 8282 1 17 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.765 -1.247 18986 8283 1 17 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.848 -3.533 18986 8284 1 17 . 1 1 681 681 GLU N N 681 118.851 118.851 120.607 -1.756 18986 8285 1 17 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.766 -0.328 18986 8286 1 17 . 1 1 681 681 GLU C C 681 172.890 172.890 175.100 -2.210 18986 8287 1 17 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.144 -3.663 18986 8288 1 17 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.331 -4.542 18986 8289 1 17 . 1 1 681 681 GLU H H 681 10.003 10.003 9.541 0.462 18986 8290 1 17 . 1 1 682 682 CYS N N 682 120.934 120.934 116.939 3.995 18986 8291 1 17 . 1 1 682 682 CYS HA H 682 5.027 5.027 4.999 0.028 18986 8292 1 17 . 1 1 682 682 CYS C C 682 171.905 171.905 173.722 -1.817 18986 8293 1 17 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.876 -3.632 18986 8294 1 17 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.813 16.482 18986 8295 1 17 . 1 1 682 682 CYS H H 682 7.860 7.860 8.071 -0.211 18986 8296 1 17 . 1 1 683 683 TYR N N 683 126.183 126.183 124.449 1.734 18986 8297 1 17 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.124 0.100 18986 8298 1 17 . 1 1 683 683 TYR C C 683 173.008 173.008 175.704 -2.696 18986 8299 1 17 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.913 -1.345 18986 8300 1 17 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.790 0.162 18986 8301 1 17 . 1 1 683 683 TYR H H 683 9.297 9.297 9.130 0.167 18986 8302 1 17 . 1 1 684 684 LYS N N 684 118.604 118.604 117.489 1.115 18986 8303 1 17 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.657 -0.220 18986 8304 1 17 . 1 1 684 684 LYS C C 684 171.628 171.628 174.917 -3.289 18986 8305 1 17 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.390 -1.087 18986 8306 1 17 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.715 -2.038 18986 8307 1 17 . 1 1 684 684 LYS H H 684 8.630 8.630 8.658 -0.028 18986 8308 1 17 . 1 1 685 685 LYS N N 685 122.869 122.869 123.263 -0.394 18986 8309 1 17 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.253 0.391 18986 8310 1 17 . 1 1 685 685 LYS C C 685 173.337 173.337 176.310 -2.973 18986 8311 1 17 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.108 -2.855 18986 8312 1 17 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.863 -1.936 18986 8313 1 17 . 1 1 685 685 LYS H H 685 8.969 8.969 8.537 0.432 18986 8314 1 18 . 1 1 601 601 SER HA H 601 4.475 4.475 4.838 -0.363 18986 8315 1 18 . 1 1 601 601 SER CA C 601 55.508 55.508 57.808 -2.300 18986 8316 1 18 . 1 1 601 601 SER CB C 601 61.220 61.220 65.058 -3.838 18986 8317 1 18 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.653 -0.037 18986 8318 1 18 . 1 1 602 602 HIS C C 602 172.320 172.320 174.193 -1.873 18986 8319 1 18 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.787 -2.933 18986 8320 1 18 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.307 -2.224 18986 8321 1 18 . 1 1 603 603 MET N N 603 121.862 121.862 114.607 7.255 18986 8322 1 18 . 1 1 603 603 MET HA H 603 4.425 4.425 4.799 -0.374 18986 8323 1 18 . 1 1 603 603 MET C C 603 173.948 173.948 174.552 -0.604 18986 8324 1 18 . 1 1 603 603 MET CA C 603 53.108 53.108 54.980 -1.872 18986 8325 1 18 . 1 1 603 603 MET CB C 603 30.049 30.049 36.140 -6.091 18986 8326 1 18 . 1 1 603 603 MET H H 603 8.394 8.394 7.928 0.466 18986 8327 1 18 . 1 1 604 604 GLY N N 604 110.382 110.382 107.857 2.525 18986 8328 1 18 . 1 1 604 604 GLY C C 604 171.590 171.590 172.769 -1.179 18986 8329 1 18 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.671 -2.054 18986 8330 1 18 . 1 1 604 604 GLY H H 604 8.411 8.411 8.748 -0.337 18986 8331 1 18 . 1 1 605 605 GLU N N 605 120.709 120.709 119.315 1.394 18986 8332 1 18 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.692 -0.385 18986 8333 1 18 . 1 1 605 605 GLU C C 605 174.220 174.220 175.685 -1.465 18986 8334 1 18 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.775 -1.809 18986 8335 1 18 . 1 1 605 605 GLU CB C 605 27.611 27.611 32.616 -5.005 18986 8336 1 18 . 1 1 605 605 GLU H H 605 8.282 8.282 8.731 -0.449 18986 8337 1 18 . 1 1 606 606 SER N N 606 116.679 116.679 115.818 0.861 18986 8338 1 18 . 1 1 606 606 SER HA H 606 4.405 4.405 4.766 -0.361 18986 8339 1 18 . 1 1 606 606 SER C C 606 172.455 172.455 174.275 -1.820 18986 8340 1 18 . 1 1 606 606 SER CA C 606 56.028 56.028 57.574 -1.546 18986 8341 1 18 . 1 1 606 606 SER CB C 606 61.039 61.039 64.022 -2.983 18986 8342 1 18 . 1 1 606 606 SER H H 606 8.420 8.420 8.637 -0.217 18986 8343 1 18 . 1 1 607 607 GLY N N 607 110.716 110.716 109.115 1.601 18986 8344 1 18 . 1 1 607 607 GLY C C 607 171.173 171.173 173.322 -2.149 18986 8345 1 18 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.872 -2.231 18986 8346 1 18 . 1 1 607 607 GLY H H 607 8.386 8.386 8.305 0.081 18986 8347 1 18 . 1 1 608 608 LYS N N 608 120.785 120.785 118.583 2.202 18986 8348 1 18 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.221 0.118 18986 8349 1 18 . 1 1 608 608 LYS C C 608 173.673 173.673 175.326 -1.653 18986 8350 1 18 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.284 -2.919 18986 8351 1 18 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.452 -1.921 18986 8352 1 18 . 1 1 608 608 LYS H H 608 8.008 8.008 8.002 0.006 18986 8353 1 18 . 1 1 609 609 ILE N N 609 122.404 122.404 124.296 -1.892 18986 8354 1 18 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.236 -0.087 18986 8355 1 18 . 1 1 609 609 ILE C C 609 172.675 172.675 174.535 -1.860 18986 8356 1 18 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.601 -2.598 18986 8357 1 18 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.135 -2.931 18986 8358 1 18 . 1 1 609 609 ILE H H 609 8.186 8.186 8.191 -0.005 18986 8359 1 18 . 1 1 610 610 ASP N N 610 125.357 125.357 123.245 2.112 18986 8360 1 18 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.824 -0.121 18986 8361 1 18 . 1 1 610 610 ASP C C 610 173.668 173.668 175.367 -1.699 18986 8362 1 18 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.435 -2.733 18986 8363 1 18 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.699 -4.008 18986 8364 1 18 . 1 1 610 610 ASP H H 610 8.369 8.369 8.001 0.368 18986 8365 1 18 . 1 1 611 611 ILE N N 611 122.494 122.494 120.233 2.261 18986 8366 1 18 . 1 1 611 611 ILE HA H 611 3.909 3.909 3.901 0.008 18986 8367 1 18 . 1 1 611 611 ILE C C 611 173.618 173.618 177.225 -3.607 18986 8368 1 18 . 1 1 611 611 ILE CA C 611 60.040 60.040 64.228 -4.188 18986 8369 1 18 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.225 -2.427 18986 8370 1 18 . 1 1 611 611 ILE H H 611 8.284 8.284 8.302 -0.018 18986 8371 1 18 . 1 1 612 612 ASP N N 612 121.440 121.440 119.544 1.896 18986 8372 1 18 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.386 0.048 18986 8373 1 18 . 1 1 612 612 ASP C C 612 175.129 175.129 178.406 -3.277 18986 8374 1 18 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.299 -4.533 18986 8375 1 18 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.622 -1.484 18986 8376 1 18 . 1 1 612 612 ASP H H 612 8.279 8.279 8.474 -0.195 18986 8377 1 18 . 1 1 613 613 THR N N 613 114.422 114.422 114.027 0.395 18986 8378 1 18 . 1 1 613 613 THR HA H 613 4.106 4.106 4.017 0.089 18986 8379 1 18 . 1 1 613 613 THR C C 613 173.338 173.338 175.710 -2.372 18986 8380 1 18 . 1 1 613 613 THR CA C 613 61.545 61.545 65.930 -4.385 18986 8381 1 18 . 1 1 613 613 THR CB C 613 66.267 66.267 68.620 -2.353 18986 8382 1 18 . 1 1 613 613 THR H H 613 7.866 7.866 8.404 -0.538 18986 8383 1 18 . 1 1 614 614 ILE N N 614 121.654 121.654 118.929 2.725 18986 8384 1 18 . 1 1 614 614 ILE HA H 614 4.029 4.029 3.921 0.108 18986 8385 1 18 . 1 1 614 614 ILE C C 614 174.471 174.471 177.713 -3.242 18986 8386 1 18 . 1 1 614 614 ILE CA C 614 60.173 60.173 64.188 -4.015 18986 8387 1 18 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.534 -2.719 18986 8388 1 18 . 1 1 614 614 ILE H H 614 7.819 7.819 7.375 0.444 18986 8389 1 18 . 1 1 615 615 MET N N 615 119.713 119.713 118.509 1.204 18986 8390 1 18 . 1 1 615 615 MET HA H 615 4.478 4.478 4.503 -0.025 18986 8391 1 18 . 1 1 615 615 MET C C 615 174.075 174.075 178.430 -4.355 18986 8392 1 18 . 1 1 615 615 MET CA C 615 52.764 52.764 57.717 -4.953 18986 8393 1 18 . 1 1 615 615 MET CB C 615 29.337 29.337 31.729 -2.392 18986 8394 1 18 . 1 1 615 615 MET H H 615 8.188 8.188 8.473 -0.285 18986 8395 1 18 . 1 1 616 616 THR N N 616 114.770 114.770 114.866 -0.096 18986 8396 1 18 . 1 1 616 616 THR HA H 616 4.099 4.099 4.136 -0.037 18986 8397 1 18 . 1 1 616 616 THR C C 616 172.535 172.535 176.444 -3.909 18986 8398 1 18 . 1 1 616 616 THR CA C 616 61.112 61.112 66.077 -4.965 18986 8399 1 18 . 1 1 616 616 THR CB C 616 66.617 66.617 68.772 -2.155 18986 8400 1 18 . 1 1 616 616 THR H H 616 7.722 7.722 8.609 -0.887 18986 8401 1 18 . 1 1 617 617 GLY N N 617 111.384 111.384 108.133 3.251 18986 8402 1 18 . 1 1 617 617 GLY C C 617 171.437 171.437 174.459 -3.022 18986 8403 1 18 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.197 -2.755 18986 8404 1 18 . 1 1 617 617 GLY H H 617 8.431 8.431 7.710 0.721 18986 8405 1 18 . 1 1 618 618 LYS N N 618 120.996 120.996 121.799 -0.803 18986 8406 1 18 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.880 -0.213 18986 8407 1 18 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.119 -1.291 18986 8408 1 18 . 1 1 618 618 LYS CB C 618 29.477 29.477 32.181 -2.704 18986 8409 1 18 . 1 1 618 618 LYS H H 618 7.821 7.821 7.929 -0.108 18986 8410 1 18 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.126 0.343 18986 8411 1 18 . 1 1 619 619 PRO C C 619 174.453 174.453 176.927 -2.474 18986 8412 1 18 . 1 1 619 619 PRO CA C 619 60.192 60.192 65.256 -5.064 18986 8413 1 18 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.314 -2.734 18986 8414 1 18 . 1 1 620 620 LYS N N 620 123.464 123.464 117.513 5.951 18986 8415 1 18 . 1 1 620 620 LYS HA H 620 4.046 4.046 4.352 -0.306 18986 8416 1 18 . 1 1 620 620 LYS C C 620 174.895 174.895 178.179 -3.284 18986 8417 1 18 . 1 1 620 620 LYS CA C 620 56.289 56.289 55.487 0.802 18986 8418 1 18 . 1 1 620 620 LYS CB C 620 30.454 30.454 33.349 -2.895 18986 8419 1 18 . 1 1 620 620 LYS H H 620 8.728 8.728 7.576 1.152 18986 8420 1 18 . 1 1 621 621 SER N N 621 113.921 113.921 115.754 -1.833 18986 8421 1 18 . 1 1 621 621 SER HA H 621 4.336 4.336 4.277 0.059 18986 8422 1 18 . 1 1 621 621 SER C C 621 173.149 173.149 176.371 -3.222 18986 8423 1 18 . 1 1 621 621 SER CA C 621 56.691 56.691 61.293 -4.602 18986 8424 1 18 . 1 1 621 621 SER CB C 621 60.689 60.689 62.451 -1.762 18986 8425 1 18 . 1 1 621 621 SER H H 621 8.531 8.531 8.645 -0.114 18986 8426 1 18 . 1 1 622 622 ALA N N 622 124.177 124.177 124.548 -0.371 18986 8427 1 18 . 1 1 622 622 ALA HA H 622 4.168 4.168 4.021 0.147 18986 8428 1 18 . 1 1 622 622 ALA C C 622 176.804 176.804 179.348 -2.544 18986 8429 1 18 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.223 -2.855 18986 8430 1 18 . 1 1 622 622 ALA CB C 622 15.854 15.854 17.805 -1.951 18986 8431 1 18 . 1 1 622 622 ALA H H 622 7.835 7.835 8.368 -0.533 18986 8432 1 18 . 1 1 623 623 ARG N N 623 118.263 118.263 119.513 -1.250 18986 8433 1 18 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.019 -0.069 18986 8434 1 18 . 1 1 623 623 ARG C C 623 175.683 175.683 178.425 -2.742 18986 8435 1 18 . 1 1 623 623 ARG CA C 623 57.163 57.163 58.917 -1.754 18986 8436 1 18 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.391 -1.940 18986 8437 1 18 . 1 1 623 623 ARG H H 623 8.148 8.148 7.997 0.151 18986 8438 1 18 . 1 1 624 624 GLU N N 624 117.953 117.953 120.590 -2.637 18986 8439 1 18 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.035 -0.067 18986 8440 1 18 . 1 1 624 624 GLU C C 624 177.204 177.204 178.777 -1.573 18986 8441 1 18 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.690 -2.833 18986 8442 1 18 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.384 -2.417 18986 8443 1 18 . 1 1 624 624 GLU H H 624 8.143 8.143 8.362 -0.219 18986 8444 1 18 . 1 1 625 625 LYS N N 625 119.222 119.222 118.888 0.334 18986 8445 1 18 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.157 -0.300 18986 8446 1 18 . 1 1 625 625 LYS C C 625 175.480 175.480 179.214 -3.734 18986 8447 1 18 . 1 1 625 625 LYS CA C 625 57.487 57.487 59.118 -1.631 18986 8448 1 18 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.712 -2.049 18986 8449 1 18 . 1 1 625 625 LYS H H 625 7.772 7.772 7.935 -0.163 18986 8450 1 18 . 1 1 626 626 MET N N 626 117.883 117.883 119.674 -1.791 18986 8451 1 18 . 1 1 626 626 MET HA H 626 3.807 3.807 4.038 -0.231 18986 8452 1 18 . 1 1 626 626 MET C C 626 175.278 175.278 178.448 -3.170 18986 8453 1 18 . 1 1 626 626 MET CA C 626 57.782 57.782 59.588 -1.806 18986 8454 1 18 . 1 1 626 626 MET CB C 626 30.657 30.657 32.746 -2.089 18986 8455 1 18 . 1 1 626 626 MET H H 626 8.367 8.367 8.403 -0.036 18986 8456 1 18 . 1 1 627 627 MET N N 627 116.185 116.185 117.719 -1.534 18986 8457 1 18 . 1 1 627 627 MET HA H 627 4.152 4.152 4.112 0.040 18986 8458 1 18 . 1 1 627 627 MET C C 627 176.393 176.393 178.349 -1.956 18986 8459 1 18 . 1 1 627 627 MET CA C 627 55.359 55.359 57.572 -2.213 18986 8460 1 18 . 1 1 627 627 MET CB C 627 28.803 28.803 30.909 -2.106 18986 8461 1 18 . 1 1 627 627 MET H H 627 8.197 8.197 8.739 -0.542 18986 8462 1 18 . 1 1 628 628 LYS N N 628 119.859 119.859 120.377 -0.518 18986 8463 1 18 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.260 -0.060 18986 8464 1 18 . 1 1 628 628 LYS C C 628 175.885 175.885 179.652 -3.767 18986 8465 1 18 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.359 -4.282 18986 8466 1 18 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.325 -3.794 18986 8467 1 18 . 1 1 628 628 LYS H H 628 7.700 7.700 7.572 0.128 18986 8468 1 18 . 1 1 629 629 ILE N N 629 119.001 119.001 120.027 -1.026 18986 8469 1 18 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.645 -0.097 18986 8470 1 18 . 1 1 629 629 ILE C C 629 174.891 174.891 177.954 -3.063 18986 8471 1 18 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.489 -3.224 18986 8472 1 18 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.976 -4.127 18986 8473 1 18 . 1 1 629 629 ILE H H 629 7.970 7.970 8.232 -0.262 18986 8474 1 18 . 1 1 630 630 ILE N N 630 120.737 120.737 117.573 3.164 18986 8475 1 18 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.629 -0.162 18986 8476 1 18 . 1 1 630 630 ILE C C 630 173.875 173.875 177.719 -3.844 18986 8477 1 18 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.827 -2.073 18986 8478 1 18 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.927 -2.650 18986 8479 1 18 . 1 1 630 630 ILE H H 630 8.213 8.213 8.105 0.108 18986 8480 1 18 . 1 1 631 631 GLU N N 631 119.546 119.546 121.835 -2.289 18986 8481 1 18 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.296 -0.231 18986 8482 1 18 . 1 1 631 631 GLU C C 631 177.300 177.300 179.462 -2.162 18986 8483 1 18 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.463 -2.483 18986 8484 1 18 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.670 -2.677 18986 8485 1 18 . 1 1 631 631 GLU H H 631 7.742 7.742 8.304 -0.562 18986 8486 1 18 . 1 1 632 632 ILE N N 632 121.547 121.547 120.736 0.811 18986 8487 1 18 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.651 0.032 18986 8488 1 18 . 1 1 632 632 ILE C C 632 175.454 175.454 178.127 -2.673 18986 8489 1 18 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.633 -2.977 18986 8490 1 18 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.856 -2.026 18986 8491 1 18 . 1 1 632 632 ILE H H 632 8.013 8.013 8.070 -0.057 18986 8492 1 18 . 1 1 633 633 ILE N N 633 121.605 121.605 120.150 1.455 18986 8493 1 18 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.613 -0.278 18986 8494 1 18 . 1 1 633 633 ILE C C 633 174.558 174.558 178.081 -3.523 18986 8495 1 18 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.353 -1.434 18986 8496 1 18 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.269 -1.985 18986 8497 1 18 . 1 1 633 633 ILE H H 633 8.594 8.594 8.124 0.470 18986 8498 1 18 . 1 1 634 634 ASP N N 634 118.706 118.706 120.022 -1.316 18986 8499 1 18 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.324 0.111 18986 8500 1 18 . 1 1 634 634 ASP C C 634 176.574 176.574 178.196 -1.622 18986 8501 1 18 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.472 -2.901 18986 8502 1 18 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.185 -2.271 18986 8503 1 18 . 1 1 634 634 ASP H H 634 8.724 8.724 8.663 0.061 18986 8504 1 18 . 1 1 635 635 SER N N 635 114.064 114.064 114.468 -0.404 18986 8505 1 18 . 1 1 635 635 SER HA H 635 4.232 4.232 4.353 -0.121 18986 8506 1 18 . 1 1 635 635 SER C C 635 174.487 174.487 175.697 -1.210 18986 8507 1 18 . 1 1 635 635 SER CA C 635 58.540 58.540 60.543 -2.003 18986 8508 1 18 . 1 1 635 635 SER CB C 635 60.319 60.319 63.079 -2.760 18986 8509 1 18 . 1 1 635 635 SER H H 635 7.992 7.992 8.023 -0.031 18986 8510 1 18 . 1 1 636 636 LEU N N 636 122.493 122.493 121.007 1.486 18986 8511 1 18 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.447 -0.193 18986 8512 1 18 . 1 1 636 636 LEU C C 636 176.194 176.194 178.422 -2.228 18986 8513 1 18 . 1 1 636 636 LEU CA C 636 54.095 54.095 56.563 -2.468 18986 8514 1 18 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.994 -2.288 18986 8515 1 18 . 1 1 636 636 LEU H H 636 8.169 8.169 8.003 0.166 18986 8516 1 18 . 1 1 637 637 ALA N N 637 121.891 121.891 123.351 -1.460 18986 8517 1 18 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.357 -0.268 18986 8518 1 18 . 1 1 637 637 ALA C C 637 175.131 175.131 180.578 -5.447 18986 8519 1 18 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.432 -4.096 18986 8520 1 18 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.369 -2.881 18986 8521 1 18 . 1 1 637 637 ALA H H 637 8.482 8.482 8.421 0.061 18986 8522 1 18 . 1 1 638 638 VAL N N 638 117.140 117.140 117.887 -0.747 18986 8523 1 18 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.803 0.132 18986 8524 1 18 . 1 1 638 638 VAL C C 638 174.712 174.712 176.005 -1.293 18986 8525 1 18 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.483 -2.482 18986 8526 1 18 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.081 -2.730 18986 8527 1 18 . 1 1 638 638 VAL H H 638 7.291 7.291 8.392 -1.101 18986 8528 1 18 . 1 1 639 639 SER N N 639 114.143 114.143 114.044 0.099 18986 8529 1 18 . 1 1 639 639 SER HA H 639 4.481 4.481 4.702 -0.221 18986 8530 1 18 . 1 1 639 639 SER C C 639 172.122 172.122 173.218 -1.096 18986 8531 1 18 . 1 1 639 639 SER CA C 639 56.002 56.002 58.179 -2.177 18986 8532 1 18 . 1 1 639 639 SER CB C 639 60.921 60.921 64.756 -3.835 18986 8533 1 18 . 1 1 639 639 SER H H 639 7.918 7.918 7.916 0.002 18986 8534 1 18 . 1 1 640 640 SER N N 640 115.370 115.370 116.855 -1.485 18986 8535 1 18 . 1 1 640 640 SER HA H 640 4.711 4.711 4.754 -0.043 18986 8536 1 18 . 