data_18804 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18804 _Entry.PDB_ID 2M0B 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 18804 _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 1 635 635 GLY N N 635 108.817 108.817 110.752 -1.935 18804 2 1 1 . 1 1 635 635 GLY C C 635 172.499 172.499 174.093 -1.594 18804 3 1 1 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.301 -1.032 18804 4 1 1 . 1 1 635 635 GLY H H 635 8.390 8.390 8.877 -0.487 18804 5 1 1 . 1 1 636 636 CYS N N 636 120.634 120.634 123.550 -2.916 18804 6 1 1 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.530 0.492 18804 7 1 1 . 1 1 636 636 CYS C C 636 172.181 172.181 173.645 -1.464 18804 8 1 1 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.894 -4.300 18804 9 1 1 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.787 10.701 18804 10 1 1 . 1 1 636 636 CYS H H 636 8.327 8.327 8.123 0.204 18804 11 1 1 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.445 0.055 18804 12 1 1 . 1 1 637 637 PRO C C 637 176.215 176.215 176.408 -0.193 18804 13 1 1 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.985 -1.307 18804 14 1 1 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.770 -0.428 18804 15 1 1 . 1 1 638 638 THR N N 638 113.690 113.690 107.282 6.408 18804 16 1 1 . 1 1 638 638 THR HA H 638 4.305 4.305 3.927 0.378 18804 17 1 1 . 1 1 638 638 THR C C 638 173.495 173.495 173.228 0.267 18804 18 1 1 . 1 1 638 638 THR CA C 638 60.998 60.998 62.656 -1.657 18804 19 1 1 . 1 1 638 638 THR CB C 638 68.954 68.954 67.578 1.376 18804 20 1 1 . 1 1 638 638 THR H H 638 8.114 8.114 7.759 0.355 18804 21 1 1 . 1 1 639 639 ASN N N 639 120.695 120.695 118.851 1.844 18804 22 1 1 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.725 0.048 18804 23 1 1 . 1 1 639 639 ASN C C 639 174.216 174.216 175.561 -1.345 18804 24 1 1 . 1 1 639 639 ASN CA C 639 52.357 52.357 54.154 -1.797 18804 25 1 1 . 1 1 639 639 ASN CB C 639 38.581 38.581 38.808 -0.227 18804 26 1 1 . 1 1 639 639 ASN H H 639 8.301 8.301 8.048 0.253 18804 27 1 1 . 1 1 640 640 GLY N N 640 108.827 108.827 109.356 -0.529 18804 28 1 1 . 1 1 640 640 GLY C C 640 170.506 170.506 172.211 -1.705 18804 29 1 1 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.927 -1.072 18804 30 1 1 . 1 1 640 640 GLY H H 640 8.111 8.111 8.195 -0.084 18804 31 1 1 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.615 -0.163 18804 32 1 1 . 1 1 641 641 PRO C C 641 175.669 175.669 176.025 -0.356 18804 33 1 1 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.900 -0.825 18804 34 1 1 . 1 1 641 641 PRO CB C 641 31.488 31.488 31.151 0.337 18804 35 1 1 . 1 1 642 642 LYS N N 642 121.521 121.521 123.397 -1.876 18804 36 1 1 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.641 -0.315 18804 37 1 1 . 1 1 642 642 LYS C C 642 175.106 175.106 174.838 0.268 18804 38 1 1 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.293 -0.190 18804 39 1 1 . 1 1 642 642 LYS CB C 642 32.370 32.370 33.940 -1.570 18804 40 1 1 . 1 1 642 642 LYS H H 642 8.417 8.417 8.299 0.118 18804 41 1 1 . 1 1 643 643 ILE N N 643 121.410 121.410 122.334 -0.924 18804 42 1 1 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.410 -0.075 18804 43 1 1 . 1 1 643 643 ILE C C 643 173.587 173.587 174.641 -1.054 18804 44 1 1 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.543 -1.669 18804 45 1 1 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.524 0.094 18804 46 1 1 . 1 1 643 643 ILE H H 643 8.069 8.069 8.372 -0.303 18804 47 1 1 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.567 -0.114 18804 48 1 1 . 1 1 644 644 PRO C C 644 175.623 175.623 177.674 -2.051 18804 49 1 1 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.315 0.144 18804 50 1 1 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.353 -0.845 18804 51 1 1 . 1 1 645 645 SER N N 645 115.445 115.445 114.330 1.115 18804 52 1 1 . 1 1 645 645 SER HA H 645 4.374 4.374 4.236 0.138 18804 53 1 1 . 1 1 645 645 SER C C 645 174.611 174.611 175.963 -1.352 18804 54 1 1 . 1 1 645 645 SER CA C 645 58.566 58.566 60.277 -1.711 18804 55 1 1 . 1 1 645 645 SER CB C 645 62.842 62.842 62.742 0.100 18804 56 1 1 . 1 1 645 645 SER H H 645 8.267 8.267 8.457 -0.190 18804 57 1 1 . 1 1 646 646 ILE N N 646 120.612 120.612 122.697 -2.085 18804 58 1 1 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.871 0.238 18804 59 1 1 . 1 1 646 646 ILE C C 646 174.703 174.703 177.573 -2.870 18804 60 1 1 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.673 -0.451 18804 61 1 1 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.026 1.634 18804 62 1 1 . 1 1 646 646 ILE H H 646 8.252 8.252 8.060 0.192 18804 63 1 1 . 1 1 647 647 ALA N N 647 123.224 123.224 122.930 0.294 18804 64 1 1 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.939 0.224 18804 65 1 1 . 1 1 647 647 ALA C C 647 176.526 176.526 179.281 -2.755 18804 66 1 1 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.360 -2.176 18804 67 1 1 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.139 0.110 18804 68 1 1 . 1 1 647 647 ALA H H 647 8.084 8.084 7.666 0.418 18804 69 1 1 . 1 1 648 648 THR N N 648 111.699 111.699 114.303 -2.604 18804 70 1 1 . 1 1 648 648 THR HA H 648 4.021 4.021 3.858 0.163 18804 71 1 1 . 1 1 648 648 THR C C 648 175.018 175.018 177.009 -1.991 18804 72 1 1 . 1 1 648 648 THR CA C 648 63.554 63.554 67.373 -3.819 18804 73 1 1 . 1 1 648 648 THR CB C 648 68.098 68.098 68.406 -0.309 18804 74 1 1 . 1 1 648 648 THR H H 648 7.757 7.757 7.906 -0.149 18804 75 1 1 . 1 1 649 649 GLY N N 649 108.587 108.587 109.435 -0.848 18804 76 1 1 . 1 1 649 649 GLY C C 649 173.686 173.686 176.278 -2.592 18804 77 1 1 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.741 -0.797 18804 78 1 1 . 1 1 649 649 GLY H H 649 8.423 8.423 7.901 0.522 18804 79 1 1 . 1 1 650 650 MET N N 650 119.486 119.486 121.847 -2.361 18804 80 1 1 . 1 1 650 650 MET HA H 650 4.135 4.135 4.268 -0.133 18804 81 1 1 . 1 1 650 650 MET C C 650 176.632 176.632 178.668 -2.036 18804 82 1 1 . 1 1 650 650 MET CA C 650 57.749 57.749 56.785 0.964 18804 83 1 1 . 1 1 650 650 MET CB C 650 32.067 32.067 31.399 0.668 18804 84 1 1 . 1 1 650 650 MET H H 650 8.332 8.332 7.553 0.779 18804 85 1 1 . 1 1 651 651 VAL N N 651 118.009 118.009 118.600 -0.591 18804 86 1 1 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.660 -0.120 18804 87 1 1 . 1 1 651 651 VAL C C 651 176.672 176.672 178.374 -1.702 18804 88 1 1 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.449 -1.170 18804 89 1 1 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.765 -0.467 18804 90 1 1 . 1 1 651 651 VAL H H 651 8.038 8.038 8.908 -0.870 18804 91 1 1 . 1 1 652 652 GLY N N 652 105.785 105.785 106.793 -1.008 18804 92 1 1 . 1 1 652 652 GLY C C 652 173.359 173.359 175.389 -2.030 18804 93 1 1 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.023 -0.035 18804 94 1 1 . 1 1 652 652 GLY H H 652 8.157 8.157 8.043 0.115 18804 95 1 1 . 1 1 653 653 ALA N N 653 121.803 121.803 125.117 -3.314 18804 96 1 1 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.213 -0.286 18804 97 1 1 . 1 1 653 653 ALA C C 653 177.608 177.608 179.697 -2.089 18804 98 1 1 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.630 0.017 18804 99 1 1 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.331 -0.774 18804 100 1 1 . 1 1 653 653 ALA H H 653 8.050 8.050 7.945 0.105 18804 101 1 1 . 1 1 654 654 LEU N N 654 116.652 116.652 119.611 -2.959 18804 102 1 1 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.902 0.050 18804 103 1 1 . 1 1 654 654 LEU C C 654 177.361 177.361 179.098 -1.737 18804 104 1 1 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.154 -0.892 18804 105 1 1 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.815 -0.912 18804 106 1 1 . 1 1 654 654 LEU H H 654 7.919 7.919 8.431 -0.512 18804 107 1 1 . 1 1 655 655 LEU N N 655 117.910 117.910 118.699 -0.789 18804 108 1 1 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.956 -0.019 18804 109 1 1 . 1 1 655 655 LEU C C 655 177.353 177.353 179.178 -1.825 18804 110 1 1 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.879 -0.364 18804 111 1 1 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.553 -0.743 18804 112 1 1 . 1 1 655 655 LEU H H 655 8.189 8.189 7.683 0.506 18804 113 1 1 . 1 1 656 656 LEU N N 656 118.140 118.140 119.168 -1.028 18804 114 1 1 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.916 -0.007 18804 115 1 1 . 