1 1 640 640 SER C C 640 171.185 171.185 174.308 -3.123 18986 8537 1 18 . 1 1 640 640 SER CA C 640 55.009 55.009 57.257 -2.248 18986 8538 1 18 . 1 1 640 640 SER CB C 640 61.974 61.974 65.531 -3.557 18986 8539 1 18 . 1 1 640 640 SER H H 640 7.765 7.765 7.559 0.206 18986 8540 1 18 . 1 1 641 641 GLU N N 641 119.994 119.994 121.753 -1.759 18986 8541 1 18 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.125 -0.081 18986 8542 1 18 . 1 1 641 641 GLU C C 641 173.167 173.167 175.796 -2.629 18986 8543 1 18 . 1 1 641 641 GLU CA C 641 56.651 56.651 59.000 -2.349 18986 8544 1 18 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.930 -2.446 18986 8545 1 18 . 1 1 641 641 GLU H H 641 8.363 8.363 8.877 -0.514 18986 8546 1 18 . 1 1 642 642 CYS N N 642 110.257 110.257 115.311 -5.054 18986 8547 1 18 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.636 -0.177 18986 8548 1 18 . 1 1 642 642 CYS C C 642 168.058 168.058 173.584 -5.526 18986 8549 1 18 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.220 -5.274 18986 8550 1 18 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.647 9.714 18986 8551 1 18 . 1 1 642 642 CYS H H 642 7.881 7.881 7.564 0.317 18986 8552 1 18 . 1 1 643 643 ALA N N 643 123.922 123.922 124.375 -0.453 18986 8553 1 18 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.337 0.301 18986 8554 1 18 . 1 1 643 643 ALA C C 643 172.517 172.517 176.399 -3.882 18986 8555 1 18 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.901 -4.281 18986 8556 1 18 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.997 -0.553 18986 8557 1 18 . 1 1 643 643 ALA H H 643 9.787 9.787 9.030 0.757 18986 8558 1 18 . 1 1 644 644 LYS N N 644 128.479 128.479 121.830 6.649 18986 8559 1 18 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.379 0.132 18986 8560 1 18 . 1 1 644 644 LYS C C 644 176.945 176.945 177.871 -0.926 18986 8561 1 18 . 1 1 644 644 LYS CA C 644 54.338 54.338 55.870 -1.532 18986 8562 1 18 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.871 -1.929 18986 8563 1 18 . 1 1 644 644 LYS H H 644 9.809 9.809 8.500 1.309 18986 8564 1 18 . 1 1 645 645 VAL N N 645 124.257 124.257 127.185 -2.928 18986 8565 1 18 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.751 -0.103 18986 8566 1 18 . 1 1 645 645 VAL C C 645 173.996 173.996 176.796 -2.800 18986 8567 1 18 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.228 -1.366 18986 8568 1 18 . 1 1 645 645 VAL CB C 645 29.201 29.201 32.372 -3.171 18986 8569 1 18 . 1 1 645 645 VAL H H 645 8.458 8.458 8.804 -0.346 18986 8570 1 18 . 1 1 646 646 LYS N N 646 117.598 117.598 118.598 -1.000 18986 8571 1 18 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.930 0.077 18986 8572 1 18 . 1 1 646 646 LYS C C 646 176.047 176.047 178.349 -2.302 18986 8573 1 18 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.280 -3.035 18986 8574 1 18 . 1 1 646 646 LYS CB C 646 29.398 29.398 32.028 -2.630 18986 8575 1 18 . 1 1 646 646 LYS H H 646 8.706 8.706 8.326 0.380 18986 8576 1 18 . 1 1 647 647 ASP N N 647 119.229 119.229 119.849 -0.620 18986 8577 1 18 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.458 0.160 18986 8578 1 18 . 1 1 647 647 ASP C C 647 175.211 175.211 178.232 -3.021 18986 8579 1 18 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.278 -2.954 18986 8580 1 18 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.796 -2.058 18986 8581 1 18 . 1 1 647 647 ASP H H 647 7.012 7.012 7.764 -0.752 18986 8582 1 18 . 1 1 648 648 ILE N N 648 121.939 121.939 120.051 1.888 18986 8583 1 18 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.604 -0.223 18986 8584 1 18 . 1 1 648 648 ILE C C 648 175.243 175.243 177.823 -2.580 18986 8585 1 18 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.725 -2.683 18986 8586 1 18 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.998 -2.036 18986 8587 1 18 . 1 1 648 648 ILE H H 648 8.152 8.152 7.837 0.315 18986 8588 1 18 . 1 1 649 649 LEU N N 649 117.310 117.310 120.265 -2.955 18986 8589 1 18 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.767 0.106 18986 8590 1 18 . 1 1 649 649 LEU C C 649 176.439 176.439 178.671 -2.232 18986 8591 1 18 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.642 -2.757 18986 8592 1 18 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.373 -2.067 18986 8593 1 18 . 1 1 649 649 LEU H H 649 8.638 8.638 8.544 0.094 18986 8594 1 18 . 1 1 650 650 LYS N N 650 118.810 118.810 119.800 -0.990 18986 8595 1 18 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.824 0.222 18986 8596 1 18 . 1 1 650 650 LYS C C 650 176.801 176.801 178.900 -2.099 18986 8597 1 18 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.898 -2.847 18986 8598 1 18 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.272 -2.208 18986 8599 1 18 . 1 1 650 650 LYS H H 650 7.296 7.296 7.901 -0.605 18986 8600 1 18 . 1 1 651 651 GLU N N 651 117.713 117.713 118.272 -0.559 18986 8601 1 18 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.112 -0.004 18986 8602 1 18 . 1 1 651 651 GLU C C 651 176.903 176.903 179.168 -2.265 18986 8603 1 18 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.702 -2.892 18986 8604 1 18 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.249 -1.801 18986 8605 1 18 . 1 1 651 651 GLU H H 651 8.036 8.036 8.371 -0.335 18986 8606 1 18 . 1 1 652 652 ALA N N 652 121.206 121.206 122.522 -1.316 18986 8607 1 18 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.069 -0.071 18986 8608 1 18 . 1 1 652 652 ALA C C 652 176.766 176.766 179.908 -3.142 18986 8609 1 18 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.191 -3.457 18986 8610 1 18 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.184 -2.868 18986 8611 1 18 . 1 1 652 652 ALA H H 652 8.973 8.973 8.566 0.407 18986 8612 1 18 . 1 1 653 653 GLN N N 653 117.768 117.768 118.423 -0.655 18986 8613 1 18 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.223 0.254 18986 8614 1 18 . 1 1 653 653 GLN C C 653 177.388 177.388 178.873 -1.485 18986 8615 1 18 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.517 -2.457 18986 8616 1 18 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.799 -2.030 18986 8617 1 18 . 1 1 653 653 GLN H H 653 8.059 8.059 8.319 -0.260 18986 8618 1 18 . 1 1 654 654 GLN N N 654 117.979 117.979 118.836 -0.857 18986 8619 1 18 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.039 0.138 18986 8620 1 18 . 1 1 654 654 GLN C C 654 174.834 174.834 178.191 -3.357 18986 8621 1 18 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.530 -3.112 18986 8622 1 18 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.692 -2.715 18986 8623 1 18 . 1 1 654 654 GLN H H 654 7.495 7.495 8.087 -0.592 18986 8624 1 18 . 1 1 655 655 VAL N N 655 110.080 110.080 117.422 -7.342 18986 8625 1 18 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.862 0.665 18986 8626 1 18 . 1 1 655 655 VAL C C 655 173.369 173.369 176.844 -3.475 18986 8627 1 18 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.573 -6.506 18986 8628 1 18 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.272 -4.088 18986 8629 1 18 . 1 1 655 655 VAL H H 655 7.197 7.197 7.859 -0.662 18986 8630 1 18 . 1 1 656 656 GLY N N 656 107.089 107.089 106.098 0.991 18986 8631 1 18 . 1 1 656 656 GLY C C 656 171.639 171.639 174.812 -3.173 18986 8632 1 18 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.502 -1.191 18986 8633 1 18 . 1 1 656 656 GLY H H 656 7.541 7.541 7.812 -0.271 18986 8634 1 18 . 1 1 657 657 ILE N N 657 121.266 121.266 120.125 1.141 18986 8635 1 18 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.122 0.012 18986 8636 1 18 . 1 1 657 657 ILE C C 657 171.885 171.885 175.379 -3.494 18986 8637 1 18 . 1 1 657 657 ILE CA C 657 58.230 58.230 59.187 -0.957 18986 8638 1 18 . 1 1 657 657 ILE CB C 657 35.191 35.191 37.602 -2.411 18986 8639 1 18 . 1 1 657 657 ILE H H 657 7.633 7.633 8.069 -0.436 18986 8640 1 18 . 1 1 658 658 GLU N N 658 127.252 127.252 121.459 5.793 18986 8641 1 18 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.586 -0.383 18986 8642 1 18 . 1 1 658 658 GLU C C 658 175.316 175.316 177.068 -1.752 18986 8643 1 18 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.424 -0.064 18986 8644 1 18 . 1 1 658 658 GLU CB C 658 27.610 27.610 32.395 -4.785 18986 8645 1 18 . 1 1 658 658 GLU H H 658 8.690 8.690 8.532 0.158 18986 8646 1 18 . 1 1 659 659 LYS N N 659 124.533 124.533 125.575 -1.042 18986 8647 1 18 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.841 -0.053 18986 8648 1 18 . 1 1 659 659 LYS C C 659 175.170 175.170 177.847 -2.677 18986 8649 1 18 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.252 -2.080 18986 8650 1 18 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.518 -1.401 18986 8651 1 18 . 1 1 659 659 LYS H H 659 8.706 8.706 8.829 -0.123 18986 8652 1 18 . 1 1 660 660 SER N N 660 113.137 113.137 115.915 -2.778 18986 8653 1 18 . 1 1 660 660 SER HA H 660 4.273 4.273 4.136 0.137 18986 8654 1 18 . 1 1 660 660 SER C C 660 173.939 173.939 176.970 -3.031 18986 8655 1 18 . 1 1 660 660 SER CA C 660 58.350 58.350 61.728 -3.378 18986 8656 1 18 . 1 1 660 660 SER CB C 660 59.504 59.504 62.286 -2.782 18986 8657 1 18 . 1 1 660 660 SER H H 660 8.777 8.777 8.370 0.407 18986 8658 1 18 . 1 1 661 661 ASN N N 661 119.986 119.986 120.585 -0.599 18986 8659 1 18 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.466 0.240 18986 8660 1 18 . 1 1 661 661 ASN C C 661 174.516 174.516 177.855 -3.339 18986 8661 1 18 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.164 -4.116 18986 8662 1 18 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.596 -1.853 18986 8663 1 18 . 1 1 661 661 ASN H H 661 7.486 7.486 7.955 -0.469 18986 8664 1 18 . 1 1 662 662 ILE N N 662 120.639 120.639 120.851 -0.212 18986 8665 1 18 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.689 -0.243 18986 8666 1 18 . 1 1 662 662 ILE C C 662 174.252 174.252 178.060 -3.808 18986 8667 1 18 . 1 1 662 662 ILE CA C 662 62.606 62.606 64.566 -1.960 18986 8668 1 18 . 1 1 662 662 ILE CB C 662 34.423 34.423 36.796 -2.373 18986 8669 1 18 . 1 1 662 662 ILE H H 662 7.999 7.999 8.384 -0.385 18986 8670 1 18 . 1 1 663 663 GLU N N 663 117.706 117.706 119.248 -1.542 18986 8671 1 18 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.981 -0.191 18986 8672 1 18 . 1 1 663 663 GLU C C 663 176.509 176.509 179.208 -2.699 18986 8673 1 18 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.873 -2.165 18986 8674 1 18 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.371 -2.616 18986 8675 1 18 . 1 1 663 663 GLU H H 663 8.190 8.190 8.789 -0.599 18986 8676 1 18 . 1 1 664 664 LYS N N 664 119.586 119.586 120.618 -1.032 18986 8677 1 18 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.086 -0.033 18986 8678 1 18 . 1 1 664 664 LYS C C 664 175.941 175.941 179.026 -3.085 18986 8679 1 18 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.362 -2.781 18986 8680 1 18 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.132 -2.309 18986 8681 1 18 . 1 1 664 664 LYS H H 664 7.590 7.590 8.043 -0.453 18986 8682 1 18 . 1 1 665 665 LEU N N 665 119.756 119.756 121.230 -1.474 18986 8683 1 18 . 1 1 665 665 LEU HA H 665 4.080 4.080 3.975 0.105 18986 8684 1 18 . 1 1 665 665 LEU C C 665 176.700 176.700 179.027 -2.327 18986 8685 1 18 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.737 -2.352 18986 8686 1 18 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.866 -2.674 18986 8687 1 18 . 1 1 665 665 LEU H H 665 8.075 8.075 8.077 -0.002 18986 8688 1 18 . 1 1 666 666 LEU N N 666 118.788 118.788 119.534 -0.746 18986 8689 1 18 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.590 0.174 18986 8690 1 18 . 1 1 666 666 LEU C C 666 176.484 176.484 178.946 -2.462 18986 8691 1 18 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.297 -2.639 18986 8692 1 18 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.889 -2.278 18986 8693 1 18 . 1 1 666 666 LEU H H 666 8.550 8.550 8.745 -0.195 18986 8694 1 18 . 1 1 667 667 THR N N 667 115.244 115.244 115.139 0.105 18986 8695 1 18 . 1 1 667 667 THR HA H 667 3.839 3.839 3.976 -0.137 18986 8696 1 18 . 1 1 667 667 THR C C 667 173.740 173.740 176.272 -2.532 18986 8697 1 18 . 1 1 667 667 THR CA C 667 64.378 64.378 67.504 -3.126 18986 8698 1 18 . 1 1 667 667 THR CB C 667 65.748 65.748 68.174 -2.426 18986 8699 1 18 . 1 1 667 667 THR H H 667 7.662 7.662 8.001 -0.339 18986 8700 1 18 . 1 1 668 668 ASP N N 668 122.862 122.862 122.720 0.142 18986 8701 1 18 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.338 0.045 18986 8702 1 18 . 1 1 668 668 ASP C C 668 177.192 177.192 178.589 -1.397 18986 8703 1 18 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.341 -2.210 18986 8704 1 18 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.904 -3.018 18986 8705 1 18 . 1 1 668 668 ASP H H 668 8.291 8.291 8.146 0.145 18986 8706 1 18 . 1 1 669 669 MET N N 669 119.640 119.640 118.961 0.679 18986 8707 1 18 . 1 1 669 669 MET HA H 669 3.917 3.917 4.087 -0.170 18986 8708 1 18 . 1 1 669 669 MET C C 669 175.414 175.414 178.550 -3.136 18986 8709 1 18 . 1 1 669 669 MET CA C 669 57.234 57.234 59.606 -2.373 18986 8710 1 18 . 1 1 669 669 MET CB C 669 32.088 32.088 32.718 -0.630 18986 8711 1 18 . 1 1 669 669 MET H H 669 8.809 8.809 8.527 0.282 18986 8712 1 18 . 1 1 670 670 ARG N N 670 122.614 122.614 117.275 5.339 18986 8713 1 18 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.654 -0.137 18986 8714 1 18 . 1 1 670 670 ARG C C 670 177.928 177.928 178.563 -0.635 18986 8715 1 18 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.229 -2.007 18986 8716 1 18 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.933 -2.629 18986 8717 1 18 . 1 1 670 670 ARG H H 670 8.450 8.450 8.453 -0.003 18986 8718 1 18 . 1 1 671 671 LYS N N 671 121.976 121.976 119.518 2.458 18986 8719 1 18 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.312 -0.199 18986 8720 1 18 . 1 1 671 671 LYS C C 671 176.143 176.143 177.832 -1.689 18986 8721 1 18 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.309 -1.223 18986 8722 1 18 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.931 -3.427 18986 8723 1 18 . 1 1 671 671 LYS H H 671 8.609 8.609 8.028 0.581 18986 8724 1 18 . 1 1 672 672 SER N N 672 111.655 111.655 113.362 -1.707 18986 8725 1 18 . 1 1 672 672 SER HA H 672 4.469 4.469 4.466 0.003 18986 8726 1 18 . 1 1 672 672 SER C C 672 171.692 171.692 175.290 -3.598 18986 8727 1 18 . 1 1 672 672 SER CA C 672 56.790 56.790 59.821 -3.031 18986 8728 1 18 . 1 1 672 672 SER CB C 672 61.343 61.343 64.358 -3.015 18986 8729 1 18 . 1 1 672 672 SER H H 672 7.884 7.884 8.178 -0.294 18986 8730 1 18 . 1 1 673 673 GLY N N 673 108.029 108.029 108.158 -0.129 18986 8731 1 18 . 1 1 673 673 GLY C C 673 171.492 171.492 175.107 -3.615 18986 8732 1 18 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.237 -1.962 18986 8733 1 18 . 1 1 673 673 GLY H H 673 7.774 7.774 8.278 -0.504 18986 8734 1 18 . 1 1 674 674 ILE N N 674 116.193 116.193 119.846 -3.653 18986 8735 1 18 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.948 0.153 18986 8736 1 18 . 1 1 674 674 ILE C C 674 173.980 173.980 175.668 -1.688 18986 8737 1 18 . 1 1 674 674 ILE CA C 674 60.242 60.242 62.805 -2.563 18986 8738 1 18 . 1 1 674 674 ILE CB C 674 36.804 36.804 37.846 -1.042 18986 8739 1 18 . 1 1 674 674 ILE H H 674 8.026 8.026 8.110 -0.084 18986 8740 1 18 . 1 1 675 675 ILE N N 675 108.928 108.928 112.315 -3.387 18986 8741 1 18 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.902 0.456 18986 8742 1 18 . 1 1 675 675 ILE C C 675 170.797 170.797 174.328 -3.531 18986 8743 1 18 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.978 -2.954 18986 8744 1 18 . 1 1 675 675 ILE CB C 675 39.486 39.486 42.064 -2.578 18986 8745 1 18 . 1 1 675 675 ILE H H 675 7.120 7.120 7.311 -0.191 18986 8746 1 18 . 1 1 676 676 TYR N N 676 118.062 118.062 120.627 -2.565 18986 8747 1 18 . 1 1 676 676 TYR HA H 676 4.995 4.995 4.966 0.029 18986 8748 1 18 . 1 1 676 676 TYR C C 676 170.020 170.020 176.705 -6.685 18986 8749 1 18 . 1 1 676 676 TYR CA C 676 52.893 52.893 56.290 -3.397 18986 8750 1 18 . 1 1 676 676 TYR CB C 676 38.516 38.516 39.796 -1.280 18986 8751 1 18 . 1 1 676 676 TYR H H 676 9.380 9.380 8.711 0.669 18986 8752 1 18 . 1 1 677 677 GLU N N 677 123.578 123.578 122.850 0.728 18986 8753 1 18 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.615 0.211 18986 8754 1 18 . 1 1 677 677 GLU C C 677 172.146 172.146 178.106 -5.960 18986 8755 1 18 . 1 1 677 677 GLU CA C 677 52.476 52.476 58.596 -6.120 18986 8756 1 18 . 1 1 677 677 GLU CB C 677 26.612 26.612 30.189 -3.577 18986 8757 1 18 . 1 1 677 677 GLU H H 677 8.951 8.951 8.889 0.062 18986 8758 1 18 . 1 1 678 678 ALA N N 678 133.220 133.220 119.855 13.365 18986 8759 1 18 . 1 1 678 678 ALA HA H 678 4.041 4.041 3.954 0.087 18986 8760 1 18 . 1 1 678 678 ALA C C 678 175.219 175.219 177.262 -2.043 18986 8761 1 18 . 1 1 678 678 ALA CA C 678 51.601 51.601 54.075 -2.474 18986 8762 1 18 . 1 1 678 678 ALA CB C 678 16.599 16.599 17.846 -1.247 18986 8763 1 18 . 1 1 678 678 ALA H H 678 7.912 7.912 8.214 -0.302 18986 8764 1 18 . 1 1 679 679 LYS N N 679 115.687 115.687 117.998 -2.311 18986 8765 1 18 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.704 -0.269 18986 8766 1 18 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.749 -1.733 18986 8767 1 18 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.162 -3.167 18986 8768 1 18 . 1 1 679 679 LYS H H 679 8.215 8.215 7.838 0.377 18986 8769 1 18 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.332 -0.313 18986 8770 1 18 . 1 1 680 680 PRO C C 680 174.504 174.504 176.948 -2.444 18986 8771 1 18 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.475 -0.957 18986 8772 1 18 . 1 1 680 680 PRO CB C 680 28.315 28.315 32.139 -3.824 18986 8773 1 18 . 1 1 681 681 GLU N N 681 118.851 118.851 116.906 1.945 18986 8774 1 18 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.010 -0.572 18986 8775 1 18 . 1 1 681 681 GLU C C 681 172.890 172.890 175.800 -2.910 18986 8776 1 18 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.014 -3.533 18986 8777 1 18 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.015 -4.226 18986 8778 1 18 . 1 1 681 681 GLU H H 681 10.003 10.003 8.741 1.262 18986 8779 1 18 . 1 1 682 682 CYS N N 682 120.934 120.934 115.509 5.425 18986 8780 1 18 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.545 -0.518 18986 8781 1 18 . 1 1 682 682 CYS C C 682 171.905 171.905 173.126 -1.221 18986 8782 1 18 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.663 -3.419 18986 8783 1 18 . 1 1 682 682 CYS CB C 682 45.295 45.295 31.723 13.572 18986 8784 1 18 . 1 1 682 682 CYS H H 682 7.860 7.860 7.435 0.425 18986 8785 1 18 . 1 1 683 683 TYR N N 683 126.183 126.183 118.885 7.298 18986 8786 1 18 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.056 0.168 18986 8787 1 18 . 1 1 683 683 TYR C C 683 173.008 173.008 173.959 -0.951 18986 8788 1 18 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.374 -0.806 18986 8789 1 18 . 1 1 683 683 TYR CB C 683 40.952 40.952 43.684 -2.732 18986 8790 1 18 . 1 1 683 683 TYR H H 683 9.297 9.297 9.271 0.026 18986 8791 1 18 . 1 1 684 684 LYS N N 684 118.604 118.604 121.136 -2.532 18986 8792 1 18 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.811 -0.374 18986 8793 1 18 . 1 1 684 684 LYS C C 684 171.628 171.628 175.108 -3.480 18986 8794 1 18 . 1 1 684 684 LYS CA C 684 52.303 52.303 54.124 -1.821 18986 8795 1 18 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.470 -1.793 18986 8796 1 18 . 1 1 684 684 LYS H H 684 8.630 8.630 9.132 -0.502 18986 8797 1 18 . 1 1 685 685 LYS N N 685 122.869 122.869 128.191 -5.322 18986 8798 1 18 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.036 0.608 18986 8799 1 18 . 1 1 685 685 LYS C C 685 173.337 173.337 176.367 -3.030 18986 8800 1 18 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.001 -2.748 18986 8801 1 18 . 1 1 685 685 LYS CB C 685 30.927 30.927 31.508 -0.581 18986 8802 1 18 . 1 1 685 685 LYS H H 685 8.969 8.969 8.750 0.219 18986 8803 1 19 . 1 1 601 601 SER HA H 601 4.475 4.475 4.262 0.213 18986 8804 1 19 . 1 1 601 601 SER CA C 601 55.508 55.508 58.486 -2.978 18986 8805 1 19 . 1 1 601 601 SER CB C 601 61.220 61.220 63.175 -1.955 18986 8806 1 19 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.410 0.206 18986 8807 1 19 . 1 1 602 602 HIS C C 602 172.320 172.320 175.692 -3.372 18986 8808 1 19 . 1 1 602 602 HIS CA C 602 53.854 53.854 57.964 -4.110 18986 8809 1 19 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.238 -2.155 18986 8810 1 19 . 1 1 603 603 MET N N 603 121.862 121.862 118.055 3.807 18986 8811 1 19 . 1 1 603 603 MET HA H 603 4.425 4.425 4.628 -0.203 18986 8812 1 19 . 1 1 603 603 MET C C 603 173.948 173.948 175.724 -1.776 18986 8813 1 19 . 1 1 603 603 MET CA C 603 53.108 53.108 55.166 -2.058 18986 8814 1 19 . 1 1 603 603 MET CB C 603 30.049 30.049 34.554 -4.505 18986 8815 1 19 . 1 1 603 603 MET H H 603 8.394 8.394 8.216 0.178 18986 8816 1 19 . 1 1 604 604 GLY N N 604 110.382 110.382 108.142 2.240 18986 8817 1 19 . 1 1 604 604 GLY C C 604 171.590 171.590 172.863 -1.273 18986 8818 1 19 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.422 -1.805 18986 8819 1 19 . 1 1 604 604 GLY H H 604 8.411 8.411 8.401 0.010 18986 8820 1 19 . 1 1 605 605 GLU N N 605 120.709 120.709 119.239 1.470 18986 8821 1 19 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.593 -0.286 18986 8822 1 19 . 1 1 605 605 GLU C C 605 174.220 174.220 176.428 -2.208 18986 8823 1 19 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.175 -1.209 18986 8824 1 19 . 1 1 605 605 GLU CB C 605 27.611 27.611 31.174 -3.563 18986 8825 1 19 . 1 1 605 605 GLU H H 605 8.282 8.282 8.221 0.061 18986 8826 1 19 . 1 1 606 606 SER N N 606 116.679 116.679 115.472 1.207 18986 8827 1 19 . 1 1 606 606 SER HA H 606 4.405 4.405 4.424 -0.019 18986 8828 1 19 . 1 1 606 606 SER C C 606 172.455 172.455 175.931 -3.476 18986 8829 1 19 . 1 1 606 606 SER CA C 606 56.028 56.028 58.562 -2.534 18986 8830 1 19 . 1 1 606 606 SER CB C 606 61.039 61.039 63.203 -2.164 18986 8831 1 19 . 1 1 606 606 SER H H 606 8.420 8.420 8.523 -0.103 18986 8832 1 19 . 1 1 607 607 GLY N N 607 110.716 110.716 111.029 -0.313 18986 8833 1 19 . 1 1 607 607 GLY C C 607 171.173 171.173 174.269 -3.096 18986 8834 1 19 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.371 -1.730 18986 8835 1 19 . 1 1 607 607 GLY H H 607 8.386 8.386 8.171 0.215 18986 8836 1 19 . 1 1 608 608 LYS N N 608 120.785 120.785 120.109 0.676 18986 8837 1 19 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.188 0.151 18986 8838 1 19 . 1 1 608 608 LYS C C 608 173.673 173.673 175.996 -2.323 18986 8839 1 19 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.217 -2.852 18986 8840 1 19 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.609 -2.078 18986 8841 1 19 . 1 1 608 608 LYS H H 608 8.008 8.008 8.105 -0.097 18986 8842 1 19 . 1 1 609 609 ILE N N 609 122.404 122.404 115.997 6.407 18986 8843 1 19 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.226 -0.077 18986 8844 1 19 . 1 1 609 609 ILE C C 609 172.675 172.675 173.998 -1.323 18986 8845 1 19 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.855 -2.852 18986 8846 1 19 . 1 1 609 609 ILE CB C 609 36.204 36.204 39.540 -3.336 18986 8847 1 19 . 1 1 609 609 ILE H H 609 8.186 8.186 7.306 0.880 18986 8848 1 19 . 1 1 610 610 ASP N N 610 125.357 125.357 125.360 -0.003 18986 8849 1 19 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.779 -0.076 18986 8850 1 19 . 1 1 610 610 ASP C C 610 173.668 173.668 175.530 -1.862 18986 8851 1 19 . 1 1 610 610 ASP CA C 610 50.702 50.702 52.999 -2.297 18986 8852 1 19 . 1 1 610 610 ASP CB C 610 38.690 38.690 43.854 -5.164 18986 8853 1 19 . 1 1 610 610 ASP H H 610 8.369 8.369 8.124 0.245 18986 8854 1 19 . 1 1 611 611 ILE N N 611 122.494 122.494 118.909 3.585 18986 8855 1 19 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.194 -0.285 18986 8856 1 19 . 1 1 611 611 ILE C C 611 173.618 173.618 177.131 -3.513 18986 8857 1 19 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.504 -2.464 18986 8858 1 19 . 1 1 611 611 ILE CB C 611 35.798 35.798 39.124 -3.326 18986 8859 1 19 . 1 1 611 611 ILE H H 611 8.284 8.284 8.226 0.058 18986 8860 1 19 . 1 1 612 612 ASP N N 612 121.440 121.440 120.682 0.758 18986 8861 1 19 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.284 0.150 18986 8862 1 19 . 1 1 612 612 ASP C C 612 175.129 175.129 178.373 -3.244 18986 8863 1 19 . 1 1 612 612 ASP CA C 612 53.766 53.766 58.365 -4.599 18986 8864 1 19 . 1 1 612 612 ASP CB C 612 38.138 38.138 40.841 -2.703 18986 8865 1 19 . 1 1 612 612 ASP H H 612 8.279 8.279 9.233 -0.954 18986 8866 1 19 . 1 1 613 613 THR N N 613 114.422 114.422 112.779 1.643 18986 8867 1 19 . 1 1 613 613 THR HA H 613 4.106 4.106 4.100 0.006 18986 8868 1 19 . 1 1 613 613 THR C C 613 173.338 173.338 175.304 -1.966 18986 8869 1 19 . 1 1 613 613 THR CA C 613 61.545 61.545 64.823 -3.278 18986 8870 1 19 . 1 1 613 613 THR CB C 613 66.267 66.267 68.463 -2.196 18986 8871 1 19 . 1 1 613 613 THR H H 613 7.866 7.866 8.255 -0.389 18986 8872 1 19 . 1 1 614 614 ILE N N 614 121.654 121.654 118.074 3.580 18986 8873 1 19 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.246 -0.217 18986 8874 1 19 . 1 1 614 614 ILE C C 614 174.471 174.471 177.515 -3.044 18986 8875 1 19 . 1 1 614 614 ILE CA C 614 60.173 60.173 61.748 -1.575 18986 8876 1 19 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.269 -2.454 18986 8877 1 19 . 1 1 614 614 ILE H H 614 7.819 7.819 7.486 0.333 18986 8878 1 19 . 1 1 615 615 MET N N 615 119.713 119.713 119.004 0.709 18986 8879 1 19 . 1 1 615 615 MET HA H 615 4.478 4.478 4.597 -0.119 18986 8880 1 19 . 1 1 615 615 MET C C 615 174.075 174.075 178.474 -4.399 18986 8881 1 19 . 1 1 615 615 MET CA C 615 52.764 52.764 56.573 -3.809 18986 8882 1 19 . 1 1 615 615 MET CB C 615 29.337 29.337 31.654 -2.317 18986 8883 1 19 . 1 1 615 615 MET H H 615 8.188 8.188 8.476 -0.288 18986 8884 1 19 . 1 1 616 616 THR N N 616 114.770 114.770 112.934 1.836 18986 8885 1 19 . 1 1 616 616 THR HA H 616 4.099 4.099 4.201 -0.102 18986 8886 1 19 . 1 1 616 616 THR C C 616 172.535 172.535 175.800 -3.265 18986 8887 1 19 . 1 1 616 616 THR CA C 616 61.112 61.112 64.713 -3.601 18986 8888 1 19 . 1 1 616 616 THR CB C 616 66.617 66.617 69.230 -2.613 18986 8889 1 19 . 1 1 616 616 THR H H 616 7.722 7.722 8.157 -0.435 18986 8890 1 19 . 1 1 617 617 GLY N N 617 111.384 111.384 106.168 5.216 18986 8891 1 19 . 1 1 617 617 GLY C C 617 171.437 171.437 173.726 -2.289 18986 8892 1 19 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.178 -2.736 18986 8893 1 19 . 1 1 617 617 GLY H H 617 8.431 8.431 7.656 0.775 18986 8894 1 19 . 1 1 618 618 LYS N N 618 120.996 120.996 120.585 0.411 18986 8895 1 19 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.865 -0.198 18986 8896 1 19 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.718 -1.890 18986 8897 1 19 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.066 -4.590 18986 8898 1 19 . 1 1 618 618 LYS H H 618 7.821 7.821 7.631 0.190 18986 8899 1 19 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.411 0.058 18986 8900 1 19 . 1 1 619 619 PRO C C 619 174.453 174.453 177.033 -2.580 18986 8901 1 19 . 1 1 619 619 PRO CA C 619 60.192 60.192 65.282 -5.090 18986 8902 1 19 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.396 -2.816 18986 8903 1 19 . 1 1 620 620 LYS N N 620 123.464 123.464 114.019 9.445 18986 8904 1 19 . 1 1 620 620 LYS HA H 620 4.046 4.046 4.490 -0.444 18986 8905 1 19 . 1 1 620 620 LYS C C 620 174.895 174.895 178.295 -3.400 18986 8906 1 19 . 1 1 620 620 LYS CA C 620 56.289 56.289 57.388 -1.099 18986 8907 1 19 . 1 1 620 620 LYS CB C 620 30.454 30.454 33.066 -2.612 18986 8908 1 19 . 1 1 620 620 LYS H H 620 8.728 8.728 7.909 0.819 18986 8909 1 19 . 1 1 621 621 SER N N 621 113.921 113.921 116.919 -2.998 18986 8910 1 19 . 1 1 621 621 SER HA H 621 4.336 4.336 4.056 0.280 18986 8911 1 19 . 1 1 621 621 SER C C 621 173.149 173.149 175.955 -2.806 18986 8912 1 19 . 1 1 621 621 SER CA C 621 56.691 56.691 61.260 -4.569 18986 8913 1 19 . 1 1 621 621 SER CB C 621 60.689 60.689 62.609 -1.920 18986 8914 1 19 . 1 1 621 621 SER H H 621 8.531 8.531 8.455 0.076 18986 8915 1 19 . 1 1 622 622 ALA N N 622 124.177 124.177 125.758 -1.581 18986 8916 1 19 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.967 0.201 18986 8917 1 19 . 1 1 622 622 ALA C C 622 176.804 176.804 179.315 -2.511 18986 8918 1 19 . 1 1 622 622 ALA CA C 622 52.368 52.368 54.868 -2.500 18986 8919 1 19 . 1 1 622 622 ALA CB C 622 15.854 15.854 17.930 -2.076 18986 8920 1 19 . 1 1 622 622 ALA H H 622 7.835 7.835 8.451 -0.616 18986 8921 1 19 . 1 1 623 623 ARG N N 623 118.263 118.263 118.861 -0.598 18986 8922 1 19 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.943 0.007 18986 8923 1 19 . 1 1 623 623 ARG C C 623 175.683 175.683 178.577 -2.894 18986 8924 1 19 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.011 -1.848 18986 8925 1 19 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.453 -2.002 18986 8926 1 19 . 1 1 623 623 ARG H H 623 8.148 8.148 7.890 0.258 18986 8927 1 19 . 1 1 624 624 GLU N N 624 117.953 117.953 119.710 -1.757 18986 8928 1 19 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.105 -0.137 18986 8929 1 19 . 1 1 624 624 GLU C C 624 177.204 177.204 178.549 -1.345 18986 8930 1 19 . 1 1 624 624 GLU CA C 624 56.857 56.857 58.995 -2.138 18986 8931 1 19 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.095 -2.128 18986 8932 1 19 . 1 1 624 624 GLU H H 624 8.143 8.143 8.214 -0.071 18986 8933 1 19 . 1 1 625 625 LYS N N 625 119.222 119.222 118.104 1.118 18986 8934 1 19 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.313 -0.456 18986 8935 1 19 . 1 1 625 625 LYS C C 625 175.480 175.480 178.783 -3.303 18986 8936 1 19 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.582 -1.095 18986 8937 1 19 . 1 1 625 625 LYS CB C 625 30.663 30.663 33.013 -2.350 18986 8938 1 19 . 1 1 625 625 LYS H H 625 7.772 7.772 7.743 0.029 18986 8939 1 19 . 1 1 626 626 MET N N 626 117.883 117.883 120.002 -2.119 18986 8940 1 19 . 1 1 626 626 MET HA H 626 3.807 3.807 4.033 -0.226 18986 8941 1 19 . 1 1 626 626 MET C C 626 175.278 175.278 178.317 -3.039 18986 8942 1 19 . 1 1 626 626 MET CA C 626 57.782 57.782 59.469 -1.687 18986 8943 1 19 . 1 1 626 626 MET CB C 626 30.657 30.657 32.591 -1.934 18986 8944 1 19 . 1 1 626 626 MET H H 626 8.367 8.367 8.594 -0.227 18986 8945 1 19 . 1 1 627 627 MET N N 627 116.185 116.185 116.487 -0.302 18986 8946 1 19 . 1 1 627 627 MET HA H 627 4.152 4.152 4.081 0.071 18986 8947 1 19 . 1 1 627 627 MET C C 627 176.393 176.393 178.468 -2.075 18986 8948 1 19 . 1 1 627 627 MET CA C 627 55.359 55.359 58.129 -2.770 18986 8949 1 19 . 1 1 627 627 MET CB C 627 28.803 28.803 31.187 -2.384 18986 8950 1 19 . 1 1 627 627 MET H H 627 8.197 8.197 8.399 -0.202 18986 8951 1 19 . 1 1 628 628 LYS N N 628 119.859 119.859 120.196 -0.337 18986 8952 1 19 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.062 0.138 18986 8953 1 19 . 1 1 628 628 LYS C C 628 175.885 175.885 178.926 -3.041 18986 8954 1 19 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.231 -4.154 18986 8955 1 19 . 1 1 628 628 LYS CB C 628 28.531 28.531 31.911 -3.380 18986 8956 1 19 . 1 1 628 628 LYS H H 628 7.700 7.700 7.542 0.158 18986 8957 1 19 . 1 1 629 629 ILE N N 629 119.001 119.001 120.990 -1.989 18986 8958 1 19 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.610 -0.062 18986 8959 1 19 . 1 1 629 629 ILE C C 629 174.891 174.891 178.186 -3.295 18986 8960 1 19 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.357 -3.092 18986 8961 1 19 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.954 -4.105 18986 8962 1 19 . 1 1 629 629 ILE H H 629 7.970 7.970 8.045 -0.075 18986 8963 1 19 . 1 1 630 630 ILE N N 630 120.737 120.737 114.810 5.927 18986 8964 1 19 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.771 -0.304 18986 8965 1 19 . 1 1 630 630 ILE C C 630 173.875 173.875 177.447 -3.572 18986 8966 1 19 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.685 -1.931 18986 8967 1 19 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.997 -2.720 18986 8968 1 19 . 1 1 630 630 ILE H H 630 8.213 8.213 8.267 -0.054 18986 8969 1 19 . 1 1 631 631 GLU N N 631 119.546 119.546 119.949 -0.403 18986 8970 1 19 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.376 -0.311 18986 8971 1 19 . 1 1 631 631 GLU C C 631 177.300 177.300 178.985 -1.685 18986 8972 1 19 . 1 1 631 631 GLU CA C 631 56.980 56.980 57.714 -0.734 18986 8973 1 19 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.511 -2.518 18986 8974 1 19 . 1 1 631 631 GLU H H 631 7.742 7.742 7.548 0.194 18986 8975 1 19 . 1 1 632 632 ILE N N 632 121.547 121.547 121.747 -0.200 18986 8976 1 19 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.750 -0.067 18986 8977 1 19 . 1 1 632 632 ILE C C 632 175.454 175.454 178.164 -2.710 18986 8978 1 19 . 1 1 632 632 ILE CA C 632 62.656 62.656 63.918 -1.262 18986 8979 1 19 . 1 1 632 632 ILE CB C 632 35.830 35.830 36.493 -0.663 18986 8980 1 19 . 1 1 632 632 ILE H H 632 8.013 8.013 8.179 -0.166 18986 8981 1 19 . 1 1 633 633 ILE N N 633 121.605 121.605 121.154 0.451 18986 8982 1 19 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.569 -0.234 18986 8983 1 19 . 1 1 633 633 ILE C C 633 174.558 174.558 178.381 -3.823 18986 8984 1 19 . 1 1 633 633 ILE CA C 633 63.919 63.919 66.144 -2.225 18986 8985 1 19 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.465 -2.181 18986 8986 1 19 . 1 1 633 633 ILE H H 633 8.594 8.594 8.151 0.443 18986 8987 1 19 . 1 1 634 634 ASP N N 634 118.706 118.706 119.878 -1.172 18986 8988 1 19 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.368 0.067 18986 8989 1 19 . 1 1 634 634 ASP C C 634 176.574 176.574 178.435 -1.861 18986 8990 1 19 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.646 -3.075 18986 8991 1 19 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.224 -2.310 18986 8992 1 19 . 1 1 634 634 ASP H H 634 8.724 8.724 8.213 0.511 18986 8993 1 19 . 1 1 635 635 SER N N 635 114.064 114.064 114.254 -0.190 18986 8994 1 19 . 1 1 635 635 SER HA H 635 4.232 4.232 4.294 -0.062 18986 8995 1 19 . 1 1 635 635 SER C C 635 174.487 174.487 175.567 -1.080 18986 8996 1 19 . 1 1 635 635 SER CA C 635 58.540 58.540 60.197 -1.657 18986 8997 1 19 . 1 1 635 635 SER CB C 635 60.319 60.319 62.753 -2.434 18986 8998 1 19 . 1 1 635 635 SER H H 635 7.992 7.992 8.225 -0.233 18986 8999 1 19 . 1 1 636 636 LEU N N 636 122.493 122.493 119.219 3.274 18986 9000 1 19 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.380 -0.126 18986 9001 1 19 . 1 1 636 636 LEU C C 636 176.194 176.194 178.304 -2.110 18986 9002 1 19 . 1 1 636 636 LEU CA C 636 54.095 54.095 56.386 -2.291 18986 9003 1 19 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.537 -2.831 18986 9004 1 19 . 1 1 636 636 LEU H H 636 8.169 8.169 7.700 0.469 18986 9005 1 19 . 1 1 637 637 ALA N N 637 121.891 121.891 122.653 -0.762 18986 9006 1 19 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.414 -0.325 18986 9007 1 19 . 1 1 637 637 ALA C C 637 175.131 175.131 179.114 -3.983 18986 9008 1 19 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.475 -4.139 18986 9009 1 19 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.787 -3.299 18986 9010 1 19 . 1 1 637 637 ALA H H 637 8.482 8.482 8.254 0.228 18986 9011 1 19 . 1 1 638 638 VAL N N 638 117.140 117.140 116.513 0.627 18986 9012 1 19 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.859 0.076 18986 9013 1 19 . 1 1 638 638 VAL C C 638 174.712 174.712 176.581 -1.869 18986 9014 1 19 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.176 -2.175 18986 9015 1 19 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.151 -2.800 18986 9016 1 19 . 1 1 638 638 VAL H H 638 7.291 7.291 8.084 -0.793 18986 9017 1 19 . 1 1 639 639 SER N N 639 114.143 114.143 113.155 0.988 18986 9018 1 19 . 1 1 639 639 SER HA H 639 4.481 4.481 4.527 -0.046 18986 9019 1 19 . 1 1 639 639 SER C C 639 172.122 172.122 174.598 -2.476 18986 9020 1 19 . 1 1 639 639 SER CA C 639 56.002 56.002 58.205 -2.203 18986 9021 1 19 . 1 1 639 639 SER CB C 639 60.921 60.921 63.959 -3.038 18986 9022 1 19 . 1 1 639 639 SER H H 639 7.918 7.918 8.098 -0.180 18986 9023 1 19 . 1 1 640 640 SER N N 640 115.370 115.370 116.289 -0.919 18986 9024 1 19 . 1 1 640 640 SER HA H 640 4.711 4.711 4.826 -0.115 18986 9025 1 19 . 1 1 640 640 SER C C 640 171.185 171.185 174.637 -3.452 18986 9026 1 19 . 1 1 640 640 SER CA C 640 55.009 55.009 56.458 -1.449 18986 9027 1 19 . 1 1 640 640 SER CB C 640 61.974 61.974 64.645 -2.671 18986 9028 1 19 . 1 1 640 640 SER H H 640 7.765 7.765 8.011 -0.246 18986 9029 1 19 . 1 1 641 641 GLU N N 641 119.994 119.994 121.539 -1.545 18986 9030 1 19 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.189 -0.145 18986 9031 1 19 . 1 1 641 641 GLU C C 641 173.167 173.167 175.965 -2.798 18986 9032 1 19 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.351 -1.700 18986 9033 1 19 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.746 -2.262 18986 9034 1 19 . 1 1 641 641 GLU H H 641 8.363 8.363 8.860 -0.497 18986 9035 1 19 . 1 1 642 642 CYS N N 642 110.257 110.257 116.671 -6.414 18986 9036 1 19 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.642 -0.183 18986 9037 1 19 . 1 1 642 642 CYS C C 642 168.058 168.058 173.426 -5.368 18986 9038 1 19 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.906 -5.960 18986 9039 1 19 . 1 1 642 642 CYS CB C 642 41.361 41.361 32.107 9.254 18986 9040 1 19 . 1 1 642 642 CYS H H 642 7.881 7.881 7.502 0.379 18986 9041 1 19 . 1 1 643 643 ALA N N 643 123.922 123.922 124.608 -0.686 18986 9042 1 19 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.436 0.202 18986 9043 1 19 . 1 1 643 643 ALA C C 643 172.517 172.517 176.356 -3.839 18986 9044 1 19 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.542 -3.922 18986 9045 1 19 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.434 0.010 18986 9046 1 19 . 