1 1 656 656 LEU C C 656 177.304 177.304 179.218 -1.914 18804 116 1 1 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.776 -0.279 18804 117 1 1 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.574 -0.813 18804 118 1 1 . 1 1 656 656 LEU H H 656 8.022 8.022 7.804 0.218 18804 119 1 1 . 1 1 657 657 LEU N N 657 118.079 118.079 119.734 -1.655 18804 120 1 1 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.865 -0.027 18804 121 1 1 . 1 1 657 657 LEU C C 657 177.304 177.304 178.990 -1.686 18804 122 1 1 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.203 -0.627 18804 123 1 1 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.637 -0.841 18804 124 1 1 . 1 1 657 657 LEU H H 657 8.073 8.073 8.226 -0.153 18804 125 1 1 . 1 1 658 658 LEU N N 658 118.238 118.238 119.062 -0.824 18804 126 1 1 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.906 0.017 18804 127 1 1 . 1 1 658 658 LEU C C 658 177.353 177.353 179.190 -1.837 18804 128 1 1 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.054 -0.545 18804 129 1 1 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.559 -0.670 18804 130 1 1 . 1 1 658 658 LEU H H 658 8.148 8.148 7.705 0.443 18804 131 1 1 . 1 1 659 659 VAL N N 659 117.951 117.951 118.622 -0.671 18804 132 1 1 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.691 -0.187 18804 133 1 1 . 1 1 659 659 VAL C C 659 176.888 176.888 178.403 -1.515 18804 134 1 1 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.259 0.233 18804 135 1 1 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.610 -0.238 18804 136 1 1 . 1 1 659 659 VAL H H 659 8.150 8.150 7.750 0.400 18804 137 1 1 . 1 1 660 660 VAL N N 660 119.240 119.240 120.752 -1.512 18804 138 1 1 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.628 -0.139 18804 139 1 1 . 1 1 660 660 VAL C C 660 176.494 176.494 177.930 -1.436 18804 140 1 1 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.564 -0.214 18804 141 1 1 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.544 -0.154 18804 142 1 1 . 1 1 660 660 VAL H H 660 8.220 8.220 8.094 0.126 18804 143 1 1 . 1 1 661 661 ALA N N 661 121.414 121.414 122.872 -1.458 18804 144 1 1 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.004 -0.112 18804 145 1 1 . 1 1 661 661 ALA C C 661 178.419 178.419 179.881 -1.462 18804 146 1 1 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.440 -0.345 18804 147 1 1 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.209 -0.910 18804 148 1 1 . 1 1 661 661 ALA H H 661 8.562 8.562 7.983 0.579 18804 149 1 1 . 1 1 662 662 LEU N N 662 117.019 117.019 118.782 -1.763 18804 150 1 1 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.876 0.101 18804 151 1 1 . 1 1 662 662 LEU C C 662 178.078 178.078 179.236 -1.158 18804 152 1 1 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.608 -0.292 18804 153 1 1 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.656 -0.616 18804 154 1 1 . 1 1 662 662 LEU H H 662 8.460 8.460 7.982 0.478 18804 155 1 1 . 1 1 663 663 GLY N N 663 106.924 106.924 107.243 -0.319 18804 156 1 1 . 1 1 663 663 GLY C C 663 174.372 174.372 176.166 -1.794 18804 157 1 1 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.287 -0.188 18804 158 1 1 . 1 1 663 663 GLY H H 663 8.683 8.683 7.999 0.684 18804 159 1 1 . 1 1 664 664 ILE N N 664 121.523 121.523 122.686 -1.163 18804 160 1 1 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.688 0.011 18804 161 1 1 . 1 1 664 664 ILE C C 664 177.614 177.614 178.087 -0.473 18804 162 1 1 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.037 -0.002 18804 163 1 1 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.686 -0.854 18804 164 1 1 . 1 1 664 664 ILE H H 664 8.750 8.750 8.140 0.610 18804 165 1 1 . 1 1 665 665 GLY N N 665 107.803 107.803 108.547 -0.744 18804 166 1 1 . 1 1 665 665 GLY C C 665 174.402 174.402 176.269 -1.867 18804 167 1 1 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.362 -0.153 18804 168 1 1 . 1 1 665 665 GLY H H 665 8.689 8.689 8.255 0.434 18804 169 1 1 . 1 1 666 666 LEU N N 666 121.365 121.365 122.093 -0.728 18804 170 1 1 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.089 -0.054 18804 171 1 1 . 1 1 666 666 LEU C C 666 178.291 178.291 178.797 -0.506 18804 172 1 1 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.165 0.166 18804 173 1 1 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.784 -0.564 18804 174 1 1 . 1 1 666 666 LEU H H 666 8.744 8.744 7.932 0.812 18804 175 1 1 . 1 1 667 667 PHE N N 667 119.838 119.838 121.431 -1.593 18804 176 1 1 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.086 0.005 18804 177 1 1 . 1 1 667 667 PHE C C 667 176.965 176.965 176.814 0.151 18804 178 1 1 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.626 -0.595 18804 179 1 1 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.514 -0.752 18804 180 1 1 . 1 1 667 667 PHE H H 667 8.454 8.454 8.288 0.166 18804 181 1 1 . 1 1 668 668 MET N N 668 116.868 116.868 116.584 0.284 18804 182 1 1 . 1 1 668 668 MET HA H 668 4.035 4.035 3.899 0.136 18804 183 1 1 . 1 1 668 668 MET C C 668 177.678 177.678 178.986 -1.308 18804 184 1 1 . 1 1 668 668 MET CA C 668 57.405 57.405 59.242 -1.837 18804 185 1 1 . 1 1 668 668 MET CB C 668 31.739 31.739 32.568 -0.829 18804 186 1 1 . 1 1 668 668 MET H H 668 8.701 8.701 8.555 0.146 18804 187 1 1 . 1 1 669 669 ARG N N 669 118.600 118.600 118.488 0.112 18804 188 1 1 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.049 0.086 18804 189 1 1 . 1 1 669 669 ARG C C 669 177.120 177.120 177.939 -0.819 18804 190 1 1 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.852 -1.600 18804 191 1 1 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.099 -0.595 18804 192 1 1 . 1 1 669 669 ARG H H 669 8.044 8.044 7.742 0.302 18804 193 1 1 . 1 1 670 670 ARG N N 670 118.124 118.124 115.527 2.597 18804 194 1 1 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.318 -0.193 18804 195 1 1 . 1 1 670 670 ARG C C 670 176.240 176.240 175.867 0.373 18804 196 1 1 . 1 1 670 670 ARG CA C 670 56.738 56.738 55.803 0.935 18804 197 1 1 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.567 -1.100 18804 198 1 1 . 1 1 670 670 ARG H H 670 7.864 7.864 7.457 0.407 18804 199 1 1 . 1 1 671 671 ARG N N 671 117.904 117.904 120.350 -2.446 18804 200 1 1 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.260 -0.174 18804 201 1 1 . 1 1 671 671 ARG C C 671 175.233 175.233 175.598 -0.365 18804 202 1 1 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.109 0.622 18804 203 1 1 . 1 1 671 671 ARG CB C 671 29.494 29.494 31.189 -1.695 18804 204 1 1 . 1 1 671 671 ARG H H 671 7.677 7.677 7.291 0.386 18804 205 1 1 . 1 1 672 672 HIS N N 672 117.048 117.048 124.633 -7.585 18804 206 1 1 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.399 0.204 18804 207 1 1 . 1 1 672 672 HIS C C 672 173.634 173.634 174.534 -0.900 18804 208 1 1 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.238 -0.397 18804 209 1 1 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.161 -1.975 18804 210 1 1 . 1 1 672 672 HIS H H 672 7.920 7.920 8.567 -0.647 18804 211 1 1 . 1 1 673 673 ILE N N 673 120.795 120.795 123.691 -2.896 18804 212 1 1 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.086 -0.012 18804 213 1 1 . 1 1 673 673 ILE C C 673 174.922 174.922 175.588 -0.666 18804 214 1 1 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.429 0.348 18804 215 1 1 . 1 1 673 673 ILE CB C 673 37.836 37.836 39.298 -1.462 18804 216 1 1 . 1 1 673 673 ILE H H 673 7.900 7.900 8.082 -0.182 18804 217 1 1 . 1 1 674 674 VAL N N 674 122.867 122.867 124.922 -2.055 18804 218 1 1 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.029 0.052 18804 219 1 1 . 1 1 674 674 VAL C C 674 174.876 174.876 175.037 -0.161 18804 220 1 1 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.179 -0.810 18804 221 1 1 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.383 -0.390 18804 222 1 1 . 1 1 674 674 VAL H H 674 8.003 8.003 7.970 0.033 18804 223 1 1 . 1 1 675 675 ARG N N 675 124.866 124.866 123.192 1.674 18804 224 1 1 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.257 -0.200 18804 225 1 1 . 1 1 675 675 ARG C C 675 174.922 174.922 175.952 -1.030 18804 226 1 1 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.192 -1.008 18804 227 1 1 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.669 -0.353 18804 228 1 1 . 1 1 675 675 ARG H H 675 8.266 8.266 8.219 0.047 18804 229 1 1 . 