1 1 643 643 ALA H H 643 9.787 9.787 8.927 0.860 18986 9047 1 19 . 1 1 644 644 LYS N N 644 128.479 128.479 126.110 2.369 18986 9048 1 19 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.374 0.137 18986 9049 1 19 . 1 1 644 644 LYS C C 644 176.945 176.945 177.703 -0.758 18986 9050 1 19 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.744 -2.406 18986 9051 1 19 . 1 1 644 644 LYS CB C 644 29.942 29.942 31.895 -1.953 18986 9052 1 19 . 1 1 644 644 LYS H H 644 9.809 9.809 8.766 1.043 18986 9053 1 19 . 1 1 645 645 VAL N N 645 124.257 124.257 126.740 -2.483 18986 9054 1 19 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.463 0.185 18986 9055 1 19 . 1 1 645 645 VAL C C 645 173.996 173.996 177.348 -3.352 18986 9056 1 19 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.527 -1.665 18986 9057 1 19 . 1 1 645 645 VAL CB C 645 29.201 29.201 30.873 -1.672 18986 9058 1 19 . 1 1 645 645 VAL H H 645 8.458 8.458 9.217 -0.759 18986 9059 1 19 . 1 1 646 646 LYS N N 646 117.598 117.598 120.535 -2.937 18986 9060 1 19 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.880 0.127 18986 9061 1 19 . 1 1 646 646 LYS C C 646 176.047 176.047 178.457 -2.410 18986 9062 1 19 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.305 -3.060 18986 9063 1 19 . 1 1 646 646 LYS CB C 646 29.398 29.398 32.189 -2.791 18986 9064 1 19 . 1 1 646 646 LYS H H 646 8.706 8.706 9.268 -0.562 18986 9065 1 19 . 1 1 647 647 ASP N N 647 119.229 119.229 119.793 -0.564 18986 9066 1 19 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.450 0.168 18986 9067 1 19 . 1 1 647 647 ASP C C 647 175.211 175.211 178.668 -3.457 18986 9068 1 19 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.070 -2.747 18986 9069 1 19 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.444 -1.706 18986 9070 1 19 . 1 1 647 647 ASP H H 647 7.012 7.012 7.816 -0.804 18986 9071 1 19 . 1 1 648 648 ILE N N 648 121.939 121.939 120.867 1.072 18986 9072 1 19 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.595 -0.214 18986 9073 1 19 . 1 1 648 648 ILE C C 648 175.243 175.243 177.972 -2.729 18986 9074 1 19 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.294 -2.253 18986 9075 1 19 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.754 -1.792 18986 9076 1 19 . 1 1 648 648 ILE H H 648 8.152 8.152 7.474 0.678 18986 9077 1 19 . 1 1 649 649 LEU N N 649 117.310 117.310 119.596 -2.286 18986 9078 1 19 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.811 0.062 18986 9079 1 19 . 1 1 649 649 LEU C C 649 176.439 176.439 179.019 -2.580 18986 9080 1 19 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.297 -2.412 18986 9081 1 19 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.321 -2.015 18986 9082 1 19 . 1 1 649 649 LEU H H 649 8.638 8.638 8.596 0.042 18986 9083 1 19 . 1 1 650 650 LYS N N 650 118.810 118.810 119.750 -0.940 18986 9084 1 19 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.893 0.153 18986 9085 1 19 . 1 1 650 650 LYS C C 650 176.801 176.801 178.638 -1.837 18986 9086 1 19 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.717 -2.666 18986 9087 1 19 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.147 -2.083 18986 9088 1 19 . 1 1 650 650 LYS H H 650 7.296 7.296 7.883 -0.587 18986 9089 1 19 . 1 1 651 651 GLU N N 651 117.713 117.713 119.105 -1.392 18986 9090 1 19 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.015 0.093 18986 9091 1 19 . 1 1 651 651 GLU C C 651 176.903 176.903 178.972 -2.069 18986 9092 1 19 . 1 1 651 651 GLU CA C 651 55.810 55.810 59.381 -3.571 18986 9093 1 19 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.520 -2.072 18986 9094 1 19 . 1 1 651 651 GLU H H 651 8.036 8.036 8.225 -0.189 18986 9095 1 19 . 1 1 652 652 ALA N N 652 121.206 121.206 120.938 0.268 18986 9096 1 19 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.055 -0.057 18986 9097 1 19 . 1 1 652 652 ALA C C 652 176.766 176.766 179.968 -3.202 18986 9098 1 19 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.331 -3.597 18986 9099 1 19 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.330 -3.014 18986 9100 1 19 . 1 1 652 652 ALA H H 652 8.973 8.973 8.477 0.496 18986 9101 1 19 . 1 1 653 653 GLN N N 653 117.768 117.768 118.266 -0.498 18986 9102 1 19 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.308 0.169 18986 9103 1 19 . 1 1 653 653 GLN C C 653 177.388 177.388 178.989 -1.601 18986 9104 1 19 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.370 -2.309 18986 9105 1 19 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.923 -2.154 18986 9106 1 19 . 1 1 653 653 GLN H H 653 8.059 8.059 8.052 0.007 18986 9107 1 19 . 1 1 654 654 GLN N N 654 117.979 117.979 119.088 -1.109 18986 9108 1 19 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.041 0.136 18986 9109 1 19 . 1 1 654 654 GLN C C 654 174.834 174.834 178.283 -3.449 18986 9110 1 19 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.407 -2.989 18986 9111 1 19 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.802 -2.825 18986 9112 1 19 . 1 1 654 654 GLN H H 654 7.495 7.495 8.196 -0.701 18986 9113 1 19 . 1 1 655 655 VAL N N 655 110.080 110.080 117.243 -7.163 18986 9114 1 19 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.860 0.667 18986 9115 1 19 . 1 1 655 655 VAL C C 655 173.369 173.369 176.992 -3.623 18986 9116 1 19 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.182 -6.115 18986 9117 1 19 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.297 -4.114 18986 9118 1 19 . 1 1 655 655 VAL H H 655 7.197 7.197 8.190 -0.993 18986 9119 1 19 . 1 1 656 656 GLY N N 656 107.089 107.089 105.788 1.301 18986 9120 1 19 . 1 1 656 656 GLY C C 656 171.639 171.639 174.603 -2.964 18986 9121 1 19 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.779 -1.468 18986 9122 1 19 . 1 1 656 656 GLY H H 656 7.541 7.541 7.790 -0.249 18986 9123 1 19 . 1 1 657 657 ILE N N 657 121.266 121.266 120.669 0.597 18986 9124 1 19 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.234 -0.100 18986 9125 1 19 . 1 1 657 657 ILE C C 657 171.885 171.885 175.551 -3.666 18986 9126 1 19 . 1 1 657 657 ILE CA C 657 58.230 58.230 61.242 -3.012 18986 9127 1 19 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.138 -3.947 18986 9128 1 19 . 1 1 657 657 ILE H H 657 7.633 7.633 8.524 -0.891 18986 9129 1 19 . 1 1 658 658 GLU N N 658 127.252 127.252 120.094 7.158 18986 9130 1 19 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.647 -0.444 18986 9131 1 19 . 1 1 658 658 GLU C C 658 175.316 175.316 177.440 -2.124 18986 9132 1 19 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.624 -0.264 18986 9133 1 19 . 1 1 658 658 GLU CB C 658 27.610 27.610 32.119 -4.509 18986 9134 1 19 . 1 1 658 658 GLU H H 658 8.690 8.690 8.308 0.382 18986 9135 1 19 . 1 1 659 659 LYS N N 659 124.533 124.533 126.568 -2.035 18986 9136 1 19 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.805 -0.017 18986 9137 1 19 . 1 1 659 659 LYS C C 659 175.170 175.170 178.164 -2.994 18986 9138 1 19 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.209 -2.038 18986 9139 1 19 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.949 -1.832 18986 9140 1 19 . 1 1 659 659 LYS H H 659 8.706 8.706 8.514 0.192 18986 9141 1 19 . 1 1 660 660 SER N N 660 113.137 113.137 116.084 -2.947 18986 9142 1 19 . 1 1 660 660 SER HA H 660 4.273 4.273 4.093 0.180 18986 9143 1 19 . 1 1 660 660 SER C C 660 173.939 173.939 176.828 -2.889 18986 9144 1 19 . 1 1 660 660 SER CA C 660 58.350 58.350 62.085 -3.735 18986 9145 1 19 . 1 1 660 660 SER CB C 660 59.504 59.504 62.504 -3.000 18986 9146 1 19 . 1 1 660 660 SER H H 660 8.777 8.777 9.000 -0.223 18986 9147 1 19 . 1 1 661 661 ASN N N 661 119.986 119.986 120.734 -0.748 18986 9148 1 19 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.467 0.239 18986 9149 1 19 . 1 1 661 661 ASN C C 661 174.516 174.516 177.596 -3.080 18986 9150 1 19 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.374 -4.326 18986 9151 1 19 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.678 -1.935 18986 9152 1 19 . 1 1 661 661 ASN H H 661 7.486 7.486 7.836 -0.350 18986 9153 1 19 . 1 1 662 662 ILE N N 662 120.639 120.639 121.718 -1.079 18986 9154 1 19 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.603 -0.157 18986 9155 1 19 . 1 1 662 662 ILE C C 662 174.252 174.252 177.733 -3.481 18986 9156 1 19 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.943 -3.337 18986 9157 1 19 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.880 -3.457 18986 9158 1 19 . 1 1 662 662 ILE H H 662 7.999 7.999 7.942 0.057 18986 9159 1 19 . 1 1 663 663 GLU N N 663 117.706 117.706 119.182 -1.476 18986 9160 1 19 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.903 -0.113 18986 9161 1 19 . 1 1 663 663 GLU C C 663 176.509 176.509 179.188 -2.679 18986 9162 1 19 . 1 1 663 663 GLU CA C 663 57.708 57.708 59.967 -2.259 18986 9163 1 19 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.242 -2.487 18986 9164 1 19 . 1 1 663 663 GLU H H 663 8.190 8.190 8.718 -0.528 18986 9165 1 19 . 1 1 664 664 LYS N N 664 119.586 119.586 120.411 -0.825 18986 9166 1 19 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.076 -0.023 18986 9167 1 19 . 1 1 664 664 LYS C C 664 175.941 175.941 179.019 -3.078 18986 9168 1 19 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.225 -2.644 18986 9169 1 19 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.137 -2.314 18986 9170 1 19 . 1 1 664 664 LYS H H 664 7.590 7.590 7.981 -0.391 18986 9171 1 19 . 1 1 665 665 LEU N N 665 119.756 119.756 121.329 -1.573 18986 9172 1 19 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.050 0.030 18986 9173 1 19 . 1 1 665 665 LEU C C 665 176.700 176.700 179.018 -2.318 18986 9174 1 19 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.085 -2.700 18986 9175 1 19 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.322 -2.130 18986 9176 1 19 . 1 1 665 665 LEU H H 665 8.075 8.075 8.096 -0.021 18986 9177 1 19 . 1 1 666 666 LEU N N 666 118.788 118.788 115.675 3.113 18986 9178 1 19 . 1 1 666 666 LEU HA H 666 3.764 3.764 4.054 -0.290 18986 9179 1 19 . 1 1 666 666 LEU C C 666 176.484 176.484 179.072 -2.588 18986 9180 1 19 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.386 -2.728 18986 9181 1 19 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.653 -2.042 18986 9182 1 19 . 1 1 666 666 LEU H H 666 8.550 8.550 8.567 -0.017 18986 9183 1 19 . 1 1 667 667 THR N N 667 115.244 115.244 117.878 -2.634 18986 9184 1 19 . 1 1 667 667 THR HA H 667 3.839 3.839 4.054 -0.215 18986 9185 1 19 . 1 1 667 667 THR C C 667 173.740 173.740 176.392 -2.652 18986 9186 1 19 . 1 1 667 667 THR CA C 667 64.378 64.378 68.114 -3.736 18986 9187 1 19 . 1 1 667 667 THR CB C 667 65.748 65.748 68.142 -2.394 18986 9188 1 19 . 1 1 667 667 THR H H 667 7.662 7.662 8.173 -0.511 18986 9189 1 19 . 1 1 668 668 ASP N N 668 122.862 122.862 122.990 -0.128 18986 9190 1 19 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.422 -0.039 18986 9191 1 19 . 1 1 668 668 ASP C C 668 177.192 177.192 178.669 -1.477 18986 9192 1 19 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.242 -2.111 18986 9193 1 19 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.788 -2.902 18986 9194 1 19 . 1 1 668 668 ASP H H 668 8.291 8.291 8.110 0.181 18986 9195 1 19 . 1 1 669 669 MET N N 669 119.640 119.640 119.509 0.131 18986 9196 1 19 . 1 1 669 669 MET HA H 669 3.917 3.917 4.009 -0.092 18986 9197 1 19 . 1 1 669 669 MET C C 669 175.414 175.414 178.404 -2.990 18986 9198 1 19 . 1 1 669 669 MET CA C 669 57.234 57.234 60.270 -3.035 18986 9199 1 19 . 1 1 669 669 MET CB C 669 32.088 32.088 32.674 -0.586 18986 9200 1 19 . 1 1 669 669 MET H H 669 8.809 8.809 8.447 0.362 18986 9201 1 19 . 1 1 670 670 ARG N N 670 122.614 122.614 118.670 3.944 18986 9202 1 19 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.341 0.176 18986 9203 1 19 . 1 1 670 670 ARG C C 670 177.928 177.928 178.833 -0.905 18986 9204 1 19 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.586 -2.364 18986 9205 1 19 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.794 -2.490 18986 9206 1 19 . 1 1 670 670 ARG H H 670 8.450 8.450 8.496 -0.046 18986 9207 1 19 . 1 1 671 671 LYS N N 671 121.976 121.976 119.628 2.348 18986 9208 1 19 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.193 -0.080 18986 9209 1 19 . 1 1 671 671 LYS C C 671 176.143 176.143 178.387 -2.244 18986 9210 1 19 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.537 -1.451 18986 9211 1 19 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.730 -3.226 18986 9212 1 19 . 1 1 671 671 LYS H H 671 8.609 8.609 8.280 0.329 18986 9213 1 19 . 1 1 672 672 SER N N 672 111.655 111.655 113.334 -1.679 18986 9214 1 19 . 1 1 672 672 SER HA H 672 4.469 4.469 4.427 0.042 18986 9215 1 19 . 1 1 672 672 SER C C 672 171.692 171.692 174.523 -2.831 18986 9216 1 19 . 1 1 672 672 SER CA C 672 56.790 56.790 59.612 -2.822 18986 9217 1 19 . 1 1 672 672 SER CB C 672 61.343 61.343 64.148 -2.805 18986 9218 1 19 . 1 1 672 672 SER H H 672 7.884 7.884 8.171 -0.287 18986 9219 1 19 . 1 1 673 673 GLY N N 673 108.029 108.029 108.043 -0.014 18986 9220 1 19 . 1 1 673 673 GLY C C 673 171.492 171.492 174.262 -2.770 18986 9221 1 19 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.219 -1.944 18986 9222 1 19 . 1 1 673 673 GLY H H 673 7.774 7.774 8.024 -0.250 18986 9223 1 19 . 1 1 674 674 ILE N N 674 116.193 116.193 118.518 -2.325 18986 9224 1 19 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.129 -0.028 18986 9225 1 19 . 1 1 674 674 ILE C C 674 173.980 173.980 175.769 -1.789 18986 9226 1 19 . 1 1 674 674 ILE CA C 674 60.242 60.242 62.989 -2.747 18986 9227 1 19 . 1 1 674 674 ILE CB C 674 36.804 36.804 39.076 -2.272 18986 9228 1 19 . 1 1 674 674 ILE H H 674 8.026 8.026 8.239 -0.213 18986 9229 1 19 . 1 1 675 675 ILE N N 675 108.928 108.928 114.344 -5.416 18986 9230 1 19 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.287 1.071 18986 9231 1 19 . 1 1 675 675 ILE C C 675 170.797 170.797 173.928 -3.131 18986 9232 1 19 . 1 1 675 675 ILE CA C 675 56.024 56.024 59.037 -3.013 18986 9233 1 19 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.344 -1.858 18986 9234 1 19 . 1 1 675 675 ILE H H 675 7.120 7.120 7.346 -0.226 18986 9235 1 19 . 1 1 676 676 TYR N N 676 118.062 118.062 115.267 2.795 18986 9236 1 19 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.048 -0.053 18986 9237 1 19 . 1 1 676 676 TYR C C 676 170.020 170.020 173.725 -3.705 18986 9238 1 19 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.767 -2.874 18986 9239 1 19 . 1 1 676 676 TYR CB C 676 38.516 38.516 41.272 -2.756 18986 9240 1 19 . 1 1 676 676 TYR H H 676 9.380 9.380 8.757 0.623 18986 9241 1 19 . 1 1 677 677 GLU N N 677 123.578 123.578 122.050 1.528 18986 9242 1 19 . 1 1 677 677 GLU HA H 677 3.826 3.826 4.326 -0.500 18986 9243 1 19 . 1 1 677 677 GLU C C 677 172.146 172.146 174.955 -2.809 18986 9244 1 19 . 1 1 677 677 GLU CA C 677 52.476 52.476 54.347 -1.871 18986 9245 1 19 . 1 1 677 677 GLU CB C 677 26.612 26.612 27.195 -0.583 18986 9246 1 19 . 1 1 677 677 GLU H H 677 8.951 8.951 8.517 0.434 18986 9247 1 19 . 1 1 678 678 ALA N N 678 133.220 133.220 125.709 7.511 18986 9248 1 19 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.146 -0.105 18986 9249 1 19 . 1 1 678 678 ALA C C 678 175.219 175.219 177.429 -2.210 18986 9250 1 19 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.593 -1.992 18986 9251 1 19 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.425 -2.826 18986 9252 1 19 . 1 1 678 678 ALA H H 678 7.912 7.912 8.674 -0.762 18986 9253 1 19 . 1 1 679 679 LYS N N 679 115.687 115.687 116.900 -1.213 18986 9254 1 19 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.754 -0.319 18986 9255 1 19 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.691 -1.675 18986 9256 1 19 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.133 -3.138 18986 9257 1 19 . 1 1 679 679 LYS H H 679 8.215 8.215 7.429 0.786 18986 9258 1 19 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.474 -0.455 18986 9259 1 19 . 1 1 680 680 PRO C C 680 174.504 174.504 177.383 -2.879 18986 9260 1 19 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.752 -1.234 18986 9261 1 19 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.915 -3.600 18986 9262 1 19 . 1 1 681 681 GLU N N 681 118.851 118.851 119.304 -0.453 18986 9263 1 19 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.103 -0.665 18986 9264 1 19 . 1 1 681 681 GLU C C 681 172.890 172.890 175.602 -2.712 18986 9265 1 19 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.667 -4.186 18986 9266 1 19 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.526 -4.737 18986 9267 1 19 . 1 1 681 681 GLU H H 681 10.003 10.003 9.063 0.940 18986 9268 1 19 . 1 1 682 682 CYS N N 682 120.934 120.934 119.024 1.910 18986 9269 1 19 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.264 -0.237 18986 9270 1 19 . 1 1 682 682 CYS C C 682 171.905 171.905 173.590 -1.685 18986 9271 1 19 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.407 -3.163 18986 9272 1 19 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.828 16.467 18986 9273 1 19 . 1 1 682 682 CYS H H 682 7.860 7.860 7.537 0.323 18986 9274 1 19 . 1 1 683 683 TYR N N 683 126.183 126.183 123.869 2.314 18986 9275 1 19 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.117 0.107 18986 9276 1 19 . 1 1 683 683 TYR C C 683 173.008 173.008 174.864 -1.856 18986 9277 1 19 . 1 1 683 683 TYR CA C 683 56.568 56.568 55.992 0.576 18986 9278 1 19 . 1 1 683 683 TYR CB C 683 40.952 40.952 41.015 -0.063 18986 9279 1 19 . 1 1 683 683 TYR H H 683 9.297 9.297 9.518 -0.221 18986 9280 1 19 . 1 1 684 684 LYS N N 684 118.604 118.604 120.734 -2.130 18986 9281 1 19 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.824 -0.387 18986 9282 1 19 . 1 1 684 684 LYS C C 684 171.628 171.628 175.154 -3.526 18986 9283 1 19 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.139 -0.836 18986 9284 1 19 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.863 -2.186 18986 9285 1 19 . 1 1 684 684 LYS H H 684 8.630 8.630 9.315 -0.685 18986 9286 1 19 . 1 1 685 685 LYS N N 685 122.869 122.869 124.902 -2.033 18986 9287 1 19 . 1 1 685 685 LYS HA H 685 4.644 4.644 3.839 0.805 18986 9288 1 19 . 1 1 685 685 LYS C C 685 173.337 173.337 176.501 -3.164 18986 9289 1 19 . 1 1 685 685 LYS CA C 685 54.253 54.253 57.012 -2.759 18986 9290 1 19 . 1 1 685 685 LYS CB C 685 30.927 30.927 33.032 -2.106 18986 9291 1 19 . 1 1 685 685 LYS H H 685 8.969 8.969 8.599 0.370 18986 9292 1 20 . 1 1 601 601 SER HA H 601 4.475 4.475 4.186 0.289 18986 9293 1 20 . 1 1 601 601 SER CA C 601 55.508 55.508 59.772 -4.264 18986 9294 1 20 . 1 1 601 601 SER CB C 601 61.220 61.220 63.026 -1.806 18986 9295 1 20 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.237 0.379 18986 9296 1 20 . 1 1 602 602 HIS C C 602 172.320 172.320 174.303 -1.983 18986 9297 1 20 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.673 -2.819 18986 9298 1 20 . 