1 1 676 676 LYS N N 676 123.517 123.517 118.797 4.720 18804 230 1 1 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.079 0.186 18804 231 1 1 . 1 1 676 676 LYS C C 676 174.625 174.625 175.180 -0.555 18804 232 1 1 . 1 1 676 676 LYS CA C 676 55.753 55.753 57.126 -1.373 18804 233 1 1 . 1 1 676 676 LYS CB C 676 30.281 30.281 30.418 -0.137 18804 234 1 1 . 1 1 676 676 LYS H H 676 8.260 8.260 8.679 -0.419 18804 235 1 2 . 1 1 635 635 GLY N N 635 108.817 108.817 110.281 -1.464 18804 236 1 2 . 1 1 635 635 GLY C C 635 172.499 172.499 174.163 -1.664 18804 237 1 2 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.443 -1.174 18804 238 1 2 . 1 1 635 635 GLY H H 635 8.390 8.390 8.668 -0.278 18804 239 1 2 . 1 1 636 636 CYS N N 636 120.634 120.634 120.657 -0.023 18804 240 1 2 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.958 0.064 18804 241 1 2 . 1 1 636 636 CYS C C 636 172.181 172.181 173.038 -0.857 18804 242 1 2 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.406 -3.812 18804 243 1 2 . 1 1 636 636 CYS CB C 636 39.488 39.488 29.223 10.265 18804 244 1 2 . 1 1 636 636 CYS H H 636 8.327 8.327 8.105 0.222 18804 245 1 2 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.436 0.064 18804 246 1 2 . 1 1 637 637 PRO C C 637 176.215 176.215 176.380 -0.165 18804 247 1 2 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.216 -0.538 18804 248 1 2 . 1 1 637 637 PRO CB C 637 31.342 31.342 29.929 1.413 18804 249 1 2 . 1 1 638 638 THR N N 638 113.690 113.690 113.635 0.055 18804 250 1 2 . 1 1 638 638 THR HA H 638 4.305 4.305 3.949 0.356 18804 251 1 2 . 1 1 638 638 THR C C 638 173.495 173.495 173.729 -0.234 18804 252 1 2 . 1 1 638 638 THR CA C 638 60.998 60.998 63.482 -2.484 18804 253 1 2 . 1 1 638 638 THR CB C 638 68.954 68.954 67.541 1.413 18804 254 1 2 . 1 1 638 638 THR H H 638 8.114 8.114 8.322 -0.208 18804 255 1 2 . 1 1 639 639 ASN N N 639 120.695 120.695 118.740 1.955 18804 256 1 2 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.835 -0.062 18804 257 1 2 . 1 1 639 639 ASN C C 639 174.216 174.216 174.720 -0.504 18804 258 1 2 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.316 0.040 18804 259 1 2 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.940 -1.359 18804 260 1 2 . 1 1 639 639 ASN H H 639 8.301 8.301 7.916 0.385 18804 261 1 2 . 1 1 640 640 GLY N N 640 108.827 108.827 107.678 1.149 18804 262 1 2 . 1 1 640 640 GLY C C 640 170.506 170.506 172.996 -2.490 18804 263 1 2 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.325 -0.470 18804 264 1 2 . 1 1 640 640 GLY H H 640 8.111 8.111 8.415 -0.304 18804 265 1 2 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.651 -0.199 18804 266 1 2 . 1 1 641 641 PRO C C 641 175.669 175.669 175.759 -0.090 18804 267 1 2 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.580 -0.505 18804 268 1 2 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.574 -1.086 18804 269 1 2 . 1 1 642 642 LYS N N 642 121.521 121.521 122.488 -0.967 18804 270 1 2 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.535 -0.209 18804 271 1 2 . 1 1 642 642 LYS C C 642 175.106 175.106 175.005 0.101 18804 272 1 2 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.046 -0.943 18804 273 1 2 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.511 -2.141 18804 274 1 2 . 1 1 642 642 LYS H H 642 8.417 8.417 8.204 0.213 18804 275 1 2 . 1 1 643 643 ILE N N 643 121.410 121.410 125.692 -4.282 18804 276 1 2 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.486 -0.151 18804 277 1 2 . 1 1 643 643 ILE C C 643 173.587 173.587 174.632 -1.045 18804 278 1 2 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.726 -1.852 18804 279 1 2 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.894 -0.276 18804 280 1 2 . 1 1 643 643 ILE H H 643 8.069 8.069 8.528 -0.459 18804 281 1 2 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.568 -0.115 18804 282 1 2 . 1 1 644 644 PRO C C 644 175.623 175.623 177.715 -2.092 18804 283 1 2 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.455 0.004 18804 284 1 2 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.373 -0.865 18804 285 1 2 . 1 1 645 645 SER N N 645 115.445 115.445 114.077 1.368 18804 286 1 2 . 1 1 645 645 SER HA H 645 4.374 4.374 4.302 0.072 18804 287 1 2 . 1 1 645 645 SER C C 645 174.611 174.611 175.805 -1.194 18804 288 1 2 . 1 1 645 645 SER CA C 645 58.566 58.566 60.300 -1.734 18804 289 1 2 . 1 1 645 645 SER CB C 645 62.842 62.842 62.388 0.454 18804 290 1 2 . 1 1 645 645 SER H H 645 8.267 8.267 8.467 -0.200 18804 291 1 2 . 1 1 646 646 ILE N N 646 120.612 120.612 122.015 -1.403 18804 292 1 2 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.910 0.199 18804 293 1 2 . 1 1 646 646 ILE C C 646 174.703 174.703 177.281 -2.578 18804 294 1 2 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.210 0.012 18804 295 1 2 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.050 1.610 18804 296 1 2 . 1 1 646 646 ILE H H 646 8.252 8.252 7.967 0.285 18804 297 1 2 . 1 1 647 647 ALA N N 647 123.224 123.224 124.066 -0.842 18804 298 1 2 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.867 0.296 18804 299 1 2 . 1 1 647 647 ALA C C 647 176.526 176.526 179.215 -2.689 18804 300 1 2 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.144 -1.960 18804 301 1 2 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.104 0.145 18804 302 1 2 . 1 1 647 647 ALA H H 647 8.084 8.084 7.637 0.447 18804 303 1 2 . 1 1 648 648 THR N N 648 111.699 111.699 114.504 -2.805 18804 304 1 2 . 1 1 648 648 THR HA H 648 4.021 4.021 3.860 0.161 18804 305 1 2 . 1 1 648 648 THR C C 648 175.018 175.018 176.888 -1.870 18804 306 1 2 . 1 1 648 648 THR CA C 648 63.554 63.554 67.529 -3.975 18804 307 1 2 . 1 1 648 648 THR CB C 648 68.098 68.098 68.506 -0.408 18804 308 1 2 . 1 1 648 648 THR H H 648 7.757 7.757 7.728 0.029 18804 309 1 2 . 1 1 649 649 GLY N N 649 108.587 108.587 109.557 -0.970 18804 310 1 2 . 1 1 649 649 GLY C C 649 173.686 173.686 176.310 -2.624 18804 311 1 2 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.807 -0.863 18804 312 1 2 . 1 1 649 649 GLY H H 649 8.423 8.423 7.903 0.520 18804 313 1 2 . 1 1 650 650 MET N N 650 119.486 119.486 121.635 -2.149 18804 314 1 2 . 1 1 650 650 MET HA H 650 4.135 4.135 4.277 -0.142 18804 315 1 2 . 1 1 650 650 MET C C 650 176.632 176.632 178.633 -2.001 18804 316 1 2 . 1 1 650 650 MET CA C 650 57.749 57.749 56.955 0.794 18804 317 1 2 . 1 1 650 650 MET CB C 650 32.067 32.067 31.651 0.416 18804 318 1 2 . 1 1 650 650 MET H H 650 8.332 8.332 7.561 0.771 18804 319 1 2 . 1 1 651 651 VAL N N 651 118.009 118.009 118.741 -0.732 18804 320 1 2 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.655 -0.115 18804 321 1 2 . 1 1 651 651 VAL C C 651 176.672 176.672 178.220 -1.548 18804 322 1 2 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.470 -1.191 18804 323 1 2 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.682 -0.384 18804 324 1 2 . 1 1 651 651 VAL H H 651 8.038 8.038 8.798 -0.760 18804 325 1 2 . 1 1 652 652 GLY N N 652 105.785 105.785 107.216 -1.431 18804 326 1 2 . 1 1 652 652 GLY C C 652 173.359 173.359 175.477 -2.118 18804 327 1 2 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.298 -0.310 18804 328 1 2 . 1 1 652 652 GLY H H 652 8.157 8.157 8.035 0.122 18804 329 1 2 . 1 1 653 653 ALA N N 653 121.803 121.803 124.918 -3.115 18804 330 1 2 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.200 -0.273 18804 331 1 2 . 1 1 653 653 ALA C C 653 177.608 177.608 179.658 -2.050 18804 332 1 2 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.636 0.011 18804 333 1 2 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.359 -0.802 18804 334 1 2 . 1 1 653 653 ALA H H 653 8.050 8.050 7.742 0.308 18804 335 1 2 . 1 1 654 654 LEU N N 654 116.652 116.652 119.753 -3.101 18804 336 1 2 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.878 0.074 18804 337 1 2 . 1 1 654 654 LEU C C 654 177.361 177.361 179.130 -1.769 18804 338 1 2 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.159 -0.897 18804 339 1 2 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.781 -0.878 18804 340 1 2 . 1 1 654 654 LEU H H 654 7.919 7.919 8.426 -0.507 18804 341 1 2 . 1 1 655 655 LEU N N 655 117.910 117.910 118.739 -0.829 18804 342 1 2 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.934 0.003 18804 343 1 2 . 1 1 655 655 LEU C C 655 177.353 177.353 179.223 -1.870 18804 344 1 2 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.925 -0.410 18804 345 1 2 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.602 -0.792 18804 346 1 2 . 1 1 655 655 LEU H H 655 8.189 8.189 8.206 -0.017 18804 347 1 2 . 1 1 656 656 LEU N N 656 118.140 118.140 119.136 -0.996 18804 348 1 2 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.917 -0.008 18804 349 1 2 . 1 1 656 656 LEU C C 656 177.304 177.304 179.209 -1.905 18804 350 1 2 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.735 -0.238 18804 351 1 2 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.639 -0.878 18804 352 1 2 . 1 1 656 656 LEU H H 656 8.022 8.022 7.684 0.338 18804 353 1 2 . 1 1 657 657 LEU N N 657 118.079 118.079 119.949 -1.870 18804 354 1 2 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.868 -0.030 18804 355 1 2 . 1 1 657 657 LEU C C 657 177.304 177.304 178.999 -1.695 18804 356 1 2 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.231 -0.655 18804 357 1 2 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.648 -0.851 18804 358 1 2 . 1 1 657 657 LEU H H 657 8.073 8.073 8.151 -0.078 18804 359 1 2 . 1 1 658 658 LEU N N 658 118.238 118.238 118.955 -0.717 18804 360 1 2 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.912 0.011 18804 361 1 2 . 1 1 658 658 LEU C C 658 177.353 177.353 179.163 -1.810 18804 362 1 2 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.005 -0.496 18804 363 1 2 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.650 -0.761 18804 364 1 2 . 1 1 658 658 LEU H H 658 8.148 8.148 7.725 0.423 18804 365 1 2 . 1 1 659 659 VAL N N 659 117.951 117.951 118.865 -0.914 18804 366 1 2 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.670 -0.166 18804 367 1 2 . 1 1 659 659 VAL C C 659 176.888 176.888 177.972 -1.084 18804 368 1 2 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.516 -0.024 18804 369 1 2 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.076 -0.704 18804 370 1 2 . 1 1 659 659 VAL H H 659 8.150 8.150 7.717 0.433 18804 371 1 2 . 1 1 660 660 VAL N N 660 119.240 119.240 120.369 -1.129 18804 372 1 2 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.522 -0.033 18804 373 1 2 . 1 1 660 660 VAL C C 660 176.494 176.494 177.513 -1.019 18804 374 1 2 . 1 1 660 660 VAL CA C 660 66.350 66.350 67.082 -0.732 18804 375 1 2 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.203 -0.813 18804 376 1 2 . 1 1 660 660 VAL H H 660 8.220 8.220 7.917 0.303 18804 377 1 2 . 1 1 661 661 ALA N N 661 121.414 121.414 122.593 -1.179 18804 378 1 2 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.003 -0.111 18804 379 1 2 . 1 1 661 661 ALA C C 661 178.419 178.419 179.612 -1.193 18804 380 1 2 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.359 -0.264 18804 381 1 2 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.168 -0.869 18804 382 1 2 . 1 1 661 661 ALA H H 661 8.562 8.562 7.781 0.781 18804 383 1 2 . 1 1 662 662 LEU N N 662 117.019 117.019 118.791 -1.772 18804 384 1 2 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.886 0.091 18804 385 1 2 . 1 1 662 662 LEU C C 662 178.078 178.078 179.201 -1.123 18804 386 1 2 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.574 -0.258 18804 387 1 2 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.680 -0.641 18804 388 1 2 . 1 1 662 662 LEU H H 662 8.460 8.460 7.947 0.513 18804 389 1 2 . 1 1 663 663 GLY N N 663 106.924 106.924 107.293 -0.369 18804 390 1 2 . 1 1 663 663 GLY C C 663 174.372 174.372 176.127 -1.755 18804 391 1 2 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.319 -0.220 18804 392 1 2 . 1 1 663 663 GLY H H 663 8.683 8.683 8.042 0.641 18804 393 1 2 . 1 1 664 664 ILE N N 664 121.523 121.523 122.749 -1.226 18804 394 1 2 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.664 0.035 18804 395 1 2 . 1 1 664 664 ILE C C 664 177.614 177.614 178.062 -0.448 18804 396 1 2 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.157 -0.122 18804 397 1 2 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.675 -0.843 18804 398 1 2 . 1 1 664 664 ILE H H 664 8.750 8.750 8.039 0.711 18804 399 1 2 . 1 1 665 665 GLY N N 665 107.803 107.803 108.353 -0.550 18804 400 1 2 . 1 1 665 665 GLY C C 665 174.402 174.402 176.310 -1.908 18804 401 1 2 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.352 -0.143 18804 402 1 2 . 1 1 665 665 GLY H H 665 8.689 8.689 8.084 0.605 18804 403 1 2 . 1 1 666 666 LEU N N 666 121.365 121.365 122.028 -0.663 18804 404 1 2 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.062 -0.027 18804 405 1 2 . 1 1 666 666 LEU C C 666 178.291 178.291 178.835 -0.544 18804 406 1 2 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.077 0.255 18804 407 1 2 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.803 -0.583 18804 408 1 2 . 1 1 666 666 LEU H H 666 8.744 8.744 7.929 0.815 18804 409 1 2 . 1 1 667 667 PHE N N 667 119.838 119.838 121.231 -1.393 18804 410 1 2 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.028 0.063 18804 411 1 2 . 1 1 667 667 PHE C C 667 176.965 176.965 177.350 -0.385 18804 412 1 2 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.810 -0.779 18804 413 1 2 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.413 -0.652 18804 414 1 2 . 1 1 667 667 PHE H H 667 8.454 8.454 8.333 0.121 18804 415 1 2 . 1 1 668 668 MET N N 668 116.868 116.868 117.146 -0.278 18804 416 1 2 . 1 1 668 668 MET HA H 668 4.035 4.035 3.920 0.115 18804 417 1 2 . 1 1 668 668 MET C C 668 177.678 177.678 178.798 -1.120 18804 418 1 2 . 1 1 668 668 MET CA C 668 57.405 57.405 59.242 -1.837 18804 419 1 2 . 1 1 668 668 MET CB C 668 31.739 31.739 32.504 -0.765 18804 420 1 2 . 1 1 668 668 MET H H 668 8.701 8.701 8.659 0.042 18804 421 1 2 . 1 1 669 669 ARG N N 669 118.600 118.600 117.193 1.407 18804 422 1 2 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.010 0.125 18804 423 1 2 . 1 1 669 669 ARG C C 669 177.120 177.120 177.678 -0.558 18804 424 1 2 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.264 -1.012 18804 425 1 2 . 1 1 669 669 ARG CB C 669 29.504 29.504 29.916 -0.412 18804 426 1 2 . 1 1 669 669 ARG H H 669 8.044 8.044 7.702 0.342 18804 427 1 2 . 1 1 670 670 ARG N N 670 118.124 118.124 117.123 1.001 18804 428 1 2 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.056 0.069 18804 429 1 2 . 1 1 670 670 ARG C C 670 176.240 176.240 176.214 0.026 18804 430 1 2 . 1 1 670 670 ARG CA C 670 56.738 56.738 57.527 -0.789 18804 431 1 2 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.823 -1.356 18804 432 1 2 . 1 1 670 670 ARG H H 670 7.864 7.864 7.440 0.424 18804 433 1 2 . 1 1 671 671 ARG N N 671 117.904 117.904 118.208 -0.304 18804 434 1 2 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.412 -0.326 18804 435 1 2 . 1 1 671 671 ARG C C 671 175.233 175.233 175.633 -0.400 18804 436 1 2 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.297 1.434 18804 437 1 2 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.856 -1.362 18804 438 1 2 . 1 1 671 671 ARG H H 671 7.677 7.677 7.169 0.508 18804 439 1 2 . 1 1 672 672 HIS N N 672 117.048 117.048 122.452 -5.404 18804 440 1 2 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.467 0.136 18804 441 1 2 . 1 1 672 672 HIS C C 672 173.634 173.634 175.838 -2.204 18804 442 1 2 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.967 -2.126 18804 443 1 2 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.777 -2.591 18804 444 1 2 . 1 1 672 672 HIS H H 672 7.920 7.920 8.480 -0.560 18804 445 1 2 . 1 1 673 673 ILE N N 673 120.795 120.795 122.104 -1.309 18804 446 1 2 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.286 -0.212 18804 447 1 2 . 1 1 673 673 ILE C C 673 174.922 174.922 176.301 -1.379 18804 448 1 2 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.753 0.024 18804 449 1 2 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.827 -0.991 18804 450 1 2 . 1 1 673 673 ILE H H 673 7.900 7.900 8.452 -0.552 18804 451 1 2 . 1 1 674 674 VAL N N 674 122.867 122.867 123.493 -0.626 18804 452 1 2 . 1 1 674 674 VAL HA H 674 4.081 4.081 3.829 0.252 18804 453 1 2 . 1 1 674 674 VAL C C 674 174.876 174.876 176.431 -1.555 18804 454 1 2 . 1 1 674 674 VAL CA C 674 61.370 61.370 64.056 -2.686 18804 455 1 2 . 1 1 674 674 VAL CB C 674 31.994 31.994 31.875 0.119 18804 456 1 2 . 1 1 674 674 VAL H H 674 8.003 8.003 8.250 -0.247 18804 457 1 2 . 1 1 675 675 ARG N N 675 124.866 124.866 120.704 4.162 18804 458 1 2 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.269 -0.212 18804 459 1 2 . 