1 1 602 602 HIS CB C 602 28.083 28.083 29.545 -1.462 18986 9299 1 20 . 1 1 603 603 MET N N 603 121.862 121.862 119.277 2.585 18986 9300 1 20 . 1 1 603 603 MET HA H 603 4.425 4.425 4.319 0.106 18986 9301 1 20 . 1 1 603 603 MET C C 603 173.948 173.948 176.875 -2.927 18986 9302 1 20 . 1 1 603 603 MET CA C 603 53.108 53.108 57.084 -3.977 18986 9303 1 20 . 1 1 603 603 MET CB C 603 30.049 30.049 33.895 -3.846 18986 9304 1 20 . 1 1 603 603 MET H H 603 8.394 8.394 7.962 0.432 18986 9305 1 20 . 1 1 604 604 GLY N N 604 110.382 110.382 108.746 1.636 18986 9306 1 20 . 1 1 604 604 GLY C C 604 171.590 171.590 173.285 -1.695 18986 9307 1 20 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.714 -2.097 18986 9308 1 20 . 1 1 604 604 GLY H H 604 8.411 8.411 8.357 0.054 18986 9309 1 20 . 1 1 605 605 GLU N N 605 120.709 120.709 122.005 -1.296 18986 9310 1 20 . 1 1 605 605 GLU HA H 605 4.307 4.307 5.138 -0.831 18986 9311 1 20 . 1 1 605 605 GLU C C 605 174.220 174.220 176.188 -1.968 18986 9312 1 20 . 1 1 605 605 GLU CA C 605 53.966 53.966 55.446 -1.480 18986 9313 1 20 . 1 1 605 605 GLU CB C 605 27.611 27.611 32.641 -5.029 18986 9314 1 20 . 1 1 605 605 GLU H H 605 8.282 8.282 8.592 -0.310 18986 9315 1 20 . 1 1 606 606 SER N N 606 116.679 116.679 115.498 1.181 18986 9316 1 20 . 1 1 606 606 SER HA H 606 4.405 4.405 4.784 -0.379 18986 9317 1 20 . 1 1 606 606 SER C C 606 172.455 172.455 173.048 -0.593 18986 9318 1 20 . 1 1 606 606 SER CA C 606 56.028 56.028 58.244 -2.216 18986 9319 1 20 . 1 1 606 606 SER CB C 606 61.039 61.039 64.078 -3.039 18986 9320 1 20 . 1 1 606 606 SER H H 606 8.420 8.420 8.605 -0.185 18986 9321 1 20 . 1 1 607 607 GLY N N 607 110.716 110.716 110.010 0.706 18986 9322 1 20 . 1 1 607 607 GLY C C 607 171.173 171.173 173.807 -2.634 18986 9323 1 20 . 1 1 607 607 GLY CA C 607 42.641 42.641 44.784 -2.143 18986 9324 1 20 . 1 1 607 607 GLY H H 607 8.386 8.386 8.433 -0.047 18986 9325 1 20 . 1 1 608 608 LYS N N 608 120.785 120.785 119.371 1.414 18986 9326 1 20 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.418 -0.079 18986 9327 1 20 . 1 1 608 608 LYS C C 608 173.673 173.673 176.143 -2.470 18986 9328 1 20 . 1 1 608 608 LYS CA C 608 53.365 53.365 55.585 -2.220 18986 9329 1 20 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.266 -1.735 18986 9330 1 20 . 1 1 608 608 LYS H H 608 8.008 8.008 8.310 -0.302 18986 9331 1 20 . 1 1 609 609 ILE N N 609 122.404 122.404 121.204 1.200 18986 9332 1 20 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.115 0.034 18986 9333 1 20 . 1 1 609 609 ILE C C 609 172.675 172.675 175.654 -2.979 18986 9334 1 20 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.881 -2.878 18986 9335 1 20 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.448 -2.244 18986 9336 1 20 . 1 1 609 609 ILE H H 609 8.186 8.186 7.947 0.239 18986 9337 1 20 . 1 1 610 610 ASP N N 610 125.357 125.357 128.081 -2.724 18986 9338 1 20 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.743 -0.040 18986 9339 1 20 . 1 1 610 610 ASP C C 610 173.668 173.668 175.653 -1.985 18986 9340 1 20 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.208 -2.506 18986 9341 1 20 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.170 -3.480 18986 9342 1 20 . 1 1 610 610 ASP H H 610 8.369 8.369 8.423 -0.054 18986 9343 1 20 . 1 1 611 611 ILE N N 611 122.494 122.494 119.949 2.545 18986 9344 1 20 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.054 -0.145 18986 9345 1 20 . 1 1 611 611 ILE C C 611 173.618 173.618 176.595 -2.977 18986 9346 1 20 . 1 1 611 611 ILE CA C 611 60.040 60.040 62.988 -2.948 18986 9347 1 20 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.075 -2.277 18986 9348 1 20 . 1 1 611 611 ILE H H 611 8.284 8.284 8.116 0.168 18986 9349 1 20 . 1 1 612 612 ASP N N 612 121.440 121.440 119.278 2.162 18986 9350 1 20 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.363 0.071 18986 9351 1 20 . 1 1 612 612 ASP C C 612 175.129 175.129 178.250 -3.121 18986 9352 1 20 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.337 -3.571 18986 9353 1 20 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.170 -1.032 18986 9354 1 20 . 1 1 612 612 ASP H H 612 8.279 8.279 8.487 -0.208 18986 9355 1 20 . 1 1 613 613 THR N N 613 114.422 114.422 113.967 0.455 18986 9356 1 20 . 1 1 613 613 THR HA H 613 4.106 4.106 4.110 -0.004 18986 9357 1 20 . 1 1 613 613 THR C C 613 173.338 173.338 176.252 -2.914 18986 9358 1 20 . 1 1 613 613 THR CA C 613 61.545 61.545 64.889 -3.345 18986 9359 1 20 . 1 1 613 613 THR CB C 613 66.267 66.267 68.410 -2.143 18986 9360 1 20 . 1 1 613 613 THR H H 613 7.866 7.866 8.366 -0.500 18986 9361 1 20 . 1 1 614 614 ILE N N 614 121.654 121.654 121.454 0.200 18986 9362 1 20 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.020 0.009 18986 9363 1 20 . 1 1 614 614 ILE C C 614 174.471 174.471 177.742 -3.271 18986 9364 1 20 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.419 -3.246 18986 9365 1 20 . 1 1 614 614 ILE CB C 614 35.815 35.815 37.290 -1.475 18986 9366 1 20 . 1 1 614 614 ILE H H 614 7.819 7.819 7.603 0.216 18986 9367 1 20 . 1 1 615 615 MET N N 615 119.713 119.713 116.637 3.076 18986 9368 1 20 . 1 1 615 615 MET HA H 615 4.478 4.478 4.751 -0.273 18986 9369 1 20 . 1 1 615 615 MET C C 615 174.075 174.075 178.107 -4.032 18986 9370 1 20 . 1 1 615 615 MET CA C 615 52.764 52.764 56.389 -3.625 18986 9371 1 20 . 1 1 615 615 MET CB C 615 29.337 29.337 31.682 -2.345 18986 9372 1 20 . 1 1 615 615 MET H H 615 8.188 8.188 8.138 0.050 18986 9373 1 20 . 1 1 616 616 THR N N 616 114.770 114.770 115.225 -0.455 18986 9374 1 20 . 1 1 616 616 THR HA H 616 4.099 4.099 4.188 -0.089 18986 9375 1 20 . 1 1 616 616 THR C C 616 172.535 172.535 176.064 -3.529 18986 9376 1 20 . 1 1 616 616 THR CA C 616 61.112 61.112 64.958 -3.846 18986 9377 1 20 . 1 1 616 616 THR CB C 616 66.617 66.617 69.369 -2.752 18986 9378 1 20 . 1 1 616 616 THR H H 616 7.722 7.722 8.366 -0.644 18986 9379 1 20 . 1 1 617 617 GLY N N 617 111.384 111.384 106.147 5.237 18986 9380 1 20 . 1 1 617 617 GLY C C 617 171.437 171.437 173.652 -2.215 18986 9381 1 20 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.148 -2.706 18986 9382 1 20 . 1 1 617 617 GLY H H 617 8.431 8.431 7.687 0.744 18986 9383 1 20 . 1 1 618 618 LYS N N 618 120.996 120.996 121.033 -0.037 18986 9384 1 20 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.852 -0.185 18986 9385 1 20 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.843 -2.015 18986 9386 1 20 . 1 1 618 618 LYS CB C 618 29.477 29.477 34.158 -4.681 18986 9387 1 20 . 1 1 618 618 LYS H H 618 7.821 7.821 7.832 -0.011 18986 9388 1 20 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.530 -0.061 18986 9389 1 20 . 1 1 619 619 PRO C C 619 174.453 174.453 178.168 -3.715 18986 9390 1 20 . 1 1 619 619 PRO CA C 619 60.192 60.192 62.305 -2.113 18986 9391 1 20 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.788 -3.208 18986 9392 1 20 . 1 1 620 620 LYS N N 620 123.464 123.464 121.443 2.021 18986 9393 1 20 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.869 0.177 18986 9394 1 20 . 1 1 620 620 LYS C C 620 174.895 174.895 178.549 -3.654 18986 9395 1 20 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.873 -3.584 18986 9396 1 20 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.528 -1.074 18986 9397 1 20 . 1 1 620 620 LYS H H 620 8.728 8.728 8.674 0.054 18986 9398 1 20 . 1 1 621 621 SER N N 621 113.921 113.921 115.383 -1.462 18986 9399 1 20 . 1 1 621 621 SER HA H 621 4.336 4.336 4.132 0.204 18986 9400 1 20 . 1 1 621 621 SER C C 621 173.149 173.149 176.019 -2.870 18986 9401 1 20 . 1 1 621 621 SER CA C 621 56.691 56.691 60.945 -4.254 18986 9402 1 20 . 1 1 621 621 SER CB C 621 60.689 60.689 62.549 -1.860 18986 9403 1 20 . 1 1 621 621 SER H H 621 8.531 8.531 8.217 0.314 18986 9404 1 20 . 1 1 622 622 ALA N N 622 124.177 124.177 123.232 0.945 18986 9405 1 20 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.979 0.189 18986 9406 1 20 . 1 1 622 622 ALA C C 622 176.804 176.804 179.139 -2.335 18986 9407 1 20 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.431 -3.062 18986 9408 1 20 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.032 -2.178 18986 9409 1 20 . 1 1 622 622 ALA H H 622 7.835 7.835 8.257 -0.422 18986 9410 1 20 . 1 1 623 623 ARG N N 623 118.263 118.263 118.844 -0.581 18986 9411 1 20 . 1 1 623 623 ARG HA H 623 3.950 3.950 4.024 -0.074 18986 9412 1 20 . 1 1 623 623 ARG C C 623 175.683 175.683 178.696 -3.013 18986 9413 1 20 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.010 -1.847 18986 9414 1 20 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.395 -1.944 18986 9415 1 20 . 1 1 623 623 ARG H H 623 8.148 8.148 7.826 0.322 18986 9416 1 20 . 1 1 624 624 GLU N N 624 117.953 117.953 120.278 -2.325 18986 9417 1 20 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.077 -0.109 18986 9418 1 20 . 1 1 624 624 GLU C C 624 177.204 177.204 178.869 -1.665 18986 9419 1 20 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.169 -2.312 18986 9420 1 20 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.144 -2.177 18986 9421 1 20 . 1 1 624 624 GLU H H 624 8.143 8.143 8.588 -0.445 18986 9422 1 20 . 1 1 625 625 LYS N N 625 119.222 119.222 118.872 0.350 18986 9423 1 20 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.229 -0.372 18986 9424 1 20 . 1 1 625 625 LYS C C 625 175.480 175.480 179.007 -3.527 18986 9425 1 20 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.964 -1.476 18986 9426 1 20 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.856 -2.193 18986 9427 1 20 . 1 1 625 625 LYS H H 625 7.772 7.772 7.966 -0.194 18986 9428 1 20 . 1 1 626 626 MET N N 626 117.883 117.883 120.075 -2.192 18986 9429 1 20 . 1 1 626 626 MET HA H 626 3.807 3.807 4.014 -0.207 18986 9430 1 20 . 1 1 626 626 MET C C 626 175.278 175.278 178.583 -3.305 18986 9431 1 20 . 1 1 626 626 MET CA C 626 57.782 57.782 59.537 -1.755 18986 9432 1 20 . 1 1 626 626 MET CB C 626 30.657 30.657 32.758 -2.102 18986 9433 1 20 . 1 1 626 626 MET H H 626 8.367 8.367 8.633 -0.266 18986 9434 1 20 . 1 1 627 627 MET N N 627 116.185 116.185 116.732 -0.547 18986 9435 1 20 . 1 1 627 627 MET HA H 627 4.152 4.152 4.009 0.143 18986 9436 1 20 . 1 1 627 627 MET C C 627 176.393 176.393 178.345 -1.952 18986 9437 1 20 . 1 1 627 627 MET CA C 627 55.359 55.359 58.197 -2.838 18986 9438 1 20 . 1 1 627 627 MET CB C 627 28.803 28.803 31.213 -2.410 18986 9439 1 20 . 1 1 627 627 MET H H 627 8.197 8.197 8.701 -0.504 18986 9440 1 20 . 1 1 628 628 LYS N N 628 119.859 119.859 120.069 -0.210 18986 9441 1 20 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.290 -0.090 18986 9442 1 20 . 1 1 628 628 LYS C C 628 175.885 175.885 179.586 -3.701 18986 9443 1 20 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.048 -3.971 18986 9444 1 20 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.032 -3.501 18986 9445 1 20 . 1 1 628 628 LYS H H 628 7.700 7.700 7.612 0.088 18986 9446 1 20 . 1 1 629 629 ILE N N 629 119.001 119.001 120.137 -1.136 18986 9447 1 20 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.651 -0.103 18986 9448 1 20 . 1 1 629 629 ILE C C 629 174.891 174.891 178.084 -3.193 18986 9449 1 20 . 1 1 629 629 ILE CA C 629 62.265 62.265 66.000 -3.735 18986 9450 1 20 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.880 -4.032 18986 9451 1 20 . 1 1 629 629 ILE H H 629 7.970 7.970 8.317 -0.347 18986 9452 1 20 . 1 1 630 630 ILE N N 630 120.737 120.737 117.424 3.313 18986 9453 1 20 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.641 -0.174 18986 9454 1 20 . 1 1 630 630 ILE C C 630 173.875 173.875 177.772 -3.897 18986 9455 1 20 . 1 1 630 630 ILE CA C 630 62.754 62.754 64.761 -2.007 18986 9456 1 20 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.856 -2.579 18986 9457 1 20 . 1 1 630 630 ILE H H 630 8.213 8.213 8.408 -0.195 18986 9458 1 20 . 1 1 631 631 GLU N N 631 119.546 119.546 120.980 -1.434 18986 9459 1 20 . 1 1 631 631 GLU HA H 631 4.065 4.065 3.927 0.138 18986 9460 1 20 . 1 1 631 631 GLU C C 631 177.300 177.300 178.925 -1.625 18986 9461 1 20 . 1 1 631 631 GLU CA C 631 56.980 56.980 60.102 -3.122 18986 9462 1 20 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.670 -2.677 18986 9463 1 20 . 1 1 631 631 GLU H H 631 7.742 7.742 8.043 -0.301 18986 9464 1 20 . 1 1 632 632 ILE N N 632 121.547 121.547 120.561 0.986 18986 9465 1 20 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.656 0.027 18986 9466 1 20 . 1 1 632 632 ILE C C 632 175.454 175.454 177.992 -2.538 18986 9467 1 20 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.688 -3.032 18986 9468 1 20 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.878 -2.048 18986 9469 1 20 . 1 1 632 632 ILE H H 632 8.013 8.013 7.967 0.046 18986 9470 1 20 . 1 1 633 633 ILE N N 633 121.605 121.605 120.016 1.589 18986 9471 1 20 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.517 -0.182 18986 9472 1 20 . 1 1 633 633 ILE C C 633 174.558 174.558 177.732 -3.174 18986 9473 1 20 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.772 -1.853 18986 9474 1 20 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.125 -1.841 18986 9475 1 20 . 1 1 633 633 ILE H H 633 8.594 8.594 8.376 0.218 18986 9476 1 20 . 1 1 634 634 ASP N N 634 118.706 118.706 120.253 -1.547 18986 9477 1 20 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.255 0.180 18986 9478 1 20 . 1 1 634 634 ASP C C 634 176.574 176.574 178.561 -1.987 18986 9479 1 20 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.795 -3.224 18986 9480 1 20 . 1 1 634 634 ASP CB C 634 37.914 37.914 41.027 -3.113 18986 9481 1 20 . 1 1 634 634 ASP H H 634 8.724 8.724 8.489 0.235 18986 9482 1 20 . 1 1 635 635 SER N N 635 114.064 114.064 115.881 -1.817 18986 9483 1 20 . 1 1 635 635 SER HA H 635 4.232 4.232 4.174 0.058 18986 9484 1 20 . 1 1 635 635 SER C C 635 174.487 174.487 176.831 -2.344 18986 9485 1 20 . 1 1 635 635 SER CA C 635 58.540 58.540 61.314 -2.774 18986 9486 1 20 . 1 1 635 635 SER CB C 635 60.319 60.319 63.134 -2.815 18986 9487 1 20 . 1 1 635 635 SER H H 635 7.992 7.992 7.924 0.068 18986 9488 1 20 . 1 1 636 636 LEU N N 636 122.493 122.493 121.223 1.270 18986 9489 1 20 . 1 1 636 636 LEU HA H 636 4.254 4.254 3.955 0.299 18986 9490 1 20 . 1 1 636 636 LEU C C 636 176.194 176.194 178.642 -2.448 18986 9491 1 20 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.829 -3.734 18986 9492 1 20 . 1 1 636 636 LEU CB C 636 39.706 39.706 42.007 -2.301 18986 9493 1 20 . 1 1 636 636 LEU H H 636 8.169 8.169 8.409 -0.240 18986 9494 1 20 . 1 1 637 637 ALA N N 637 121.891 121.891 117.566 4.325 18986 9495 1 20 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.318 -0.229 18986 9496 1 20 . 1 1 637 637 ALA C C 637 175.131 175.131 177.733 -2.602 18986 9497 1 20 . 1 1 637 637 ALA CA C 637 50.336 50.336 53.431 -3.095 18986 9498 1 20 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.399 -2.911 18986 9499 1 20 . 1 1 637 637 ALA H H 637 8.482 8.482 8.518 -0.036 18986 9500 1 20 . 1 1 638 638 VAL N N 638 117.140 117.140 117.697 -0.557 18986 9501 1 20 . 1 1 638 638 VAL HA H 638 3.935 3.935 4.177 -0.242 18986 9502 1 20 . 1 1 638 638 VAL C C 638 174.712 174.712 177.191 -2.479 18986 9503 1 20 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.212 -2.211 18986 9504 1 20 . 1 1 638 638 VAL CB C 638 29.351 29.351 32.617 -3.266 18986 9505 1 20 . 1 1 638 638 VAL H H 638 7.291 7.291 7.424 -0.133 18986 9506 1 20 . 1 1 639 639 SER N N 639 114.143 114.143 115.478 -1.335 18986 9507 1 20 . 1 1 639 639 SER HA H 639 4.481 4.481 4.405 0.076 18986 9508 1 20 . 1 1 639 639 SER C C 639 172.122 172.122 174.238 -2.116 18986 9509 1 20 . 1 1 639 639 SER CA C 639 56.002 56.002 60.333 -4.331 18986 9510 1 20 . 1 1 639 639 SER CB C 639 60.921 60.921 63.735 -2.814 18986 9511 1 20 . 1 1 639 639 SER H H 639 7.918 7.918 8.191 -0.273 18986 9512 1 20 . 1 1 640 640 SER N N 640 115.370 115.370 113.533 1.837 18986 9513 1 20 . 1 1 640 640 SER HA H 640 4.711 4.711 4.595 0.116 18986 9514 1 20 . 1 1 640 640 SER C C 640 171.185 171.185 173.439 -2.254 18986 9515 1 20 . 1 1 640 640 SER CA C 640 55.009 55.009 56.916 -1.907 18986 9516 1 20 . 1 1 640 640 SER CB C 640 61.974 61.974 64.409 -2.435 18986 9517 1 20 . 1 1 640 640 SER H H 640 7.765 7.765 7.504 0.261 18986 9518 1 20 . 1 1 641 641 GLU N N 641 119.994 119.994 119.707 0.287 18986 9519 1 20 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.163 -0.119 18986 9520 1 20 . 1 1 641 641 GLU C C 641 173.167 173.167 175.766 -2.599 18986 9521 1 20 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.808 -2.157 18986 9522 1 20 . 1 1 641 641 GLU CB C 641 27.484 27.484 30.041 -2.557 18986 9523 1 20 . 1 1 641 641 GLU H H 641 8.363 8.363 8.711 -0.348 18986 9524 1 20 . 1 1 642 642 CYS N N 642 110.257 110.257 112.750 -2.493 18986 9525 1 20 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.681 -0.222 18986 9526 1 20 . 1 1 642 642 CYS C C 642 168.058 168.058 173.283 -5.225 18986 9527 1 20 . 1 1 642 642 CYS CA C 642 50.946 50.946 55.984 -5.038 18986 9528 1 20 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.618 9.743 18986 9529 1 20 . 1 1 642 642 CYS H H 642 7.881 7.881 7.374 0.507 18986 9530 1 20 . 1 1 643 643 ALA N N 643 123.922 123.922 124.555 -0.633 18986 9531 1 20 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.539 0.099 18986 9532 1 20 . 1 1 643 643 ALA C C 643 172.517 172.517 176.489 -3.972 18986 9533 1 20 . 1 1 643 643 ALA CA C 643 47.620 47.620 50.963 -3.343 18986 9534 1 20 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.169 0.275 18986 9535 1 20 . 1 1 643 643 ALA H H 643 9.787 9.787 8.979 0.808 18986 9536 1 20 . 1 1 644 644 LYS N N 644 128.479 128.479 126.135 2.344 18986 9537 1 20 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.445 0.066 18986 9538 1 20 . 1 1 644 644 LYS C C 644 176.945 176.945 177.505 -0.560 18986 9539 1 20 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.479 -2.141 18986 9540 1 20 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.154 -2.212 18986 9541 1 20 . 1 1 644 644 LYS H H 644 9.809 9.809 8.539 1.270 18986 9542 1 20 . 1 1 645 645 VAL N N 645 124.257 124.257 126.804 -2.547 18986 9543 1 20 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.534 0.114 18986 9544 1 20 . 1 1 645 645 VAL C C 645 173.996 173.996 177.596 -3.600 18986 9545 1 20 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.652 -1.790 18986 9546 1 20 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.387 -2.186 18986 9547 1 20 . 1 1 645 645 VAL H H 645 8.458 8.458 9.132 -0.674 18986 9548 1 20 . 1 1 646 646 LYS N N 646 117.598 117.598 119.946 -2.348 18986 9549 1 20 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.915 0.092 18986 9550 1 20 . 1 1 646 646 LYS C C 646 176.047 176.047 178.960 -2.913 18986 9551 1 20 . 1 1 646 646 LYS CA C 646 57.245 57.245 59.942 -2.697 18986 9552 1 20 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.581 -2.183 18986 9553 1 20 . 1 1 646 646 LYS H H 646 8.706 8.706 8.394 0.312 18986 9554 1 20 . 