1 1 675 675 ARG C C 675 174.922 174.922 176.765 -1.843 18804 460 1 2 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.461 -1.277 18804 461 1 2 . 1 1 675 675 ARG CB C 675 30.316 30.316 31.126 -0.810 18804 462 1 2 . 1 1 675 675 ARG H H 675 8.266 8.266 7.839 0.427 18804 463 1 2 . 1 1 676 676 LYS N N 676 123.517 123.517 123.683 -0.166 18804 464 1 2 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.128 0.137 18804 465 1 2 . 1 1 676 676 LYS C C 676 174.625 174.625 176.646 -2.021 18804 466 1 2 . 1 1 676 676 LYS CA C 676 55.753 55.753 58.552 -2.799 18804 467 1 2 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.670 -2.389 18804 468 1 2 . 1 1 676 676 LYS H H 676 8.260 8.260 8.566 -0.306 18804 469 1 3 . 1 1 635 635 GLY N N 635 108.817 108.817 111.025 -2.208 18804 470 1 3 . 1 1 635 635 GLY C C 635 172.499 172.499 173.738 -1.239 18804 471 1 3 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.156 -0.887 18804 472 1 3 . 1 1 635 635 GLY H H 635 8.390 8.390 8.572 -0.182 18804 473 1 3 . 1 1 636 636 CYS N N 636 120.634 120.634 123.370 -2.736 18804 474 1 3 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.774 0.248 18804 475 1 3 . 1 1 636 636 CYS C C 636 172.181 172.181 173.295 -1.114 18804 476 1 3 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.725 -4.131 18804 477 1 3 . 1 1 636 636 CYS CB C 636 39.488 39.488 29.505 9.983 18804 478 1 3 . 1 1 636 636 CYS H H 636 8.327 8.327 8.229 0.098 18804 479 1 3 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.487 0.013 18804 480 1 3 . 1 1 637 637 PRO C C 637 176.215 176.215 176.152 0.063 18804 481 1 3 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.273 -1.595 18804 482 1 3 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.694 -0.352 18804 483 1 3 . 1 1 638 638 THR N N 638 113.690 113.690 109.846 3.844 18804 484 1 3 . 1 1 638 638 THR HA H 638 4.305 4.305 3.960 0.345 18804 485 1 3 . 1 1 638 638 THR C C 638 173.495 173.495 173.193 0.302 18804 486 1 3 . 1 1 638 638 THR CA C 638 60.998 60.998 62.812 -1.814 18804 487 1 3 . 1 1 638 638 THR CB C 638 68.954 68.954 66.916 2.038 18804 488 1 3 . 1 1 638 638 THR H H 638 8.114 8.114 8.061 0.053 18804 489 1 3 . 1 1 639 639 ASN N N 639 120.695 120.695 118.338 2.357 18804 490 1 3 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.814 -0.041 18804 491 1 3 . 1 1 639 639 ASN C C 639 174.216 174.216 174.744 -0.528 18804 492 1 3 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.979 -0.622 18804 493 1 3 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.408 -0.827 18804 494 1 3 . 1 1 639 639 ASN H H 639 8.301 8.301 8.007 0.294 18804 495 1 3 . 1 1 640 640 GLY N N 640 108.827 108.827 112.564 -3.737 18804 496 1 3 . 1 1 640 640 GLY C C 640 170.506 170.506 172.510 -2.004 18804 497 1 3 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.773 -0.917 18804 498 1 3 . 1 1 640 640 GLY H H 640 8.111 8.111 8.317 -0.206 18804 499 1 3 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.921 -0.469 18804 500 1 3 . 1 1 641 641 PRO C C 641 175.669 175.669 176.190 -0.521 18804 501 1 3 . 1 1 641 641 PRO CA C 641 62.075 62.075 63.168 -1.093 18804 502 1 3 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.988 -1.500 18804 503 1 3 . 1 1 642 642 LYS N N 642 121.521 121.521 120.627 0.894 18804 504 1 3 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.546 -0.220 18804 505 1 3 . 1 1 642 642 LYS C C 642 175.106 175.106 175.024 0.082 18804 506 1 3 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.826 -0.723 18804 507 1 3 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.189 -1.819 18804 508 1 3 . 1 1 642 642 LYS H H 642 8.417 8.417 8.087 0.330 18804 509 1 3 . 1 1 643 643 ILE N N 643 121.410 121.410 123.922 -2.512 18804 510 1 3 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.442 -0.107 18804 511 1 3 . 1 1 643 643 ILE C C 643 173.587 173.587 174.797 -1.210 18804 512 1 3 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.827 -1.953 18804 513 1 3 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.755 -0.137 18804 514 1 3 . 1 1 643 643 ILE H H 643 8.069 8.069 8.532 -0.463 18804 515 1 3 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.563 -0.110 18804 516 1 3 . 1 1 644 644 PRO C C 644 175.623 175.623 177.559 -1.936 18804 517 1 3 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.348 0.111 18804 518 1 3 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.400 -0.892 18804 519 1 3 . 1 1 645 645 SER N N 645 115.445 115.445 113.773 1.672 18804 520 1 3 . 1 1 645 645 SER HA H 645 4.374 4.374 4.253 0.121 18804 521 1 3 . 1 1 645 645 SER C C 645 174.611 174.611 175.948 -1.337 18804 522 1 3 . 1 1 645 645 SER CA C 645 58.566 58.566 60.239 -1.673 18804 523 1 3 . 1 1 645 645 SER CB C 645 62.842 62.842 62.909 -0.067 18804 524 1 3 . 1 1 645 645 SER H H 645 8.267 8.267 8.437 -0.170 18804 525 1 3 . 1 1 646 646 ILE N N 646 120.612 120.612 121.106 -0.494 18804 526 1 3 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.830 0.279 18804 527 1 3 . 1 1 646 646 ILE C C 646 174.703 174.703 176.987 -2.284 18804 528 1 3 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.589 -1.367 18804 529 1 3 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.984 0.676 18804 530 1 3 . 1 1 646 646 ILE H H 646 8.252 8.252 7.903 0.349 18804 531 1 3 . 1 1 647 647 ALA N N 647 123.224 123.224 123.710 -0.486 18804 532 1 3 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.887 0.276 18804 533 1 3 . 1 1 647 647 ALA C C 647 176.526 176.526 179.053 -2.527 18804 534 1 3 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.073 -1.889 18804 535 1 3 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.079 0.170 18804 536 1 3 . 1 1 647 647 ALA H H 647 8.084 8.084 7.649 0.435 18804 537 1 3 . 1 1 648 648 THR N N 648 111.699 111.699 114.557 -2.858 18804 538 1 3 . 1 1 648 648 THR HA H 648 4.021 4.021 3.836 0.185 18804 539 1 3 . 1 1 648 648 THR C C 648 175.018 175.018 176.951 -1.933 18804 540 1 3 . 1 1 648 648 THR CA C 648 63.554 63.554 66.893 -3.339 18804 541 1 3 . 1 1 648 648 THR CB C 648 68.098 68.098 68.475 -0.377 18804 542 1 3 . 1 1 648 648 THR H H 648 7.757 7.757 7.746 0.011 18804 543 1 3 . 1 1 649 649 GLY N N 649 108.587 108.587 109.579 -0.992 18804 544 1 3 . 1 1 649 649 GLY C C 649 173.686 173.686 176.206 -2.520 18804 545 1 3 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.741 -0.797 18804 546 1 3 . 1 1 649 649 GLY H H 649 8.423 8.423 7.877 0.546 18804 547 1 3 . 1 1 650 650 MET N N 650 119.486 119.486 121.715 -2.229 18804 548 1 3 . 1 1 650 650 MET HA H 650 4.135 4.135 4.232 -0.097 18804 549 1 3 . 1 1 650 650 MET C C 650 176.632 176.632 178.675 -2.043 18804 550 1 3 . 1 1 650 650 MET CA C 650 57.749 57.749 57.057 0.692 18804 551 1 3 . 1 1 650 650 MET CB C 650 32.067 32.067 31.756 0.311 18804 552 1 3 . 1 1 650 650 MET H H 650 8.332 8.332 7.577 0.755 18804 553 1 3 . 1 1 651 651 VAL N N 651 118.009 118.009 119.074 -1.065 18804 554 1 3 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.599 -0.059 18804 555 1 3 . 1 1 651 651 VAL C C 651 176.672 176.672 177.941 -1.269 18804 556 1 3 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.240 -0.961 18804 557 1 3 . 1 1 651 651 VAL CB C 651 30.298 30.298 31.229 -0.931 18804 558 1 3 . 1 1 651 651 VAL H H 651 8.038 8.038 8.777 -0.739 18804 559 1 3 . 1 1 652 652 GLY N N 652 105.785 105.785 106.674 -0.889 18804 560 1 3 . 1 1 652 652 GLY C C 652 173.359 173.359 175.414 -2.055 18804 561 1 3 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.258 -0.270 18804 562 1 3 . 1 1 652 652 GLY H H 652 8.157 8.157 7.975 0.182 18804 563 1 3 . 1 1 653 653 ALA N N 653 121.803 121.803 124.902 -3.099 18804 564 1 3 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.201 -0.274 18804 565 1 3 . 1 1 653 653 ALA C C 653 177.608 177.608 179.708 -2.100 18804 566 1 3 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.652 -0.005 18804 567 1 3 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.360 -0.803 18804 568 1 3 . 1 1 653 653 ALA H H 653 8.050 8.050 7.824 0.226 18804 569 1 3 . 1 1 654 654 LEU N N 654 116.652 116.652 119.761 -3.109 18804 570 1 3 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.901 0.051 18804 571 1 3 . 1 1 654 654 LEU C C 654 177.361 177.361 179.131 -1.770 18804 572 1 3 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.145 -0.883 18804 573 1 3 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.809 -0.906 18804 574 1 3 . 1 1 654 654 LEU H H 654 7.919 7.919 8.382 -0.463 18804 575 1 3 . 