1 1 647 647 ASP N N 647 119.229 119.229 119.938 -0.709 18986 9555 1 20 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.512 0.106 18986 9556 1 20 . 1 1 647 647 ASP C C 647 175.211 175.211 178.543 -3.332 18986 9557 1 20 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.026 -2.703 18986 9558 1 20 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.722 -1.984 18986 9559 1 20 . 1 1 647 647 ASP H H 647 7.012 7.012 7.961 -0.949 18986 9560 1 20 . 1 1 648 648 ILE N N 648 121.939 121.939 120.938 1.001 18986 9561 1 20 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.558 -0.177 18986 9562 1 20 . 1 1 648 648 ILE C C 648 175.243 175.243 177.907 -2.664 18986 9563 1 20 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.753 -2.712 18986 9564 1 20 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.828 -1.866 18986 9565 1 20 . 1 1 648 648 ILE H H 648 8.152 8.152 7.712 0.440 18986 9566 1 20 . 1 1 649 649 LEU N N 649 117.310 117.310 120.263 -2.953 18986 9567 1 20 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.767 0.106 18986 9568 1 20 . 1 1 649 649 LEU C C 649 176.439 176.439 178.979 -2.540 18986 9569 1 20 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.456 -2.571 18986 9570 1 20 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.313 -2.007 18986 9571 1 20 . 1 1 649 649 LEU H H 649 8.638 8.638 8.459 0.179 18986 9572 1 20 . 1 1 650 650 LYS N N 650 118.810 118.810 119.727 -0.917 18986 9573 1 20 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.863 0.183 18986 9574 1 20 . 1 1 650 650 LYS C C 650 176.801 176.801 179.113 -2.312 18986 9575 1 20 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.983 -2.932 18986 9576 1 20 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.222 -2.158 18986 9577 1 20 . 1 1 650 650 LYS H H 650 7.296 7.296 8.136 -0.840 18986 9578 1 20 . 1 1 651 651 GLU N N 651 117.713 117.713 118.328 -0.615 18986 9579 1 20 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.080 0.028 18986 9580 1 20 . 1 1 651 651 GLU C C 651 176.903 176.903 179.178 -2.275 18986 9581 1 20 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.687 -2.877 18986 9582 1 20 . 1 1 651 651 GLU CB C 651 27.448 27.448 28.962 -1.514 18986 9583 1 20 . 1 1 651 651 GLU H H 651 8.036 8.036 8.318 -0.282 18986 9584 1 20 . 1 1 652 652 ALA N N 652 121.206 121.206 122.223 -1.017 18986 9585 1 20 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.102 -0.104 18986 9586 1 20 . 1 1 652 652 ALA C C 652 176.766 176.766 179.960 -3.194 18986 9587 1 20 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.166 -3.432 18986 9588 1 20 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.172 -2.856 18986 9589 1 20 . 1 1 652 652 ALA H H 652 8.973 8.973 8.482 0.491 18986 9590 1 20 . 1 1 653 653 GLN N N 653 117.768 117.768 117.904 -0.136 18986 9591 1 20 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.341 0.136 18986 9592 1 20 . 1 1 653 653 GLN C C 653 177.388 177.388 178.765 -1.377 18986 9593 1 20 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.554 -2.494 18986 9594 1 20 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.814 -2.045 18986 9595 1 20 . 1 1 653 653 GLN H H 653 8.059 8.059 8.284 -0.225 18986 9596 1 20 . 1 1 654 654 GLN N N 654 117.979 117.979 118.605 -0.626 18986 9597 1 20 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.103 0.074 18986 9598 1 20 . 1 1 654 654 GLN C C 654 174.834 174.834 178.634 -3.800 18986 9599 1 20 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.008 -2.590 18986 9600 1 20 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.507 -2.530 18986 9601 1 20 . 1 1 654 654 GLN H H 654 7.495 7.495 8.129 -0.634 18986 9602 1 20 . 1 1 655 655 VAL N N 655 110.080 110.080 116.739 -6.659 18986 9603 1 20 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.859 0.668 18986 9604 1 20 . 1 1 655 655 VAL C C 655 173.369 173.369 176.852 -3.483 18986 9605 1 20 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.436 -6.369 18986 9606 1 20 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.073 -3.889 18986 9607 1 20 . 1 1 655 655 VAL H H 655 7.197 7.197 8.127 -0.930 18986 9608 1 20 . 1 1 656 656 GLY N N 656 107.089 107.089 105.883 1.206 18986 9609 1 20 . 1 1 656 656 GLY C C 656 171.639 171.639 174.377 -2.738 18986 9610 1 20 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.792 -1.481 18986 9611 1 20 . 1 1 656 656 GLY H H 656 7.541 7.541 7.812 -0.271 18986 9612 1 20 . 1 1 657 657 ILE N N 657 121.266 121.266 120.747 0.519 18986 9613 1 20 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.266 -0.132 18986 9614 1 20 . 1 1 657 657 ILE C C 657 171.885 171.885 175.372 -3.487 18986 9615 1 20 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.730 -2.500 18986 9616 1 20 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.448 -4.257 18986 9617 1 20 . 1 1 657 657 ILE H H 657 7.633 7.633 8.411 -0.778 18986 9618 1 20 . 1 1 658 658 GLU N N 658 127.252 127.252 121.411 5.841 18986 9619 1 20 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.580 -0.377 18986 9620 1 20 . 1 1 658 658 GLU C C 658 175.316 175.316 176.885 -1.569 18986 9621 1 20 . 1 1 658 658 GLU CA C 658 54.360 54.360 54.674 -0.314 18986 9622 1 20 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.379 -3.769 18986 9623 1 20 . 1 1 658 658 GLU H H 658 8.690 8.690 8.500 0.190 18986 9624 1 20 . 1 1 659 659 LYS N N 659 124.533 124.533 127.262 -2.729 18986 9625 1 20 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.795 -0.007 18986 9626 1 20 . 1 1 659 659 LYS C C 659 175.170 175.170 177.810 -2.640 18986 9627 1 20 . 1 1 659 659 LYS CA C 659 58.171 58.171 59.998 -1.827 18986 9628 1 20 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.694 -1.577 18986 9629 1 20 . 1 1 659 659 LYS H H 659 8.706 8.706 9.085 -0.379 18986 9630 1 20 . 1 1 660 660 SER N N 660 113.137 113.137 114.800 -1.663 18986 9631 1 20 . 1 1 660 660 SER HA H 660 4.273 4.273 4.298 -0.025 18986 9632 1 20 . 1 1 660 660 SER C C 660 173.939 173.939 176.524 -2.585 18986 9633 1 20 . 1 1 660 660 SER CA C 660 58.350 58.350 60.552 -2.202 18986 9634 1 20 . 1 1 660 660 SER CB C 660 59.504 59.504 62.833 -3.329 18986 9635 1 20 . 1 1 660 660 SER H H 660 8.777 8.777 8.843 -0.066 18986 9636 1 20 . 1 1 661 661 ASN N N 661 119.986 119.986 119.773 0.213 18986 9637 1 20 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.435 0.271 18986 9638 1 20 . 1 1 661 661 ASN C C 661 174.516 174.516 177.228 -2.712 18986 9639 1 20 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.706 -4.658 18986 9640 1 20 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.505 -1.762 18986 9641 1 20 . 1 1 661 661 ASN H H 661 7.486 7.486 8.255 -0.769 18986 9642 1 20 . 1 1 662 662 ILE N N 662 120.639 120.639 120.713 -0.074 18986 9643 1 20 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.737 -0.291 18986 9644 1 20 . 1 1 662 662 ILE C C 662 174.252 174.252 178.022 -3.770 18986 9645 1 20 . 1 1 662 662 ILE CA C 662 62.606 62.606 63.756 -1.150 18986 9646 1 20 . 1 1 662 662 ILE CB C 662 34.423 34.423 36.870 -2.447 18986 9647 1 20 . 1 1 662 662 ILE H H 662 7.999 7.999 8.112 -0.113 18986 9648 1 20 . 1 1 663 663 GLU N N 663 117.706 117.706 120.235 -2.529 18986 9649 1 20 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.893 -0.103 18986 9650 1 20 . 1 1 663 663 GLU C C 663 176.509 176.509 178.964 -2.455 18986 9651 1 20 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.175 -2.467 18986 9652 1 20 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.458 -2.703 18986 9653 1 20 . 1 1 663 663 GLU H H 663 8.190 8.190 8.511 -0.321 18986 9654 1 20 . 1 1 664 664 LYS N N 664 119.586 119.586 120.854 -1.268 18986 9655 1 20 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.124 -0.071 18986 9656 1 20 . 1 1 664 664 LYS C C 664 175.941 175.941 178.783 -2.842 18986 9657 1 20 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.045 -2.464 18986 9658 1 20 . 1 1 664 664 LYS CB C 664 29.823 29.823 31.854 -2.031 18986 9659 1 20 . 1 1 664 664 LYS H H 664 7.590 7.590 8.329 -0.739 18986 9660 1 20 . 1 1 665 665 LEU N N 665 119.756 119.756 121.661 -1.905 18986 9661 1 20 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.087 -0.007 18986 9662 1 20 . 1 1 665 665 LEU C C 665 176.700 176.700 179.073 -2.373 18986 9663 1 20 . 1 1 665 665 LEU CA C 665 55.385 55.385 58.795 -3.410 18986 9664 1 20 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.724 -2.532 18986 9665 1 20 . 1 1 665 665 LEU H H 665 8.075 8.075 8.128 -0.053 18986 9666 1 20 . 1 1 666 666 LEU N N 666 118.788 118.788 119.675 -0.887 18986 9667 1 20 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.703 0.061 18986 9668 1 20 . 1 1 666 666 LEU C C 666 176.484 176.484 179.048 -2.564 18986 9669 1 20 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.572 -2.914 18986 9670 1 20 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.938 -2.326 18986 9671 1 20 . 1 1 666 666 LEU H H 666 8.550 8.550 8.738 -0.188 18986 9672 1 20 . 1 1 667 667 THR N N 667 115.244 115.244 115.733 -0.489 18986 9673 1 20 . 1 1 667 667 THR HA H 667 3.839 3.839 4.111 -0.272 18986 9674 1 20 . 1 1 667 667 THR C C 667 173.740 173.740 176.962 -3.222 18986 9675 1 20 . 1 1 667 667 THR CA C 667 64.378 64.378 67.218 -2.840 18986 9676 1 20 . 1 1 667 667 THR CB C 667 65.748 65.748 68.105 -2.357 18986 9677 1 20 . 1 1 667 667 THR H H 667 7.662 7.662 7.940 -0.278 18986 9678 1 20 . 1 1 668 668 ASP N N 668 122.862 122.862 122.667 0.195 18986 9679 1 20 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.443 -0.060 18986 9680 1 20 . 1 1 668 668 ASP C C 668 177.192 177.192 178.898 -1.706 18986 9681 1 20 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.446 -2.315 18986 9682 1 20 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.483 -2.597 18986 9683 1 20 . 1 1 668 668 ASP H H 668 8.291 8.291 8.458 -0.167 18986 9684 1 20 . 1 1 669 669 MET N N 669 119.640 119.640 118.758 0.882 18986 9685 1 20 . 1 1 669 669 MET HA H 669 3.917 3.917 4.165 -0.248 18986 9686 1 20 . 1 1 669 669 MET C C 669 175.414 175.414 178.589 -3.175 18986 9687 1 20 . 1 1 669 669 MET CA C 669 57.234 57.234 59.282 -2.048 18986 9688 1 20 . 1 1 669 669 MET CB C 669 32.088 32.088 32.342 -0.254 18986 9689 1 20 . 1 1 669 669 MET H H 669 8.809 8.809 8.546 0.263 18986 9690 1 20 . 1 1 670 670 ARG N N 670 122.614 122.614 119.984 2.630 18986 9691 1 20 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.457 0.060 18986 9692 1 20 . 1 1 670 670 ARG C C 670 177.928 177.928 178.586 -0.658 18986 9693 1 20 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.619 -2.397 18986 9694 1 20 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.877 -2.572 18986 9695 1 20 . 1 1 670 670 ARG H H 670 8.450 8.450 8.622 -0.172 18986 9696 1 20 . 1 1 671 671 LYS N N 671 121.976 121.976 119.577 2.399 18986 9697 1 20 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.224 -0.111 18986 9698 1 20 . 1 1 671 671 LYS C C 671 176.143 176.143 178.394 -2.251 18986 9699 1 20 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.595 -1.509 18986 9700 1 20 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.690 -3.186 18986 9701 1 20 . 1 1 671 671 LYS H H 671 8.609 8.609 8.145 0.464 18986 9702 1 20 . 1 1 672 672 SER N N 672 111.655 111.655 112.638 -0.983 18986 9703 1 20 . 1 1 672 672 SER HA H 672 4.469 4.469 4.285 0.184 18986 9704 1 20 . 1 1 672 672 SER C C 672 171.692 171.692 175.795 -4.103 18986 9705 1 20 . 1 1 672 672 SER CA C 672 56.790 56.790 59.849 -3.059 18986 9706 1 20 . 1 1 672 672 SER CB C 672 61.343 61.343 64.256 -2.913 18986 9707 1 20 . 1 1 672 672 SER H H 672 7.884 7.884 8.119 -0.235 18986 9708 1 20 . 1 1 673 673 GLY N N 673 108.029 108.029 107.643 0.386 18986 9709 1 20 . 1 1 673 673 GLY C C 673 171.492 171.492 175.304 -3.812 18986 9710 1 20 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.193 -1.918 18986 9711 1 20 . 1 1 673 673 GLY H H 673 7.774 7.774 8.187 -0.413 18986 9712 1 20 . 1 1 674 674 ILE N N 674 116.193 116.193 120.560 -4.367 18986 9713 1 20 . 1 1 674 674 ILE HA H 674 4.101 4.101 3.895 0.206 18986 9714 1 20 . 1 1 674 674 ILE C C 674 173.980 173.980 176.098 -2.118 18986 9715 1 20 . 1 1 674 674 ILE CA C 674 60.242 60.242 64.425 -4.183 18986 9716 1 20 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.495 -1.691 18986 9717 1 20 . 1 1 674 674 ILE H H 674 8.026 8.026 7.832 0.194 18986 9718 1 20 . 1 1 675 675 ILE N N 675 108.928 108.928 113.326 -4.398 18986 9719 1 20 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.778 0.580 18986 9720 1 20 . 1 1 675 675 ILE C C 675 170.797 170.797 174.519 -3.722 18986 9721 1 20 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.419 -2.395 18986 9722 1 20 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.894 -2.408 18986 9723 1 20 . 1 1 675 675 ILE H H 675 7.120 7.120 7.492 -0.372 18986 9724 1 20 . 1 1 676 676 TYR N N 676 118.062 118.062 114.848 3.214 18986 9725 1 20 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.047 -0.052 18986 9726 1 20 . 1 1 676 676 TYR C C 676 170.020 170.020 174.156 -4.136 18986 9727 1 20 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.990 -3.097 18986 9728 1 20 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.247 -1.731 18986 9729 1 20 . 1 1 676 676 TYR H H 676 9.380 9.380 8.424 0.956 18986 9730 1 20 . 1 1 677 677 GLU N N 677 123.578 123.578 121.839 1.739 18986 9731 1 20 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.544 0.282 18986 9732 1 20 . 1 1 677 677 GLU C C 677 172.146 172.146 175.795 -3.649 18986 9733 1 20 . 1 1 677 677 GLU CA C 677 52.476 52.476 55.522 -3.046 18986 9734 1 20 . 1 1 677 677 GLU CB C 677 26.612 26.612 27.538 -0.926 18986 9735 1 20 . 1 1 677 677 GLU H H 677 8.951 8.951 8.769 0.182 18986 9736 1 20 . 1 1 678 678 ALA N N 678 133.220 133.220 123.530 9.690 18986 9737 1 20 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.148 -0.107 18986 9738 1 20 . 1 1 678 678 ALA C C 678 175.219 175.219 177.871 -2.652 18986 9739 1 20 . 1 1 678 678 ALA CA C 678 51.601 51.601 54.088 -2.487 18986 9740 1 20 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.436 -2.837 18986 9741 1 20 . 1 1 678 678 ALA H H 678 7.912 7.912 8.296 -0.384 18986 9742 1 20 . 1 1 679 679 LYS N N 679 115.687 115.687 114.836 0.851 18986 9743 1 20 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.821 -0.386 18986 9744 1 20 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.636 -1.620 18986 9745 1 20 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.282 -3.287 18986 9746 1 20 . 1 1 679 679 LYS H H 679 8.215 8.215 7.561 0.654 18986 9747 1 20 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.303 -0.284 18986 9748 1 20 . 1 1 680 680 PRO C C 680 174.504 174.504 176.555 -2.051 18986 9749 1 20 . 1 1 680 680 PRO CA C 680 62.518 62.518 64.356 -1.838 18986 9750 1 20 . 1 1 680 680 PRO CB C 680 28.315 28.315 32.108 -3.793 18986 9751 1 20 . 1 1 681 681 GLU N N 681 118.851 118.851 118.556 0.295 18986 9752 1 20 . 1 1 681 681 GLU HA H 681 3.438 3.438 4.165 -0.727 18986 9753 1 20 . 1 1 681 681 GLU C C 681 172.890 172.890 175.786 -2.896 18986 9754 1 20 . 1 1 681 681 GLU CA C 681 54.481 54.481 57.991 -3.510 18986 9755 1 20 . 1 1 681 681 GLU CB C 681 24.789 24.789 28.861 -4.072 18986 9756 1 20 . 1 1 681 681 GLU H H 681 10.003 10.003 8.906 1.097 18986 9757 1 20 . 1 1 682 682 CYS N N 682 120.934 120.934 118.508 2.426 18986 9758 1 20 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.192 -0.165 18986 9759 1 20 . 1 1 682 682 CYS C C 682 171.905 171.905 173.747 -1.842 18986 9760 1 20 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.669 -3.425 18986 9761 1 20 . 1 1 682 682 CYS CB C 682 45.295 45.295 28.422 16.873 18986 9762 1 20 . 1 1 682 682 CYS H H 682 7.860 7.860 8.180 -0.320 18986 9763 1 20 . 1 1 683 683 TYR N N 683 126.183 126.183 123.293 2.890 18986 9764 1 20 . 1 1 683 683 TYR HA H 683 5.224 5.224 4.886 0.338 18986 9765 1 20 . 1 1 683 683 TYR C C 683 173.008 173.008 174.801 -1.793 18986 9766 1 20 . 1 1 683 683 TYR CA C 683 56.568 56.568 58.027 -1.459 18986 9767 1 20 . 1 1 683 683 TYR CB C 683 40.952 40.952 40.535 0.417 18986 9768 1 20 . 1 1 683 683 TYR H H 683 9.297 9.297 9.188 0.109 18986 9769 1 20 . 1 1 684 684 LYS N N 684 118.604 118.604 120.450 -1.846 18986 9770 1 20 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.690 -0.253 18986 9771 1 20 . 1 1 684 684 LYS C C 684 171.628 171.628 174.711 -3.083 18986 9772 1 20 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.975 -1.672 18986 9773 1 20 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.123 -1.446 18986 9774 1 20 . 1 1 684 684 LYS H H 684 8.630 8.630 9.094 -0.464 18986 9775 1 20 . 1 1 685 685 LYS N N 685 122.869 122.869 127.852 -4.983 18986 9776 1 20 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.080 0.564 18986 9777 1 20 . 1 1 685 685 LYS C C 685 173.337 173.337 176.232 -2.895 18986 9778 1 20 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.046 -1.793 18986 9779 1 20 . 1 1 685 685 LYS CB C 685 30.927 30.927 31.929 -1.002 18986 9780 1 20 . 1 1 685 685 LYS H H 685 8.969 8.969 8.578 0.391 18986 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 81 2.302 -0.116 2.313 18986 2 1 1 "Average Difference" HA 90 0.226 0.027 0.226 18986 3 1 1 "Average Difference" C 82 2.801 2.694 0.770 18986 4 1 1 "Average Difference" CA 85 2.856 2.658 1.053 18986 5 1 1 "Average Difference" CB 80 3.589 2.227 2.832 18986 6 1 1 "Average Difference" HN 81 0.431 0.088 0.424 18986 7 1 2 "Average Difference" N 81 2.286 -0.286 2.282 18986 8 1 2 "Average Difference" HA 90 0.236 0.035 0.234 18986 9 1 2 "Average Difference" C 82 2.818 2.632 1.012 18986 10 1 2 "Average Difference" CA 85 2.928 2.701 1.135 18986 11 1 2 "Average Difference" CB 80 3.439 2.182 2.675 18986 12 1 2 "Average Difference" HN 81 0.486 0.038 0.488 18986 13 1 3 "Average Difference" N 81 2.535 -0.167 2.545 18986 14 1 3 "Average Difference" HA 90 0.258 0.043 0.255 18986 15 1 3 "Average Difference" C 82 2.808 2.667 0.885 18986 16 1 3 "Average Difference" CA 85 2.862 2.661 1.058 18986 17 1 3 "Average Difference" CB 80 3.360 2.240 2.520 18986 18 1 3 "Average Difference" HN 81 0.432 0.043 0.432 18986 19 1 4 "Average Difference" N 81 2.046 0.138 2.054 18986 20 1 4 "Average Difference" HA 90 0.195 0.028 0.195 18986 21 1 4 "Average Difference" C 82 2.877 2.743 0.873 18986 22 1 4 "Average Difference" CA 85 2.870 2.681 1.030 18986 23 1 4 "Average Difference" CB 80 3.438 2.110 2.732 18986 24 1 4 "Average Difference" HN 81 0.448 0.072 0.445 18986 25 1 5 "Average Difference" N 81 2.053 0.209 2.055 18986 26 1 5 "Average Difference" HA 90 0.234 0.021 0.234 18986 27 1 5 "Average Difference" C 82 2.774 2.629 0.888 18986 28 1 5 "Average Difference" CA 85 2.941 2.741 1.072 18986 29 1 5 "Average Difference" CB 80 3.422 2.214 2.626 18986 30 1 5 "Average Difference" HN 81 0.436 0.020 0.438 18986 31 1 6 "Average Difference" N 81 2.293 0.177 2.300 18986 32 1 6 "Average Difference" HA 90 0.200 0.039 0.197 18986 33 1 6 "Average Difference" C 82 2.814 2.654 0.943 18986 34 1 6 "Average Difference" CA 85 2.805 2.608 1.037 18986 35 1 6 "Average Difference" CB 80 3.407 2.156 2.654 18986 36 1 6 "Average Difference" HN 81 0.463 0.072 0.460 18986 37 1 7 "Average Difference" N 81 2.151 -0.006 2.165 18986 38 1 7 "Average Difference" HA 90 0.212 0.023 0.212 18986 39 1 7 "Average Difference" C 82 2.851 2.736 0.804 18986 40 1 7 "Average Difference" CA 85 2.906 2.746 0.957 18986 41 1 7 "Average Difference" CB 80 3.469 2.102 2.777 18986 42 1 7 "Average Difference" HN 81 0.421 0.054 0.420 18986 43 1 8 "Average Difference" N 81 2.147 0.196 2.151 18986 44 1 8 "Average Difference" HA 90 0.203 -0.012 0.203 18986 45 1 8 "Average Difference" C 82 2.908 2.784 0.844 18986 46 1 8 "Average Difference" CA 85 2.958 2.773 1.037 18986 47 1 8 "Average Difference" CB 80 3.340 2.017 2.680 18986 48 1 8 "Average Difference" HN 81 0.469 0.072 0.467 18986 49 1 9 "Average Difference" N 81 2.318 -0.175 2.326 18986 50 1 9 "Average Difference" HA 90 0.249 -0.005 0.250 18986 51 1 9 "Average Difference" C 82 2.913 2.787 0.850 18986 52 1 9 "Average Difference" CA 85 2.960 2.752 1.096 18986 53 1 9 "Average Difference" CB 80 3.188 2.120 2.396 18986 54 1 9 "Average Difference" HN 81 0.496 0.074 0.493 18986 55 1 10 "Average Difference" N 81 2.951 -0.161 2.965 18986 56 1 10 "Average Difference" HA 90 0.235 -0.006 0.236 18986 57 1 10 "Average Difference" C 82 3.008 2.796 1.116 18986 58 1 10 "Average Difference" CA 85 2.902 2.666 1.154 18986 59 1 10 "Average Difference" CB 80 3.197 2.146 2.385 18986 60 1 10 "Average Difference" HN 81 0.444 0.061 0.443 18986 61 1 11 "Average Difference" N 81 2.995 -0.213 3.006 18986 62 1 11 "Average Difference" HA 90 0.233 0.019 0.234 18986 63 1 11 "Average Difference" C 82 2.925 2.706 1.117 18986 64 1 11 "Average Difference" CA 85 2.912 2.697 1.104 18986 65 1 11 "Average Difference" CB 80 3.433 2.310 2.555 18986 66 1 11 "Average Difference" HN 81 0.446 0.057 0.445 18986 67 1 12 "Average Difference" N 81 3.007 -0.500 2.984 18986 68 1 12 "Average Difference" HA 90 0.217 -0.004 0.218 18986 69 1 12 "Average Difference" C 82 2.867 2.650 1.101 18986 70 1 12 "Average Difference" CA 85 2.911 2.720 1.045 18986 71 1 12 "Average Difference" CB 80 3.286 2.175 2.479 18986 72 1 12 "Average Difference" HN 81 0.455 0.011 0.457 18986 73 1 13 "Average Difference" N 81 3.038 -0.277 3.044 18986 74 1 13 "Average Difference" HA 90 0.208 0.017 0.209 18986 75 1 13 "Average Difference" C 82 2.862 2.646 1.096 18986 76 1 13 "Average Difference" CA 85 3.026 2.775 1.213 18986 77 1 13 "Average Difference" CB 80 3.441 2.116 2.730 18986 78 1 13 "Average Difference" HN 81 0.491 0.083 0.487 18986 79 1 14 "Average Difference" N 81 2.246 -0.144 2.255 18986 80 1 14 "Average Difference" HA 90 0.241 0.030 0.240 18986 81 1 14 "Average Difference" C 82 2.852 2.715 0.876 18986 82 1 14 "Average Difference" CA 85 2.943 2.724 1.121 18986 83 1 14 "Average Difference" CB 80 3.301 2.187 2.489 18986 84 1 14 "Average Difference" HN 81 0.480 0.054 0.480 18986 85 1 15 "Average Difference" N 81 2.590 -0.024 2.606 18986 86 1 15 "Average Difference" HA 90 0.214 0.004 0.215 18986 87 1 15 "Average Difference" C 82 2.858 2.704 0.933 18986 88 1 15 "Average Difference" CA 85 2.942 2.743 1.072 18986 89 1 15 "Average Difference" CB 80 3.323 2.193 2.512 18986 90 1 15 "Average Difference" HN 81 0.466 -0.001 0.469 18986 91 1 16 "Average Difference" N 81 2.076 0.111 2.086 18986 92 1 16 "Average Difference" HA 90 0.268 0.025 0.268 18986 93 1 16 "Average Difference" C 82 2.854 2.707 0.911 18986 94 1 16 "Average Difference" CA 85 2.837 2.601 1.139 18986 95 1 16 "Average Difference" CB 80 3.423 2.036 2.768 18986 96 1 16 "Average Difference" HN 81 0.483 0.059 0.483 18986 97 1 17 "Average Difference" N 81 1.953 0.063 1.964 18986 98 1 17 "Average Difference" HA 90 0.189 0.038 0.186 18986 99 1 17 "Average Difference" C 82 2.840 2.701 0.882 18986 100 1 17 "Average Difference" CA 85 2.897 2.738 0.953 18986 101 1 17 "Average Difference" CB 80 3.526 2.190 2.781 18986 102 1 17 "Average Difference" HN 81 0.451 0.084 0.446 18986 103 1 18 "Average Difference" N 81 3.078 -0.222 3.089 18986 104 1 18 "Average Difference" HA 90 0.241 0.040 0.239 18986 105 1 18 "Average Difference" C 82 2.935 2.707 1.142 18986 106 1 18 "Average Difference" CA 85 2.977 2.712 1.236 18986 107 1 18 "Average Difference" CB 80 3.303 2.234 2.449 18986 108 1 18 "Average Difference" HN 81 0.456 0.038 0.457 18986 109 1 19 "Average Difference" N 81 2.834 -0.264 2.839 18986 110 1 19 "Average Difference" HA 90 0.261 0.036 0.260 18986 111 1 19 "Average Difference" C 82 2.825 2.703 0.826 18986 112 1 19 "Average Difference" CA 85 2.835 2.596 1.145 18986 113 1 19 "Average Difference" CB 80 3.418 2.165 2.661 18986 114 1 19 "Average Difference" HN 81 0.472 0.018 0.474 18986 115 1 20 "Average Difference" N 81 2.443 -0.106 2.456 18986 116 1 20 "Average Difference" HA 90 0.242 0.011 0.244 18986 117 1 20 "Average Difference" C 82 2.869 2.744 0.843 18986 118 1 20 "Average Difference" CA 85 2.888 2.729 0.949 18986 119 1 20 "Average Difference" CB 80 3.366 2.016 2.712 18986 120 1 20 "Average Difference" HN 81 0.447 0.061 0.446 18986 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 18986 _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 1 601 601 SER HA H 601 4.475 4.475 4.366 0.109 18986 2 1 . 1 1 601 601 SER CA C 601 55.508 55.508 58.685 -3.177 18986 3 1 . 1 1 601 601 SER CB C 601 61.220 61.220 63.484 -2.264 18986 4 1 . 1 1 602 602 HIS HA H 602 4.616 4.616 4.657 -0.041 18986 5 1 . 1 1 602 602 HIS C C 602 172.320 172.320 174.706 -2.386 18986 6 1 . 1 1 602 602 HIS CA C 602 53.854 53.854 56.086 -2.232 18986 7 1 . 1 1 602 602 HIS CB C 602 28.083 28.083 30.617 -2.534 18986 8 1 . 1 1 603 603 MET N N 603 121.862 121.862 119.534 2.328 18986 9 1 . 1 1 603 603 MET HA H 603 4.425 4.425 4.608 -0.183 18986 10 1 . 1 1 603 603 MET C C 603 173.948 173.948 175.945 -1.997 18986 11 1 . 1 1 603 603 MET CA C 603 53.108 53.108 55.627 -2.519 18986 12 1 . 1 1 603 603 MET CB C 603 30.049 30.049 33.964 -3.915 18986 13 1 . 1 1 603 603 MET H H 603 8.394 8.394 8.503 -0.109 18986 14 1 . 1 1 604 604 GLY N N 604 110.382 110.382 108.815 1.567 18986 15 1 . 1 1 604 604 GLY C C 604 171.590 171.590 173.476 -1.886 18986 16 1 . 1 1 604 604 GLY CA C 604 42.617 42.617 44.919 -2.302 18986 17 1 . 1 1 604 604 GLY H H 604 8.411 8.411 8.449 -0.038 18986 18 1 . 1 1 605 605 GLU N N 605 120.709 120.709 120.088 0.621 18986 19 1 . 1 1 605 605 GLU HA H 605 4.307 4.307 4.543 -0.236 18986 20 1 . 1 1 605 605 GLU C C 605 174.220 174.220 176.354 -2.134 18986 21 1 . 1 1 605 605 GLU CA C 605 53.966 53.966 56.119 -2.153 18986 22 1 . 1 1 605 605 GLU CB C 605 27.611 27.611 31.028 -3.417 18986 23 1 . 1 1 605 605 GLU H H 605 8.282 8.282 8.430 -0.148 18986 24 1 . 1 1 606 606 SER N N 606 116.679 116.679 116.410 0.269 18986 25 1 . 1 1 606 606 SER HA H 606 4.405 4.405 4.509 -0.104 18986 26 1 . 1 1 606 606 SER C C 606 172.455 172.455 174.531 -2.076 18986 27 1 . 1 1 606 606 SER CA C 606 56.028 56.028 58.459 -2.432 18986 28 1 . 1 1 606 606 SER CB C 606 61.039 61.039 63.713 -2.674 18986 29 1 . 1 1 606 606 SER H H 606 8.420 8.420 8.373 0.047 18986 30 1 . 1 1 607 607 GLY N N 607 110.716 110.716 110.074 0.642 18986 31 1 . 1 1 607 607 GLY C C 607 171.173 171.173 173.703 -2.530 18986 32 1 . 1 1 607 607 GLY CA C 607 42.641 42.641 45.060 -2.419 18986 33 1 . 1 1 607 607 GLY H H 607 8.386 8.386 8.280 0.106 18986 34 1 . 1 1 608 608 LYS N N 608 120.785 120.785 120.652 0.133 18986 35 1 . 1 1 608 608 LYS HA H 608 4.339 4.339 4.355 -0.016 18986 36 1 . 1 1 608 608 LYS C C 608 173.673 173.673 175.792 -2.119 18986 37 1 . 1 1 608 608 LYS CA C 608 53.365 53.365 56.189 -2.824 18986 38 1 . 1 1 608 608 LYS CB C 608 30.531 30.531 32.429 -1.898 18986 39 1 . 1 1 608 608 LYS H H 608 8.008 8.008 8.318 -0.310 18986 40 1 . 1 1 609 609 ILE N N 609 122.404 122.404 121.326 1.078 18986 41 1 . 1 1 609 609 ILE HA H 609 4.149 4.149 4.184 -0.035 18986 42 1 . 1 1 609 609 ILE C C 609 172.675 172.675 174.944 -2.269 18986 43 1 . 1 1 609 609 ILE CA C 609 58.003 58.003 60.493 -2.490 18986 44 1 . 1 1 609 609 ILE CB C 609 36.204 36.204 38.872 -2.668 18986 45 1 . 1 1 609 609 ILE H H 609 8.186 8.186 7.912 0.274 18986 46 1 . 1 1 610 610 ASP N N 610 125.357 125.357 125.182 0.175 18986 47 1 . 1 1 610 610 ASP HA H 610 4.703 4.703 4.756 -0.053 18986 48 1 . 1 1 610 610 ASP C C 610 173.668 173.668 175.861 -2.193 18986 49 1 . 1 1 610 610 ASP CA C 610 50.702 50.702 53.488 -2.786 18986 50 1 . 1 1 610 610 ASP CB C 610 38.690 38.690 42.544 -3.854 18986 51 1 . 1 1 610 610 ASP H H 610 8.369 8.369 8.105 0.264 18986 52 1 . 1 1 611 611 ILE N N 611 122.494 122.494 120.140 2.354 18986 53 1 . 1 1 611 611 ILE HA H 611 3.909 3.909 4.025 -0.116 18986 54 1 . 1 1 611 611 ILE C C 611 173.618 173.618 177.239 -3.622 18986 55 1 . 1 1 611 611 ILE CA C 611 60.040 60.040 63.383 -3.343 18986 56 1 . 1 1 611 611 ILE CB C 611 35.798 35.798 38.276 -2.478 18986 57 1 . 1 1 611 611 ILE H H 611 8.284 8.284 8.224 0.060 18986 58 1 . 1 1 612 612 ASP N N 612 121.440 121.440 120.063 1.377 18986 59 1 . 1 1 612 612 ASP HA H 612 4.434 4.434 4.381 0.053 18986 60 1 . 1 1 612 612 ASP C C 612 175.129 175.129 178.349 -3.220 18986 61 1 . 1 1 612 612 ASP CA C 612 53.766 53.766 57.952 -4.186 18986 62 1 . 1 1 612 612 ASP CB C 612 38.138 38.138 39.864 -1.726 18986 63 1 . 1 1 612 612 ASP H H 612 8.279 8.279 8.569 -0.290 18986 64 1 . 1 1 613 613 THR N N 613 114.422 114.422 113.386 1.036 18986 65 1 . 1 1 613 613 THR HA H 613 4.106 4.106 4.081 0.025 18986 66 1 . 1 1 613 613 THR C C 613 173.338 173.338 175.524 -2.186 18986 67 1 . 1 1 613 613 THR CA C 613 61.545 61.545 64.947 -3.402 18986 68 1 . 1 1 613 613 THR CB C 613 66.267 66.267 68.610 -2.343 18986 69 1 . 1 1 613 613 THR H H 613 7.866 7.866 8.303 -0.437 18986 70 1 . 1 1 614 614 ILE N N 614 121.654 121.654 119.368 2.286 18986 71 1 . 1 1 614 614 ILE HA H 614 4.029 4.029 4.040 -0.011 18986 72 1 . 1 1 614 614 ILE C C 614 174.471 174.471 177.685 -3.214 18986 73 1 . 1 1 614 614 ILE CA C 614 60.173 60.173 63.053 -2.880 18986 74 1 . 1 1 614 614 ILE CB C 614 35.815 35.815 38.287 -2.472 18986 75 1 . 1 1 614 614 ILE H H 614 7.819 7.819 7.471 0.348 18986 76 1 . 1 1 615 615 MET N N 615 119.713 119.713 118.332 1.381 18986 77 1 . 1 1 615 615 MET HA H 615 4.478 4.478 4.581 -0.103 18986 78 1 . 1 1 615 615 MET C C 615 174.075 174.075 178.060 -3.985 18986 79 1 . 1 1 615 615 MET CA C 615 52.764 52.764 57.494 -4.730 18986 80 1 . 1 1 615 615 MET CB C 615 29.337 29.337 32.011 -2.675 18986 81 1 . 1 1 615 615 MET H H 615 8.188 8.188 8.381 -0.193 18986 82 1 . 1 1 616 616 THR N N 616 114.770 114.770 114.163 0.607 18986 83 1 . 1 1 616 616 THR HA H 616 4.099 4.099 4.169 -0.070 18986 84 1 . 1 1 616 616 THR C C 616 172.535 172.535 175.878 -3.343 18986 85 1 . 1 1 616 616 THR CA C 616 61.112 61.112 64.671 -3.559 18986 86 1 . 1 1 616 616 THR CB C 616 66.617 66.617 69.157 -2.540 18986 87 1 . 1 1 616 616 THR H H 616 7.722 7.722 8.309 -0.587 18986 88 1 . 1 1 617 617 GLY N N 617 111.384 111.384 106.851 4.533 18986 89 1 . 1 1 617 617 GLY C C 617 171.437 171.437 173.695 -2.258 18986 90 1 . 1 1 617 617 GLY CA C 617 42.442 42.442 45.160 -2.718 18986 91 1 . 1 1 617 617 GLY H H 617 8.431 8.431 7.807 0.624 18986 92 1 . 1 1 618 618 LYS N N 618 120.996 120.996 120.952 0.044 18986 93 1 . 1 1 618 618 LYS HA H 618 4.667 4.667 4.843 -0.177 18986 94 1 . 1 1 618 618 LYS CA C 618 50.828 50.828 52.850 -2.022 18986 95 1 . 1 1 618 618 LYS CB C 618 29.477 29.477 33.986 -4.509 18986 96 1 . 1 1 618 618 LYS H H 618 7.821 7.821 7.908 -0.087 18986 97 1 . 1 1 619 619 PRO HA H 619 4.469 4.469 4.478 -0.009 18986 98 1 . 1 1 619 619 PRO C C 619 174.453 174.453 177.835 -3.382 18986 99 1 . 1 1 619 619 PRO CA C 619 60.192 60.192 63.157 -2.965 18986 100 1 . 1 1 619 619 PRO CB C 619 29.580 29.580 32.557 -2.977 18986 101 1 . 1 1 620 620 LYS N N 620 123.464 123.464 120.591 2.873 18986 102 1 . 1 1 620 620 LYS HA H 620 4.046 4.046 3.990 0.056 18986 103 1 . 1 1 620 620 LYS C C 620 174.895 174.895 178.502 -3.607 18986 104 1 . 1 1 620 620 LYS CA C 620 56.289 56.289 59.327 -3.038 18986 105 1 . 1 1 620 620 LYS CB C 620 30.454 30.454 31.879 -1.425 18986 106 1 . 1 1 620 620 LYS H H 620 8.728 8.728 8.537 0.191 18986 107 1 . 1 1 621 621 SER N N 621 113.921 113.921 115.020 -1.099 18986 108 1 . 1 1 621 621 SER HA H 621 4.336 4.336 4.224 0.112 18986 109 1 . 1 1 621 621 SER C C 621 173.149 173.149 176.199 -3.050 18986 110 1 . 1 1 621 621 SER CA C 621 56.691 56.691 60.841 -4.150 18986 111 1 . 1 1 621 621 SER CB C 621 60.689 60.689 62.587 -1.898 18986 112 1 . 1 1 621 621 SER H H 621 8.531 8.531 8.330 0.201 18986 113 1 . 1 1 622 622 ALA N N 622 124.177 124.177 124.618 -0.441 18986 114 1 . 1 1 622 622 ALA HA H 622 4.168 4.168 3.985 0.183 18986 115 1 . 1 1 622 622 ALA C C 622 176.804 176.804 178.976 -2.172 18986 116 1 . 1 1 622 622 ALA CA C 622 52.368 52.368 55.284 -2.915 18986 117 1 . 1 1 622 622 ALA CB C 622 15.854 15.854 18.150 -2.296 18986 118 1 . 1 1 622 622 ALA H H 622 7.835 7.835 8.243 -0.408 18986 119 1 . 1 1 623 623 ARG N N 623 118.263 118.263 118.922 -0.659 18986 120 1 . 1 1 623 623 ARG HA H 623 3.950 3.950 3.983 -0.033 18986 121 1 . 1 1 623 623 ARG C C 623 175.683 175.683 178.425 -2.742 18986 122 1 . 1 1 623 623 ARG CA C 623 57.163 57.163 59.056 -1.893 18986 123 1 . 1 1 623 623 ARG CB C 623 27.451 27.451 29.480 -2.030 18986 124 1 . 1 1 623 623 ARG H H 623 8.148 8.148 7.955 0.193 18986 125 1 . 1 1 624 624 GLU N N 624 117.953 117.953 119.953 -2.000 18986 126 1 . 1 1 624 624 GLU HA H 624 3.968 3.968 4.070 -0.102 18986 127 1 . 1 1 624 624 GLU C C 624 177.204 177.204 178.470 -1.266 18986 128 1 . 1 1 624 624 GLU CA C 624 56.857 56.857 59.120 -2.263 18986 129 1 . 1 1 624 624 GLU CB C 624 26.967 26.967 29.289 -2.322 18986 130 1 . 1 1 624 624 GLU H H 624 8.143 8.143 8.426 -0.283 18986 131 1 . 1 1 625 625 LYS N N 625 119.222 119.222 118.294 0.928 18986 132 1 . 1 1 625 625 LYS HA H 625 3.857 3.857 4.234 -0.378 18986 133 1 . 1 1 625 625 LYS C C 625 175.480 175.480 179.011 -3.531 18986 134 1 . 1 1 625 625 LYS CA C 625 57.487 57.487 58.810 -1.323 18986 135 1 . 1 1 625 625 LYS CB C 625 30.663 30.663 32.877 -2.214 18986 136 1 . 1 1 625 625 LYS H H 625 7.772 7.772 7.849 -0.077 18986 137 1 . 1 1 626 626 MET N N 626 117.883 117.883 119.715 -1.832 18986 138 1 . 1 1 626 626 MET HA H 626 3.807 3.807 4.088 -0.281 18986 139 1 . 1 1 626 626 MET C C 626 175.278 175.278 178.440 -3.162 18986 140 1 . 1 1 626 626 MET CA C 626 57.782 57.782 59.234 -1.452 18986 141 1 . 1 1 626 626 MET CB C 626 30.657 30.657 32.601 -1.944 18986 142 1 . 1 1 626 626 MET H H 626 8.367 8.367 8.573 -0.206 18986 143 1 . 1 1 627 627 MET N N 627 116.185 116.185 117.299 -1.114 18986 144 1 . 1 1 627 627 MET HA H 627 4.152 4.152 4.122 0.030 18986 145 1 . 1 1 627 627 MET C C 627 176.393 176.393 178.240 -1.847 18986 146 1 . 1 1 627 627 MET CA C 627 55.359 55.359 57.979 -2.620 18986 147 1 . 1 1 627 627 MET CB C 627 28.803 28.803 31.277 -2.474 18986 148 1 . 1 1 627 627 MET H H 627 8.197 8.197 8.649 -0.452 18986 149 1 . 1 1 628 628 LYS N N 628 119.859 119.859 120.501 -0.642 18986 150 1 . 1 1 628 628 LYS HA H 628 4.200 4.200 4.184 0.016 18986 151 1 . 1 1 628 628 LYS C C 628 175.885 175.885 179.242 -3.357 18986 152 1 . 1 1 628 628 LYS CA C 628 55.077 55.077 59.188 -4.112 18986 153 1 . 1 1 628 628 LYS CB C 628 28.531 28.531 32.234 -3.703 18986 154 1 . 1 1 628 628 LYS H H 628 7.700 7.700 7.558 0.143 18986 155 1 . 1 1 629 629 ILE N N 629 119.001 119.001 120.213 -1.212 18986 156 1 . 1 1 629 629 ILE HA H 629 3.548 3.548 3.632 -0.084 18986 157 1 . 1 1 629 629 ILE C C 629 174.891 174.891 178.005 -3.114 18986 158 1 . 1 1 629 629 ILE CA C 629 62.265 62.265 65.614 -3.349 18986 159 1 . 1 1 629 629 ILE CB C 629 33.849 33.849 37.956 -4.107 18986 160 1 . 1 1 629 629 ILE H H 629 7.970 7.970 8.165 -0.195 18986 161 1 . 1 1 630 630 ILE N N 630 120.737 120.737 117.106 3.631 18986 162 1 . 1 1 630 630 ILE HA H 630 3.467 3.467 3.637 -0.170 18986 163 1 . 1 1 630 630 ILE C C 630 173.875 173.875 177.690 -3.815 18986 164 1 . 1 1 630 630 ILE CA C 630 62.754 62.754 65.015 -2.261 18986 165 1 . 1 1 630 630 ILE CB C 630 34.277 34.277 36.936 -2.659 18986 166 1 . 1 1 630 630 ILE H H 630 8.213 8.213 8.219 -0.006 18986 167 1 . 1 1 631 631 GLU N N 631 119.546 119.546 121.194 -1.648 18986 168 1 . 1 1 631 631 GLU HA H 631 4.065 4.065 4.072 -0.007 18986 169 1 . 1 1 631 631 GLU C C 631 177.300 177.300 179.195 -1.895 18986 170 1 . 1 1 631 631 GLU CA C 631 56.980 56.980 59.530 -2.550 18986 171 1 . 1 1 631 631 GLU CB C 631 26.993 26.993 29.592 -2.599 18986 172 1 . 1 1 631 631 GLU H H 631 7.742 7.742 7.937 -0.195 18986 173 1 . 1 1 632 632 ILE N N 632 121.547 121.547 120.863 0.684 18986 174 1 . 1 1 632 632 ILE HA H 632 3.683 3.683 3.704 -0.020 18986 175 1 . 1 1 632 632 ILE C C 632 175.454 175.454 178.237 -2.783 18986 176 1 . 1 1 632 632 ILE CA C 632 62.656 62.656 65.239 -2.583 18986 177 1 . 1 1 632 632 ILE CB C 632 35.830 35.830 37.514 -1.684 18986 178 1 . 1 1 632 632 ILE H H 632 8.013 8.013 8.209 -0.196 18986 179 1 . 1 1 633 633 ILE N N 633 121.605 121.605 120.582 1.023 18986 180 1 . 1 1 633 633 ILE HA H 633 3.335 3.335 3.574 -0.239 18986 181 1 . 1 1 633 633 ILE C C 633 174.558 174.558 178.102 -3.544 18986 182 1 . 1 1 633 633 ILE CA C 633 63.919 63.919 65.719 -1.800 18986 183 1 . 1 1 633 633 ILE CB C 633 35.284 35.284 37.149 -1.865 18986 184 1 . 1 1 633 633 ILE H H 633 8.594 8.594 8.287 0.307 18986 185 1 . 1 1 634 634 ASP N N 634 118.706 118.706 120.133 -1.427 18986 186 1 . 1 1 634 634 ASP HA H 634 4.435 4.435 4.381 0.054 18986 187 1 . 1 1 634 634 ASP C C 634 176.574 176.574 178.627 -2.053 18986 188 1 . 1 1 634 634 ASP CA C 634 54.571 54.571 57.550 -2.979 18986 189 1 . 1 1 634 634 ASP CB C 634 37.914 37.914 40.662 -2.748 18986 190 1 . 1 1 634 634 ASP H H 634 8.724 8.724 8.410 0.314 18986 191 1 . 1 1 635 635 SER N N 635 114.064 114.064 115.430 -1.366 18986 192 1 . 1 1 635 635 SER HA H 635 4.232 4.232 4.250 -0.018 18986 193 1 . 1 1 635 635 SER C C 635 174.487 174.487 176.588 -2.101 18986 194 1 . 1 1 635 635 SER CA C 635 58.540 58.540 61.289 -2.749 18986 195 1 . 1 1 635 635 SER CB C 635 60.319 60.319 63.188 -2.869 18986 196 1 . 1 1 635 635 SER H H 635 7.992 7.992 8.163 -0.171 18986 197 1 . 1 1 636 636 LEU N N 636 122.493 122.493 121.749 0.744 18986 198 1 . 1 1 636 636 LEU HA H 636 4.254 4.254 4.195 0.059 18986 199 1 . 1 1 636 636 LEU C C 636 176.194 176.194 178.608 -2.414 18986 200 1 . 1 1 636 636 LEU CA C 636 54.095 54.095 57.426 -3.331 18986 201 1 . 1 1 636 636 LEU CB C 636 39.706 39.706 41.778 -2.072 18986 202 1 . 1 1 636 636 LEU H H 636 8.169 8.169 8.257 -0.088 18986 203 1 . 1 1 637 637 ALA N N 637 121.891 121.891 121.280 0.611 18986 204 1 . 1 1 637 637 ALA HA H 637 4.089 4.089 4.306 -0.217 18986 205 1 . 1 1 637 637 ALA C C 637 175.131 175.131 179.490 -4.359 18986 206 1 . 1 1 637 637 ALA CA C 637 50.336 50.336 54.189 -3.853 18986 207 1 . 