1 1 655 655 LEU N N 655 117.910 117.910 118.820 -0.910 18804 576 1 3 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.947 -0.010 18804 577 1 3 . 1 1 655 655 LEU C C 655 177.353 177.353 179.259 -1.906 18804 578 1 3 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.907 -0.392 18804 579 1 3 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.632 -0.821 18804 580 1 3 . 1 1 655 655 LEU H H 655 8.189 8.189 8.205 -0.016 18804 581 1 3 . 1 1 656 656 LEU N N 656 118.140 118.140 119.242 -1.102 18804 582 1 3 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.921 -0.012 18804 583 1 3 . 1 1 656 656 LEU C C 656 177.304 177.304 179.141 -1.837 18804 584 1 3 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.820 -0.323 18804 585 1 3 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.684 -0.923 18804 586 1 3 . 1 1 656 656 LEU H H 656 8.022 8.022 7.806 0.216 18804 587 1 3 . 1 1 657 657 LEU N N 657 118.079 118.079 119.874 -1.795 18804 588 1 3 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.867 -0.029 18804 589 1 3 . 1 1 657 657 LEU C C 657 177.304 177.304 178.999 -1.695 18804 590 1 3 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.256 -0.680 18804 591 1 3 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.648 -0.852 18804 592 1 3 . 1 1 657 657 LEU H H 657 8.073 8.073 8.230 -0.157 18804 593 1 3 . 1 1 658 658 LEU N N 658 118.238 118.238 118.752 -0.514 18804 594 1 3 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.924 -0.001 18804 595 1 3 . 1 1 658 658 LEU C C 658 177.353 177.353 179.157 -1.804 18804 596 1 3 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.109 -0.600 18804 597 1 3 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.744 -0.855 18804 598 1 3 . 1 1 658 658 LEU H H 658 8.148 8.148 7.697 0.451 18804 599 1 3 . 1 1 659 659 VAL N N 659 117.951 117.951 118.987 -1.036 18804 600 1 3 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.607 -0.103 18804 601 1 3 . 1 1 659 659 VAL C C 659 176.888 176.888 178.044 -1.156 18804 602 1 3 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.556 -0.064 18804 603 1 3 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.508 -1.135 18804 604 1 3 . 1 1 659 659 VAL H H 659 8.150 8.150 7.595 0.555 18804 605 1 3 . 1 1 660 660 VAL N N 660 119.240 119.240 120.628 -1.388 18804 606 1 3 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.614 -0.125 18804 607 1 3 . 1 1 660 660 VAL C C 660 176.494 176.494 177.564 -1.070 18804 608 1 3 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.593 -0.243 18804 609 1 3 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.951 -0.561 18804 610 1 3 . 1 1 660 660 VAL H H 660 8.220 8.220 8.028 0.192 18804 611 1 3 . 1 1 661 661 ALA N N 661 121.414 121.414 122.308 -0.894 18804 612 1 3 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.048 -0.156 18804 613 1 3 . 1 1 661 661 ALA C C 661 178.419 178.419 179.757 -1.338 18804 614 1 3 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.313 -0.218 18804 615 1 3 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.161 -0.862 18804 616 1 3 . 1 1 661 661 ALA H H 661 8.562 8.562 7.837 0.725 18804 617 1 3 . 1 1 662 662 LEU N N 662 117.019 117.019 118.839 -1.820 18804 618 1 3 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.889 0.088 18804 619 1 3 . 1 1 662 662 LEU C C 662 178.078 178.078 179.219 -1.141 18804 620 1 3 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.561 -0.245 18804 621 1 3 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.655 -0.616 18804 622 1 3 . 1 1 662 662 LEU H H 662 8.460 8.460 7.927 0.533 18804 623 1 3 . 1 1 663 663 GLY N N 663 106.924 106.924 107.145 -0.221 18804 624 1 3 . 1 1 663 663 GLY C C 663 174.372 174.372 176.123 -1.751 18804 625 1 3 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.219 -0.120 18804 626 1 3 . 1 1 663 663 GLY H H 663 8.683 8.683 7.939 0.744 18804 627 1 3 . 1 1 664 664 ILE N N 664 121.523 121.523 122.645 -1.122 18804 628 1 3 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.661 0.038 18804 629 1 3 . 1 1 664 664 ILE C C 664 177.614 177.614 178.169 -0.555 18804 630 1 3 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.058 -0.023 18804 631 1 3 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.754 -0.922 18804 632 1 3 . 1 1 664 664 ILE H H 664 8.750 8.750 7.952 0.798 18804 633 1 3 . 1 1 665 665 GLY N N 665 107.803 107.803 108.114 -0.311 18804 634 1 3 . 1 1 665 665 GLY C C 665 174.402 174.402 176.049 -1.647 18804 635 1 3 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.323 -0.114 18804 636 1 3 . 1 1 665 665 GLY H H 665 8.689 8.689 8.057 0.632 18804 637 1 3 . 1 1 666 666 LEU N N 666 121.365 121.365 122.138 -0.773 18804 638 1 3 . 1 1 666 666 LEU HA H 666 4.035 4.035 3.959 0.076 18804 639 1 3 . 1 1 666 666 LEU C C 666 178.291 178.291 179.124 -0.833 18804 640 1 3 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.349 -0.018 18804 641 1 3 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.858 -0.638 18804 642 1 3 . 1 1 666 666 LEU H H 666 8.744 8.744 7.938 0.806 18804 643 1 3 . 1 1 667 667 PHE N N 667 119.838 119.838 120.212 -0.374 18804 644 1 3 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.177 -0.086 18804 645 1 3 . 1 1 667 667 PHE C C 667 176.965 176.965 177.047 -0.082 18804 646 1 3 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.062 -0.032 18804 647 1 3 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.542 -0.781 18804 648 1 3 . 1 1 667 667 PHE H H 667 8.454 8.454 7.864 0.590 18804 649 1 3 . 1 1 668 668 MET N N 668 116.868 116.868 119.223 -2.355 18804 650 1 3 . 1 1 668 668 MET HA H 668 4.035 4.035 3.702 0.333 18804 651 1 3 . 1 1 668 668 MET C C 668 177.678 177.678 178.569 -0.891 18804 652 1 3 . 1 1 668 668 MET CA C 668 57.405 57.405 59.650 -2.245 18804 653 1 3 . 1 1 668 668 MET CB C 668 31.739 31.739 32.322 -0.583 18804 654 1 3 . 1 1 668 668 MET H H 668 8.701 8.701 8.524 0.177 18804 655 1 3 . 1 1 669 669 ARG N N 669 118.600 118.600 116.441 2.159 18804 656 1 3 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.152 -0.017 18804 657 1 3 . 1 1 669 669 ARG C C 669 177.120 177.120 178.176 -1.056 18804 658 1 3 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.588 -1.336 18804 659 1 3 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.114 -0.610 18804 660 1 3 . 1 1 669 669 ARG H H 669 8.044 8.044 7.956 0.088 18804 661 1 3 . 1 1 670 670 ARG N N 670 118.124 118.124 117.995 0.129 18804 662 1 3 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.115 0.010 18804 663 1 3 . 1 1 670 670 ARG C C 670 176.240 176.240 177.799 -1.559 18804 664 1 3 . 1 1 670 670 ARG CA C 670 56.738 56.738 57.969 -1.231 18804 665 1 3 . 1 1 670 670 ARG CB C 670 29.467 29.467 29.842 -0.375 18804 666 1 3 . 1 1 670 670 ARG H H 670 7.864 7.864 7.403 0.461 18804 667 1 3 . 1 1 671 671 ARG N N 671 117.904 117.904 115.080 2.824 18804 668 1 3 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.244 -0.158 18804 669 1 3 . 1 1 671 671 ARG C C 671 175.233 175.233 176.492 -1.259 18804 670 1 3 . 1 1 671 671 ARG CA C 671 55.731 55.731 56.345 -0.614 18804 671 1 3 . 1 1 671 671 ARG CB C 671 29.494 29.494 31.795 -2.301 18804 672 1 3 . 1 1 671 671 ARG H H 671 7.677 7.677 7.147 0.530 18804 673 1 3 . 1 1 672 672 HIS N N 672 117.048 117.048 118.540 -1.492 18804 674 1 3 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.589 0.014 18804 675 1 3 . 1 1 672 672 HIS C C 672 173.634 173.634 174.931 -1.297 18804 676 1 3 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.419 -0.578 18804 677 1 3 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.638 -2.452 18804 678 1 3 . 1 1 672 672 HIS H H 672 7.920 7.920 7.877 0.043 18804 679 1 3 . 1 1 673 673 ILE N N 673 120.795 120.795 121.383 -0.588 18804 680 1 3 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.390 -0.316 18804 681 1 3 . 1 1 673 673 ILE C C 673 174.922 174.922 175.342 -0.420 18804 682 1 3 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.286 0.491 18804 683 1 3 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.415 -0.579 18804 684 1 3 . 1 1 673 673 ILE H H 673 7.900 7.900 8.215 -0.315 18804 685 1 3 . 1 1 674 674 VAL N N 674 122.867 122.867 126.452 -3.585 18804 686 1 3 . 1 1 674 674 VAL HA H 674 4.081 4.081 3.997 0.084 18804 687 1 3 . 1 1 674 674 VAL C C 674 174.876 174.876 175.997 -1.121 18804 688 1 3 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.670 -1.300 18804 689 1 3 . 