1 1 637 637 ALA CB C 637 15.488 15.488 18.388 -2.900 18986 208 1 . 1 1 637 637 ALA H H 637 8.482 8.482 8.321 0.161 18986 209 1 . 1 1 638 638 VAL N N 638 117.140 117.140 117.522 -0.382 18986 210 1 . 1 1 638 638 VAL HA H 638 3.935 3.935 3.895 0.040 18986 211 1 . 1 1 638 638 VAL C C 638 174.712 174.712 176.565 -1.853 18986 212 1 . 1 1 638 638 VAL CA C 638 62.001 62.001 64.416 -2.415 18986 213 1 . 1 1 638 638 VAL CB C 638 29.351 29.351 31.976 -2.625 18986 214 1 . 1 1 638 638 VAL H H 638 7.291 7.291 8.072 -0.781 18986 215 1 . 1 1 639 639 SER N N 639 114.143 114.143 113.920 0.223 18986 216 1 . 1 1 639 639 SER HA H 639 4.481 4.481 4.588 -0.107 18986 217 1 . 1 1 639 639 SER C C 639 172.122 172.122 173.762 -1.640 18986 218 1 . 1 1 639 639 SER CA C 639 56.002 56.002 58.686 -2.684 18986 219 1 . 1 1 639 639 SER CB C 639 60.921 60.921 64.228 -3.307 18986 220 1 . 1 1 639 639 SER H H 639 7.918 7.918 7.989 -0.071 18986 221 1 . 1 1 640 640 SER N N 640 115.370 115.370 115.984 -0.614 18986 222 1 . 1 1 640 640 SER HA H 640 4.711 4.711 4.642 0.069 18986 223 1 . 1 1 640 640 SER C C 640 171.185 171.185 174.305 -3.120 18986 224 1 . 1 1 640 640 SER CA C 640 55.009 55.009 57.406 -2.397 18986 225 1 . 1 1 640 640 SER CB C 640 61.974 61.974 64.691 -2.717 18986 226 1 . 1 1 640 640 SER H H 640 7.765 7.765 7.702 0.063 18986 227 1 . 1 1 641 641 GLU N N 641 119.994 119.994 121.024 -1.030 18986 228 1 . 1 1 641 641 GLU HA H 641 4.044 4.044 4.132 -0.088 18986 229 1 . 1 1 641 641 GLU C C 641 173.167 173.167 175.753 -2.586 18986 230 1 . 1 1 641 641 GLU CA C 641 56.651 56.651 58.835 -2.184 18986 231 1 . 1 1 641 641 GLU CB C 641 27.484 27.484 29.818 -2.334 18986 232 1 . 1 1 641 641 GLU H H 641 8.363 8.363 8.808 -0.445 18986 233 1 . 1 1 642 642 CYS N N 642 110.257 110.257 113.105 -2.848 18986 234 1 . 1 1 642 642 CYS HA H 642 4.459 4.459 4.669 -0.210 18986 235 1 . 1 1 642 642 CYS C C 642 168.058 168.058 173.173 -5.115 18986 236 1 . 1 1 642 642 CYS CA C 642 50.946 50.946 56.193 -5.247 18986 237 1 . 1 1 642 642 CYS CB C 642 41.361 41.361 31.325 10.036 18986 238 1 . 1 1 642 642 CYS H H 642 7.881 7.881 7.463 0.417 18986 239 1 . 1 1 643 643 ALA N N 643 123.922 123.922 123.949 -0.027 18986 240 1 . 1 1 643 643 ALA HA H 643 4.638 4.638 4.452 0.186 18986 241 1 . 1 1 643 643 ALA C C 643 172.517 172.517 176.496 -3.979 18986 242 1 . 1 1 643 643 ALA CA C 643 47.620 47.620 51.489 -3.869 18986 243 1 . 1 1 643 643 ALA CB C 643 19.444 19.444 19.425 0.019 18986 244 1 . 1 1 643 643 ALA H H 643 9.787 9.787 8.962 0.825 18986 245 1 . 1 1 644 644 LYS N N 644 128.479 128.479 124.319 4.160 18986 246 1 . 1 1 644 644 LYS HA H 644 4.511 4.511 4.464 0.047 18986 247 1 . 1 1 644 644 LYS C C 644 176.945 176.945 177.474 -0.529 18986 248 1 . 1 1 644 644 LYS CA C 644 54.338 54.338 56.164 -1.825 18986 249 1 . 1 1 644 644 LYS CB C 644 29.942 29.942 32.319 -2.377 18986 250 1 . 1 1 644 644 LYS H H 644 9.809 9.809 8.598 1.211 18986 251 1 . 1 1 645 645 VAL N N 645 124.257 124.257 126.204 -1.947 18986 252 1 . 1 1 645 645 VAL HA H 645 3.648 3.648 3.637 0.011 18986 253 1 . 1 1 645 645 VAL C C 645 173.996 173.996 177.048 -3.052 18986 254 1 . 1 1 645 645 VAL CA C 645 64.862 64.862 66.017 -1.155 18986 255 1 . 1 1 645 645 VAL CB C 645 29.201 29.201 31.627 -2.426 18986 256 1 . 1 1 645 645 VAL H H 645 8.458 8.458 9.085 -0.627 18986 257 1 . 1 1 646 646 LYS N N 646 117.598 117.598 120.144 -2.546 18986 258 1 . 1 1 646 646 LYS HA H 646 4.007 4.007 3.910 0.097 18986 259 1 . 1 1 646 646 LYS C C 646 176.047 176.047 178.585 -2.538 18986 260 1 . 1 1 646 646 LYS CA C 646 57.245 57.245 60.217 -2.972 18986 261 1 . 1 1 646 646 LYS CB C 646 29.398 29.398 31.882 -2.484 18986 262 1 . 1 1 646 646 LYS H H 646 8.706 8.706 8.535 0.171 18986 263 1 . 1 1 647 647 ASP N N 647 119.229 119.229 119.718 -0.489 18986 264 1 . 1 1 647 647 ASP HA H 647 4.618 4.618 4.471 0.147 18986 265 1 . 1 1 647 647 ASP C C 647 175.211 175.211 178.586 -3.375 18986 266 1 . 1 1 647 647 ASP CA C 647 54.323 54.323 57.343 -3.020 18986 267 1 . 1 1 647 647 ASP CB C 647 38.738 38.738 40.670 -1.932 18986 268 1 . 1 1 647 647 ASP H H 647 7.012 7.012 7.877 -0.865 18986 269 1 . 1 1 648 648 ILE N N 648 121.939 121.939 120.675 1.264 18986 270 1 . 1 1 648 648 ILE HA H 648 3.381 3.381 3.617 -0.236 18986 271 1 . 1 1 648 648 ILE C C 648 175.243 175.243 177.933 -2.690 18986 272 1 . 1 1 648 648 ILE CA C 648 63.041 63.041 65.398 -2.357 18986 273 1 . 1 1 648 648 ILE CB C 648 35.962 35.962 37.826 -1.864 18986 274 1 . 1 1 648 648 ILE H H 648 8.152 8.152 7.609 0.543 18986 275 1 . 1 1 649 649 LEU N N 649 117.310 117.310 120.371 -3.061 18986 276 1 . 1 1 649 649 LEU HA H 649 3.873 3.873 3.791 0.082 18986 277 1 . 1 1 649 649 LEU C C 649 176.439 176.439 178.924 -2.485 18986 278 1 . 1 1 649 649 LEU CA C 649 55.885 55.885 58.532 -2.647 18986 279 1 . 1 1 649 649 LEU CB C 649 39.306 39.306 41.368 -2.062 18986 280 1 . 1 1 649 649 LEU H H 649 8.638 8.638 8.618 0.020 18986 281 1 . 1 1 650 650 LYS N N 650 118.810 118.810 119.453 -0.643 18986 282 1 . 1 1 650 650 LYS HA H 650 4.046 4.046 3.913 0.133 18986 283 1 . 1 1 650 650 LYS C C 650 176.801 176.801 178.964 -2.163 18986 284 1 . 1 1 650 650 LYS CA C 650 57.051 57.051 59.558 -2.507 18986 285 1 . 1 1 650 650 LYS CB C 650 30.064 30.064 32.068 -2.004 18986 286 1 . 1 1 650 650 LYS H H 650 7.296 7.296 7.984 -0.688 18986 287 1 . 1 1 651 651 GLU N N 651 117.713 117.713 118.812 -1.099 18986 288 1 . 1 1 651 651 GLU HA H 651 4.108 4.108 4.078 0.030 18986 289 1 . 1 1 651 651 GLU C C 651 176.903 176.903 179.084 -2.181 18986 290 1 . 1 1 651 651 GLU CA C 651 55.810 55.810 58.921 -3.111 18986 291 1 . 1 1 651 651 GLU CB C 651 27.448 27.448 29.253 -1.805 18986 292 1 . 1 1 651 651 GLU H H 651 8.036 8.036 8.274 -0.238 18986 293 1 . 1 1 652 652 ALA N N 652 121.206 121.206 122.269 -1.063 18986 294 1 . 1 1 652 652 ALA HA H 652 3.998 3.998 4.050 -0.052 18986 295 1 . 1 1 652 652 ALA C C 652 176.766 176.766 179.826 -3.060 18986 296 1 . 1 1 652 652 ALA CA C 652 51.734 51.734 55.240 -3.506 18986 297 1 . 1 1 652 652 ALA CB C 652 15.316 15.316 18.203 -2.887 18986 298 1 . 1 1 652 652 ALA H H 652 8.973 8.973 8.580 0.393 18986 299 1 . 1 1 653 653 GLN N N 653 117.768 117.768 118.112 -0.344 18986 300 1 . 1 1 653 653 GLN HA H 653 4.477 4.477 4.310 0.167 18986 301 1 . 1 1 653 653 GLN C C 653 177.388 177.388 178.933 -1.545 18986 302 1 . 1 1 653 653 GLN CA C 653 56.060 56.060 58.514 -2.453 18986 303 1 . 1 1 653 653 GLN CB C 653 26.769 26.769 28.715 -1.946 18986 304 1 . 1 1 653 653 GLN H H 653 8.059 8.059 8.243 -0.184 18986 305 1 . 1 1 654 654 GLN N N 654 117.979 117.979 118.602 -0.623 18986 306 1 . 1 1 654 654 GLN HA H 654 4.177 4.177 4.089 0.088 18986 307 1 . 1 1 654 654 GLN C C 654 174.834 174.834 178.285 -3.451 18986 308 1 . 1 1 654 654 GLN CA C 654 55.418 55.418 58.213 -2.795 18986 309 1 . 1 1 654 654 GLN CB C 654 25.977 25.977 28.626 -2.649 18986 310 1 . 1 1 654 654 GLN H H 654 7.495 7.495 8.051 -0.556 18986 311 1 . 1 1 655 655 VAL N N 655 110.080 110.080 116.703 -6.623 18986 312 1 . 1 1 655 655 VAL HA H 655 4.527 4.527 3.881 0.646 18986 313 1 . 1 1 655 655 VAL C C 655 173.369 173.369 176.770 -3.401 18986 314 1 . 1 1 655 655 VAL CA C 655 58.067 58.067 64.137 -6.070 18986 315 1 . 1 1 655 655 VAL CB C 655 28.184 28.184 32.318 -4.134 18986 316 1 . 1 1 655 655 VAL H H 655 7.197 7.197 8.011 -0.814 18986 317 1 . 1 1 656 656 GLY N N 656 107.089 107.089 106.679 0.410 18986 318 1 . 1 1 656 656 GLY C C 656 171.639 171.639 174.155 -2.516 18986 319 1 . 1 1 656 656 GLY CA C 656 43.311 43.311 44.709 -1.398 18986 320 1 . 1 1 656 656 GLY H H 656 7.541 7.541 7.847 -0.306 18986 321 1 . 1 1 657 657 ILE N N 657 121.266 121.266 120.469 0.797 18986 322 1 . 1 1 657 657 ILE HA H 657 4.134 4.134 4.252 -0.118 18986 323 1 . 1 1 657 657 ILE C C 657 171.885 171.885 175.192 -3.307 18986 324 1 . 1 1 657 657 ILE CA C 657 58.230 58.230 60.303 -2.073 18986 325 1 . 1 1 657 657 ILE CB C 657 35.191 35.191 39.727 -4.536 18986 326 1 . 1 1 657 657 ILE H H 657 7.633 7.633 8.129 -0.496 18986 327 1 . 1 1 658 658 GLU N N 658 127.252 127.252 123.157 4.095 18986 328 1 . 1 1 658 658 GLU HA H 658 4.203 4.203 4.499 -0.296 18986 329 1 . 1 1 658 658 GLU C C 658 175.316 175.316 177.314 -1.998 18986 330 1 . 1 1 658 658 GLU CA C 658 54.360 54.360 55.442 -1.082 18986 331 1 . 1 1 658 658 GLU CB C 658 27.610 27.610 31.499 -3.889 18986 332 1 . 1 1 658 658 GLU H H 658 8.690 8.690 8.475 0.215 18986 333 1 . 1 1 659 659 LYS N N 659 124.533 124.533 126.319 -1.786 18986 334 1 . 1 1 659 659 LYS HA H 659 3.788 3.788 3.846 -0.058 18986 335 1 . 1 1 659 659 LYS C C 659 175.170 175.170 178.156 -2.986 18986 336 1 . 1 1 659 659 LYS CA C 659 58.171 58.171 60.191 -2.020 18986 337 1 . 1 1 659 659 LYS CB C 659 30.117 30.117 31.856 -1.739 18986 338 1 . 1 1 659 659 LYS H H 659 8.706 8.706 8.949 -0.243 18986 339 1 . 1 1 660 660 SER N N 660 113.137 113.137 114.368 -1.231 18986 340 1 . 1 1 660 660 SER HA H 660 4.273 4.273 4.323 -0.050 18986 341 1 . 1 1 660 660 SER C C 660 173.939 173.939 176.608 -2.669 18986 342 1 . 1 1 660 660 SER CA C 660 58.350 58.350 61.145 -2.795 18986 343 1 . 1 1 660 660 SER CB C 660 59.504 59.504 62.673 -3.169 18986 344 1 . 1 1 660 660 SER H H 660 8.777 8.777 8.546 0.231 18986 345 1 . 1 1 661 661 ASN N N 661 119.986 119.986 120.697 -0.711 18986 346 1 . 1 1 661 661 ASN HA H 661 4.706 4.706 4.473 0.233 18986 347 1 . 1 1 661 661 ASN C C 661 174.516 174.516 177.488 -2.972 18986 348 1 . 1 1 661 661 ASN CA C 661 52.048 52.048 56.415 -4.368 18986 349 1 . 1 1 661 661 ASN CB C 661 36.743 36.743 38.562 -1.819 18986 350 1 . 1 1 661 661 ASN H H 661 7.486 7.486 8.201 -0.715 18986 351 1 . 1 1 662 662 ILE N N 662 120.639 120.639 120.872 -0.233 18986 352 1 . 1 1 662 662 ILE HA H 662 3.446 3.446 3.694 -0.248 18986 353 1 . 1 1 662 662 ILE C C 662 174.252 174.252 177.696 -3.444 18986 354 1 . 1 1 662 662 ILE CA C 662 62.606 62.606 65.046 -2.440 18986 355 1 . 1 1 662 662 ILE CB C 662 34.423 34.423 37.657 -3.234 18986 356 1 . 1 1 662 662 ILE H H 662 7.999 7.999 8.175 -0.176 18986 357 1 . 1 1 663 663 GLU N N 663 117.706 117.706 120.117 -2.411 18986 358 1 . 1 1 663 663 GLU HA H 663 3.790 3.790 3.923 -0.133 18986 359 1 . 1 1 663 663 GLU C C 663 176.509 176.509 178.992 -2.483 18986 360 1 . 1 1 663 663 GLU CA C 663 57.708 57.708 60.106 -2.398 18986 361 1 . 1 1 663 663 GLU CB C 663 26.755 26.755 29.368 -2.613 18986 362 1 . 1 1 663 663 GLU H H 663 8.190 8.190 8.371 -0.181 18986 363 1 . 1 1 664 664 LYS N N 664 119.586 119.586 120.481 -0.895 18986 364 1 . 1 1 664 664 LYS HA H 664 4.053 4.053 4.074 -0.021 18986 365 1 . 1 1 664 664 LYS C C 664 175.941 175.941 178.872 -2.931 18986 366 1 . 1 1 664 664 LYS CA C 664 56.581 56.581 59.315 -2.734 18986 367 1 . 1 1 664 664 LYS CB C 664 29.823 29.823 32.112 -2.289 18986 368 1 . 1 1 664 664 LYS H H 664 7.590 7.590 8.227 -0.637 18986 369 1 . 1 1 665 665 LEU N N 665 119.756 119.756 121.109 -1.353 18986 370 1 . 1 1 665 665 LEU HA H 665 4.080 4.080 4.018 0.062 18986 371 1 . 1 1 665 665 LEU C C 665 176.700 176.700 179.068 -2.368 18986 372 1 . 1 1 665 665 LEU CA C 665 55.385 55.385 57.973 -2.588 18986 373 1 . 1 1 665 665 LEU CB C 665 39.192 39.192 41.743 -2.551 18986 374 1 . 1 1 665 665 LEU H H 665 8.075 8.075 8.204 -0.129 18986 375 1 . 1 1 666 666 LEU N N 666 118.788 118.788 118.790 -0.002 18986 376 1 . 1 1 666 666 LEU HA H 666 3.764 3.764 3.736 0.028 18986 377 1 . 1 1 666 666 LEU C C 666 176.484 176.484 178.989 -2.505 18986 378 1 . 1 1 666 666 LEU CA C 666 55.658 55.658 58.287 -2.629 18986 379 1 . 1 1 666 666 LEU CB C 666 38.611 38.611 40.840 -2.228 18986 380 1 . 1 1 666 666 LEU H H 666 8.550 8.550 8.630 -0.080 18986 381 1 . 1 1 667 667 THR N N 667 115.244 115.244 116.149 -0.905 18986 382 1 . 1 1 667 667 THR HA H 667 3.839 3.839 3.961 -0.122 18986 383 1 . 1 1 667 667 THR C C 667 173.740 173.740 176.424 -2.684 18986 384 1 . 1 1 667 667 THR CA C 667 64.378 64.378 67.567 -3.189 18986 385 1 . 1 1 667 667 THR CB C 667 65.748 65.748 68.280 -2.532 18986 386 1 . 1 1 667 667 THR H H 667 7.662 7.662 8.054 -0.392 18986 387 1 . 1 1 668 668 ASP N N 668 122.862 122.862 122.429 0.433 18986 388 1 . 1 1 668 668 ASP HA H 668 4.383 4.383 4.376 0.007 18986 389 1 . 1 1 668 668 ASP C C 668 177.192 177.192 178.556 -1.364 18986 390 1 . 1 1 668 668 ASP CA C 668 55.131 55.131 57.312 -2.181 18986 391 1 . 1 1 668 668 ASP CB C 668 37.886 37.886 40.751 -2.865 18986 392 1 . 1 1 668 668 ASP H H 668 8.291 8.291 8.320 -0.029 18986 393 1 . 1 1 669 669 MET N N 669 119.640 119.640 118.613 1.027 18986 394 1 . 1 1 669 669 MET HA H 669 3.917 3.917 4.077 -0.160 18986 395 1 . 1 1 669 669 MET C C 669 175.414 175.414 178.498 -3.084 18986 396 1 . 1 1 669 669 MET CA C 669 57.234 57.234 59.486 -2.252 18986 397 1 . 1 1 669 669 MET CB C 669 32.088 32.088 32.498 -0.410 18986 398 1 . 1 1 669 669 MET H H 669 8.809 8.809 8.475 0.334 18986 399 1 . 1 1 670 670 ARG N N 670 122.614 122.614 118.183 4.431 18986 400 1 . 1 1 670 670 ARG HA H 670 4.517 4.517 4.536 -0.019 18986 401 1 . 1 1 670 670 ARG C C 670 177.928 177.928 178.813 -0.885 18986 402 1 . 1 1 670 670 ARG CA C 670 56.222 56.222 58.384 -2.162 18986 403 1 . 1 1 670 670 ARG CB C 670 27.304 27.304 29.861 -2.557 18986 404 1 . 1 1 670 670 ARG H H 670 8.450 8.450 8.377 0.073 18986 405 1 . 1 1 671 671 LYS N N 671 121.976 121.976 119.639 2.337 18986 406 1 . 1 1 671 671 LYS HA H 671 4.113 4.113 4.238 -0.125 18986 407 1 . 1 1 671 671 LYS C C 671 176.143 176.143 178.195 -2.052 18986 408 1 . 1 1 671 671 LYS CA C 671 57.086 57.086 58.422 -1.336 18986 409 1 . 1 1 671 671 LYS CB C 671 29.504 29.504 32.641 -3.137 18986 410 1 . 1 1 671 671 LYS H H 671 8.609 8.609 8.160 0.449 18986 411 1 . 1 1 672 672 SER N N 672 111.655 111.655 113.208 -1.553 18986 412 1 . 1 1 672 672 SER HA H 672 4.469 4.469 4.441 0.028 18986 413 1 . 1 1 672 672 SER C C 672 171.692 171.692 175.370 -3.678 18986 414 1 . 1 1 672 672 SER CA C 672 56.790 56.790 59.463 -2.673 18986 415 1 . 1 1 672 672 SER CB C 672 61.343 61.343 64.343 -3.000 18986 416 1 . 1 1 672 672 SER H H 672 7.884 7.884 8.162 -0.278 18986 417 1 . 1 1 673 673 GLY N N 673 108.029 108.029 108.234 -0.205 18986 418 1 . 1 1 673 673 GLY C C 673 171.492 171.492 175.088 -3.596 18986 419 1 . 1 1 673 673 GLY CA C 673 43.275 43.275 45.294 -2.019 18986 420 1 . 1 1 673 673 GLY H H 673 7.774 7.774 8.140 -0.366 18986 421 1 . 1 1 674 674 ILE N N 674 116.193 116.193 120.027 -3.834 18986 422 1 . 1 1 674 674 ILE HA H 674 4.101 4.101 4.012 0.088 18986 423 1 . 1 1 674 674 ILE C C 674 173.980 173.980 175.835 -1.855 18986 424 1 . 1 1 674 674 ILE CA C 674 60.242 60.242 63.472 -3.230 18986 425 1 . 1 1 674 674 ILE CB C 674 36.804 36.804 38.580 -1.776 18986 426 1 . 1 1 674 674 ILE H H 674 8.026 8.026 8.244 -0.218 18986 427 1 . 1 1 675 675 ILE N N 675 108.928 108.928 113.200 -4.272 18986 428 1 . 1 1 675 675 ILE HA H 675 5.358 5.358 4.768 0.590 18986 429 1 . 1 1 675 675 ILE C C 675 170.797 170.797 174.032 -3.235 18986 430 1 . 1 1 675 675 ILE CA C 675 56.024 56.024 58.813 -2.789 18986 431 1 . 1 1 675 675 ILE CB C 675 39.486 39.486 41.926 -2.440 18986 432 1 . 1 1 675 675 ILE H H 675 7.120 7.120 7.376 -0.256 18986 433 1 . 1 1 676 676 TYR N N 676 118.062 118.062 116.769 1.293 18986 434 1 . 1 1 676 676 TYR HA H 676 4.995 4.995 5.079 -0.084 18986 435 1 . 1 1 676 676 TYR C C 676 170.020 170.020 174.440 -4.420 18986 436 1 . 1 1 676 676 TYR CA C 676 52.893 52.893 55.836 -2.943 18986 437 1 . 1 1 676 676 TYR CB C 676 38.516 38.516 40.756 -2.240 18986 438 1 . 1 1 676 676 TYR H H 676 9.380 9.380 8.742 0.638 18986 439 1 . 1 1 677 677 GLU N N 677 123.578 123.578 122.843 0.735 18986 440 1 . 1 1 677 677 GLU HA H 677 3.826 3.826 3.800 0.026 18986 441 1 . 1 1 677 677 GLU C C 677 172.146 172.146 176.341 -4.195 18986 442 1 . 1 1 677 677 GLU CA C 677 52.476 52.476 56.518 -4.043 18986 443 1 . 1 1 677 677 GLU CB C 677 26.612 26.612 28.950 -2.338 18986 444 1 . 1 1 677 677 GLU H H 677 8.951 8.951 8.843 0.109 18986 445 1 . 1 1 678 678 ALA N N 678 133.220 133.220 126.390 6.830 18986 446 1 . 1 1 678 678 ALA HA H 678 4.041 4.041 4.237 -0.196 18986 447 1 . 1 1 678 678 ALA C C 678 175.219 175.219 177.223 -2.004 18986 448 1 . 1 1 678 678 ALA CA C 678 51.601 51.601 53.787 -2.186 18986 449 1 . 1 1 678 678 ALA CB C 678 16.599 16.599 19.315 -2.716 18986 450 1 . 1 1 678 678 ALA H H 678 7.912 7.912 8.391 -0.479 18986 451 1 . 1 1 679 679 LYS N N 679 115.687 115.687 116.433 -0.746 18986 452 1 . 1 1 679 679 LYS HA H 679 4.435 4.435 4.724 -0.289 18986 453 1 . 1 1 679 679 LYS CA C 679 51.016 51.016 52.721 -1.705 18986 454 1 . 1 1 679 679 LYS CB C 679 30.995 30.995 34.200 -3.205 18986 455 1 . 1 1 679 679 LYS H H 679 8.215 8.215 7.700 0.515 18986 456 1 . 1 1 680 680 PRO HA H 680 4.019 4.019 4.318 -0.299 18986 457 1 . 1 1 680 680 PRO C C 680 174.504 174.504 177.208 -2.704 18986 458 1 . 1 1 680 680 PRO CA C 680 62.518 62.518 63.931 -1.413 18986 459 1 . 1 1 680 680 PRO CB C 680 28.315 28.315 31.713 -3.398 18986 460 1 . 1 1 681 681 GLU N N 681 118.851 118.851 118.161 0.690 18986 461 1 . 1 1 681 681 GLU HA H 681 3.438 3.438 3.989 -0.551 18986 462 1 . 1 1 681 681 GLU C C 681 172.890 172.890 175.092 -2.202 18986 463 1 . 1 1 681 681 GLU CA C 681 54.481 54.481 58.069 -3.588 18986 464 1 . 1 1 681 681 GLU CB C 681 24.789 24.789 29.025 -4.236 18986 465 1 . 1 1 681 681 GLU H H 681 10.003 10.003 9.026 0.977 18986 466 1 . 1 1 682 682 CYS N N 682 120.934 120.934 117.189 3.745 18986 467 1 . 1 1 682 682 CYS HA H 682 5.027 5.027 5.218 -0.191 18986 468 1 . 1 1 682 682 CYS C C 682 171.905 171.905 173.498 -1.593 18986 469 1 . 1 1 682 682 CYS CA C 682 54.244 54.244 57.819 -3.575 18986 470 1 . 1 1 682 682 CYS CB C 682 45.295 45.295 30.029 15.266 18986 471 1 . 1 1 682 682 CYS H H 682 7.860 7.860 7.861 -0.001 18986 472 1 . 1 1 683 683 TYR N N 683 126.183 126.183 122.025 4.158 18986 473 1 . 1 1 683 683 TYR HA H 683 5.224 5.224 5.171 0.053 18986 474 1 . 1 1 683 683 TYR C C 683 173.008 173.008 174.564 -1.556 18986 475 1 . 1 1 683 683 TYR CA C 683 56.568 56.568 57.003 -0.435 18986 476 1 . 1 1 683 683 TYR CB C 683 40.952 40.952 42.057 -1.105 18986 477 1 . 1 1 683 683 TYR H H 683 9.297 9.297 9.277 0.020 18986 478 1 . 1 1 684 684 LYS N N 684 118.604 118.604 119.723 -1.119 18986 479 1 . 1 1 684 684 LYS HA H 684 4.437 4.437 4.748 -0.311 18986 480 1 . 1 1 684 684 LYS C C 684 171.628 171.628 174.835 -3.207 18986 481 1 . 1 1 684 684 LYS CA C 684 52.303 52.303 53.740 -1.437 18986 482 1 . 1 1 684 684 LYS CB C 684 34.677 34.677 36.611 -1.934 18986 483 1 . 1 1 684 684 LYS H H 684 8.630 8.630 9.013 -0.383 18986 484 1 . 1 1 685 685 LYS N N 685 122.869 122.869 125.236 -2.367 18986 485 1 . 1 1 685 685 LYS HA H 685 4.644 4.644 4.109 0.535 18986 486 1 . 1 1 685 685 LYS C C 685 173.337 173.337 176.296 -2.959 18986 487 1 . 1 1 685 685 LYS CA C 685 54.253 54.253 56.588 -2.335 18986 488 1 . 1 1 685 685 LYS CB C 685 30.927 30.927 32.530 -1.603 18986 489 1 . 1 1 685 685 LYS H H 685 8.969 8.969 8.580 0.389 18986 stop_ save_