1 1 674 674 VAL CB C 674 31.994 31.994 33.556 -1.562 18804 690 1 3 . 1 1 674 674 VAL H H 674 8.003 8.003 8.347 -0.344 18804 691 1 3 . 1 1 675 675 ARG N N 675 124.866 124.866 125.697 -0.831 18804 692 1 3 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.361 -0.304 18804 693 1 3 . 1 1 675 675 ARG C C 675 174.922 174.922 176.090 -1.168 18804 694 1 3 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.797 -1.613 18804 695 1 3 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.757 -0.441 18804 696 1 3 . 1 1 675 675 ARG H H 675 8.266 8.266 8.502 -0.236 18804 697 1 3 . 1 1 676 676 LYS N N 676 123.517 123.517 120.517 3.000 18804 698 1 3 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.062 0.203 18804 699 1 3 . 1 1 676 676 LYS C C 676 174.625 174.625 176.225 -1.600 18804 700 1 3 . 1 1 676 676 LYS CA C 676 55.753 55.753 57.497 -1.744 18804 701 1 3 . 1 1 676 676 LYS CB C 676 30.281 30.281 31.213 -0.932 18804 702 1 3 . 1 1 676 676 LYS H H 676 8.260 8.260 8.564 -0.304 18804 703 1 4 . 1 1 635 635 GLY N N 635 108.817 108.817 110.213 -1.396 18804 704 1 4 . 1 1 635 635 GLY C C 635 172.499 172.499 173.239 -0.740 18804 705 1 4 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.350 -1.081 18804 706 1 4 . 1 1 635 635 GLY H H 635 8.390 8.390 8.267 0.123 18804 707 1 4 . 1 1 636 636 CYS N N 636 120.634 120.634 121.057 -0.423 18804 708 1 4 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.863 0.159 18804 709 1 4 . 1 1 636 636 CYS C C 636 172.181 172.181 173.721 -1.540 18804 710 1 4 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.913 -4.319 18804 711 1 4 . 1 1 636 636 CYS CB C 636 39.488 39.488 27.676 11.812 18804 712 1 4 . 1 1 636 636 CYS H H 636 8.327 8.327 8.187 0.140 18804 713 1 4 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.521 -0.021 18804 714 1 4 . 1 1 637 637 PRO C C 637 176.215 176.215 177.258 -1.043 18804 715 1 4 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.363 -1.685 18804 716 1 4 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.986 -0.644 18804 717 1 4 . 1 1 638 638 THR N N 638 113.690 113.690 111.534 2.156 18804 718 1 4 . 1 1 638 638 THR HA H 638 4.305 4.305 4.061 0.244 18804 719 1 4 . 1 1 638 638 THR C C 638 173.495 173.495 174.602 -1.107 18804 720 1 4 . 1 1 638 638 THR CA C 638 60.998 60.998 63.515 -2.517 18804 721 1 4 . 1 1 638 638 THR CB C 638 68.954 68.954 68.918 0.036 18804 722 1 4 . 1 1 638 638 THR H H 638 8.114 8.114 7.928 0.186 18804 723 1 4 . 1 1 639 639 ASN N N 639 120.695 120.695 119.609 1.086 18804 724 1 4 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.543 0.230 18804 725 1 4 . 1 1 639 639 ASN C C 639 174.216 174.216 175.322 -1.106 18804 726 1 4 . 1 1 639 639 ASN CA C 639 52.357 52.357 54.011 -1.654 18804 727 1 4 . 1 1 639 639 ASN CB C 639 38.581 38.581 38.234 0.346 18804 728 1 4 . 1 1 639 639 ASN H H 639 8.301 8.301 7.598 0.703 18804 729 1 4 . 1 1 640 640 GLY N N 640 108.827 108.827 108.327 0.500 18804 730 1 4 . 1 1 640 640 GLY C C 640 170.506 170.506 172.389 -1.883 18804 731 1 4 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.402 -0.547 18804 732 1 4 . 1 1 640 640 GLY H H 640 8.111 8.111 8.396 -0.285 18804 733 1 4 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.508 -0.056 18804 734 1 4 . 1 1 641 641 PRO C C 641 175.669 175.669 176.025 -0.356 18804 735 1 4 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.794 -0.719 18804 736 1 4 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.436 -0.948 18804 737 1 4 . 1 1 642 642 LYS N N 642 121.521 121.521 123.035 -1.514 18804 738 1 4 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.604 -0.278 18804 739 1 4 . 1 1 642 642 LYS C C 642 175.106 175.106 175.636 -0.530 18804 740 1 4 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.303 -1.200 18804 741 1 4 . 1 1 642 642 LYS CB C 642 32.370 32.370 35.237 -2.867 18804 742 1 4 . 1 1 642 642 LYS H H 642 8.417 8.417 8.302 0.115 18804 743 1 4 . 1 1 643 643 ILE N N 643 121.410 121.410 124.822 -3.412 18804 744 1 4 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.476 -0.141 18804 745 1 4 . 1 1 643 643 ILE C C 643 173.587 173.587 174.742 -1.155 18804 746 1 4 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.538 -1.664 18804 747 1 4 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.251 -0.633 18804 748 1 4 . 1 1 643 643 ILE H H 643 8.069 8.069 8.411 -0.342 18804 749 1 4 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.574 -0.121 18804 750 1 4 . 1 1 644 644 PRO C C 644 175.623 175.623 177.728 -2.105 18804 751 1 4 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.448 0.011 18804 752 1 4 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.371 -0.863 18804 753 1 4 . 1 1 645 645 SER N N 645 115.445 115.445 114.039 1.406 18804 754 1 4 . 1 1 645 645 SER HA H 645 4.374 4.374 4.293 0.081 18804 755 1 4 . 1 1 645 645 SER C C 645 174.611 174.611 175.718 -1.107 18804 756 1 4 . 1 1 645 645 SER CA C 645 58.566 58.566 60.422 -1.856 18804 757 1 4 . 1 1 645 645 SER CB C 645 62.842 62.842 62.512 0.330 18804 758 1 4 . 1 1 645 645 SER H H 645 8.267 8.267 8.469 -0.202 18804 759 1 4 . 1 1 646 646 ILE N N 646 120.612 120.612 121.822 -1.210 18804 760 1 4 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.915 0.194 18804 761 1 4 . 1 1 646 646 ILE C C 646 174.703 174.703 177.318 -2.615 18804 762 1 4 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.180 0.042 18804 763 1 4 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.047 1.613 18804 764 1 4 . 1 1 646 646 ILE H H 646 8.252 8.252 7.944 0.308 18804 765 1 4 . 1 1 647 647 ALA N N 647 123.224 123.224 124.047 -0.823 18804 766 1 4 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.870 0.293 18804 767 1 4 . 1 1 647 647 ALA C C 647 176.526 176.526 179.234 -2.708 18804 768 1 4 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.190 -2.006 18804 769 1 4 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.138 0.111 18804 770 1 4 . 1 1 647 647 ALA H H 647 8.084 8.084 7.641 0.443 18804 771 1 4 . 1 1 648 648 THR N N 648 111.699 111.699 114.405 -2.706 18804 772 1 4 . 1 1 648 648 THR HA H 648 4.021 4.021 3.877 0.144 18804 773 1 4 . 1 1 648 648 THR C C 648 175.018 175.018 176.910 -1.892 18804 774 1 4 . 1 1 648 648 THR CA C 648 63.554 63.554 67.524 -3.970 18804 775 1 4 . 1 1 648 648 THR CB C 648 68.098 68.098 68.450 -0.352 18804 776 1 4 . 1 1 648 648 THR H H 648 7.757 7.757 7.724 0.033 18804 777 1 4 . 1 1 649 649 GLY N N 649 108.587 108.587 109.483 -0.896 18804 778 1 4 . 1 1 649 649 GLY C C 649 173.686 173.686 176.305 -2.619 18804 779 1 4 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.801 -0.857 18804 780 1 4 . 1 1 649 649 GLY H H 649 8.423 8.423 7.917 0.506 18804 781 1 4 . 1 1 650 650 MET N N 650 119.486 119.486 121.468 -1.982 18804 782 1 4 . 1 1 650 650 MET HA H 650 4.135 4.135 4.309 -0.174 18804 783 1 4 . 1 1 650 650 MET C C 650 176.632 176.632 178.638 -2.006 18804 784 1 4 . 1 1 650 650 MET CA C 650 57.749 57.749 56.909 0.840 18804 785 1 4 . 1 1 650 650 MET CB C 650 32.067 32.067 31.651 0.416 18804 786 1 4 . 1 1 650 650 MET H H 650 8.332 8.332 7.564 0.768 18804 787 1 4 . 1 1 651 651 VAL N N 651 118.009 118.009 119.068 -1.059 18804 788 1 4 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.681 -0.141 18804 789 1 4 . 1 1 651 651 VAL C C 651 176.672 176.672 178.211 -1.539 18804 790 1 4 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.500 -1.221 18804 791 1 4 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.800 -0.502 18804 792 1 4 . 1 1 651 651 VAL H H 651 8.038 8.038 8.787 -0.749 18804 793 1 4 . 1 1 652 652 GLY N N 652 105.785 105.785 107.137 -1.352 18804 794 1 4 . 1 1 652 652 GLY C C 652 173.359 173.359 175.455 -2.096 18804 795 1 4 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.288 -0.300 18804 796 1 4 . 1 1 652 652 GLY H H 652 8.157 8.157 8.033 0.124 18804 797 1 4 . 1 1 653 653 ALA N N 653 121.803 121.803 124.948 -3.145 18804 798 1 4 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.202 -0.275 18804 799 1 4 . 1 1 653 653 ALA C C 653 177.608 177.608 179.585 -1.977 18804 800 1 4 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.643 0.004 18804 801 1 4 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.343 -0.786 18804 802 1 4 . 1 1 653 653 ALA H H 653 8.050 8.050 7.731 0.319 18804 803 1 4 . 1 1 654 654 LEU N N 654 116.652 116.652 119.733 -3.081 18804 804 1 4 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.866 0.086 18804 805 1 4 . 1 1 654 654 LEU C C 654 177.361 177.361 179.153 -1.792 18804 806 1 4 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.121 -0.859 18804 807 1 4 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.759 -0.856 18804 808 1 4 . 1 1 654 654 LEU H H 654 7.919 7.919 8.287 -0.368 18804 809 1 4 . 1 1 655 655 LEU N N 655 117.910 117.910 118.646 -0.736 18804 810 1 4 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.932 0.005 18804 811 1 4 . 1 1 655 655 LEU C C 655 177.353 177.353 179.176 -1.823 18804 812 1 4 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.889 -0.374 18804 813 1 4 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.597 -0.787 18804 814 1 4 . 1 1 655 655 LEU H H 655 8.189 8.189 8.028 0.161 18804 815 1 4 . 1 1 656 656 LEU N N 656 118.140 118.140 119.280 -1.140 18804 816 1 4 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.902 0.007 18804 817 1 4 . 1 1 656 656 LEU C C 656 177.304 177.304 179.219 -1.915 18804 818 1 4 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.818 -0.321 18804 819 1 4 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.632 -0.871 18804 820 1 4 . 1 1 656 656 LEU H H 656 8.022 8.022 7.651 0.371 18804 821 1 4 . 1 1 657 657 LEU N N 657 118.079 118.079 119.783 -1.704 18804 822 1 4 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.859 -0.021 18804 823 1 4 . 1 1 657 657 LEU C C 657 177.304 177.304 179.026 -1.722 18804 824 1 4 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.177 -0.601 18804 825 1 4 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.602 -0.805 18804 826 1 4 . 1 1 657 657 LEU H H 657 8.073 8.073 8.320 -0.247 18804 827 1 4 . 1 1 658 658 LEU N N 658 118.238 118.238 118.958 -0.720 18804 828 1 4 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.896 0.027 18804 829 1 4 . 1 1 658 658 LEU C C 658 177.353 177.353 179.104 -1.751 18804 830 1 4 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.174 -0.665 18804 831 1 4 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.770 -0.881 18804 832 1 4 . 1 1 658 658 LEU H H 658 8.148 8.148 7.707 0.441 18804 833 1 4 . 1 1 659 659 VAL N N 659 117.951 117.951 118.810 -0.859 18804 834 1 4 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.593 -0.089 18804 835 1 4 . 1 1 659 659 VAL C C 659 176.888 176.888 178.037 -1.149 18804 836 1 4 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.700 -0.208 18804 837 1 4 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.469 -1.097 18804 838 1 4 . 1 1 659 659 VAL H H 659 8.150 8.150 7.706 0.444 18804 839 1 4 . 1 1 660 660 VAL N N 660 119.240 119.240 120.457 -1.217 18804 840 1 4 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.593 -0.104 18804 841 1 4 . 1 1 660 660 VAL C C 660 176.494 176.494 177.553 -1.059 18804 842 1 4 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.385 -0.035 18804 843 1 4 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.858 -0.469 18804 844 1 4 . 1 1 660 660 VAL H H 660 8.220 8.220 7.936 0.284 18804 845 1 4 . 1 1 661 661 ALA N N 661 121.414 121.414 122.406 -0.992 18804 846 1 4 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.022 -0.130 18804 847 1 4 . 1 1 661 661 ALA C C 661 178.419 178.419 179.815 -1.396 18804 848 1 4 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.330 -0.235 18804 849 1 4 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.149 -0.850 18804 850 1 4 . 1 1 661 661 ALA H H 661 8.562 8.562 7.862 0.700 18804 851 1 4 . 1 1 662 662 LEU N N 662 117.019 117.019 118.879 -1.860 18804 852 1 4 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.866 0.111 18804 853 1 4 . 1 1 662 662 LEU C C 662 178.078 178.078 179.231 -1.153 18804 854 1 4 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.689 -0.373 18804 855 1 4 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.666 -0.627 18804 856 1 4 . 1 1 662 662 LEU H H 662 8.460 8.460 7.950 0.510 18804 857 1 4 . 1 1 663 663 GLY N N 663 106.924 106.924 107.218 -0.294 18804 858 1 4 . 1 1 663 663 GLY C C 663 174.372 174.372 176.116 -1.744 18804 859 1 4 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.242 -0.143 18804 860 1 4 . 1 1 663 663 GLY H H 663 8.683 8.683 7.956 0.727 18804 861 1 4 . 1 1 664 664 ILE N N 664 121.523 121.523 122.818 -1.295 18804 862 1 4 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.654 0.045 18804 863 1 4 . 1 1 664 664 ILE C C 664 177.614 177.614 178.133 -0.519 18804 864 1 4 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.060 -0.025 18804 865 1 4 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.669 -0.837 18804 866 1 4 . 1 1 664 664 ILE H H 664 8.750 8.750 8.174 0.576 18804 867 1 4 . 1 1 665 665 GLY N N 665 107.803 107.803 108.399 -0.596 18804 868 1 4 . 1 1 665 665 GLY C C 665 174.402 174.402 176.222 -1.820 18804 869 1 4 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.326 -0.117 18804 870 1 4 . 1 1 665 665 GLY H H 665 8.689 8.689 8.258 0.431 18804 871 1 4 . 1 1 666 666 LEU N N 666 121.365 121.365 122.120 -0.755 18804 872 1 4 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.059 -0.024 18804 873 1 4 . 1 1 666 666 LEU C C 666 178.291 178.291 178.929 -0.638 18804 874 1 4 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.108 0.223 18804 875 1 4 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.823 -0.603 18804 876 1 4 . 1 1 666 666 LEU H H 666 8.744 8.744 7.896 0.848 18804 877 1 4 . 1 1 667 667 PHE N N 667 119.838 119.838 121.333 -1.495 18804 878 1 4 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.069 0.022 18804 879 1 4 . 1 1 667 667 PHE C C 667 176.965 176.965 177.292 -0.327 18804 880 1 4 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.970 -0.939 18804 881 1 4 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.435 -0.674 18804 882 1 4 . 1 1 667 667 PHE H H 667 8.454 8.454 8.522 -0.068 18804 883 1 4 . 1 1 668 668 MET N N 668 116.868 116.868 117.580 -0.712 18804 884 1 4 . 1 1 668 668 MET HA H 668 4.035 4.035 3.895 0.140 18804 885 1 4 . 1 1 668 668 MET C C 668 177.678 177.678 178.422 -0.744 18804 886 1 4 . 1 1 668 668 MET CA C 668 57.405 57.405 59.474 -2.068 18804 887 1 4 . 1 1 668 668 MET CB C 668 31.739 31.739 32.505 -0.766 18804 888 1 4 . 1 1 668 668 MET H H 668 8.701 8.701 8.676 0.025 18804 889 1 4 . 1 1 669 669 ARG N N 669 118.600 118.600 115.942 2.658 18804 890 1 4 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.030 0.105 18804 891 1 4 . 1 1 669 669 ARG C C 669 177.120 177.120 179.061 -1.941 18804 892 1 4 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.488 -1.236 18804 893 1 4 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.058 -0.554 18804 894 1 4 . 1 1 669 669 ARG H H 669 8.044 8.044 7.722 0.322 18804 895 1 4 . 1 1 670 670 ARG N N 670 118.124 118.124 119.057 -0.933 18804 896 1 4 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.254 -0.129 18804 897 1 4 . 1 1 670 670 ARG C C 670 176.240 176.240 178.485 -2.245 18804 898 1 4 . 1 1 670 670 ARG CA C 670 56.738 56.738 58.312 -1.573 18804 899 1 4 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.192 -0.726 18804 900 1 4 . 1 1 670 670 ARG H H 670 7.864 7.864 7.874 -0.010 18804 901 1 4 . 1 1 671 671 ARG N N 671 117.904 117.904 119.096 -1.192 18804 902 1 4 . 1 1 671 671 ARG HA H 671 4.086 4.086 3.872 0.214 18804 903 1 4 . 1 1 671 671 ARG C C 671 175.233 175.233 176.628 -1.395 18804 904 1 4 . 1 1 671 671 ARG CA C 671 55.731 55.731 58.715 -2.984 18804 905 1 4 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.043 -0.548 18804 906 1 4 . 1 1 671 671 ARG H H 671 7.677 7.677 7.548 0.129 18804 907 1 4 . 1 1 672 672 HIS N N 672 117.048 117.048 114.058 2.990 18804 908 1 4 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.440 0.163 18804 909 1 4 . 1 1 672 672 HIS C C 672 173.634 173.634 175.635 -2.001 18804 910 1 4 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.920 -2.079 18804 911 1 4 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.578 -1.392 18804 912 1 4 . 1 1 672 672 HIS H H 672 7.920 7.920 7.770 0.150 18804 913 1 4 . 1 1 673 673 ILE N N 673 120.795 120.795 121.322 -0.527 18804 914 1 4 . 1 1 673 673 ILE HA H 673 4.074 4.074 3.933 0.141 18804 915 1 4 . 1 1 673 673 ILE C C 673 174.922 174.922 176.037 -1.115 18804 916 1 4 . 1 1 673 673 ILE CA C 673 60.777 60.777 62.071 -1.294 18804 917 1 4 . 1 1 673 673 ILE CB C 673 37.836 37.836 36.914 0.922 18804 918 1 4 . 1 1 673 673 ILE H H 673 7.900 7.900 7.689 0.211 18804 919 1 4 . 1 1 674 674 VAL N N 674 122.867 122.867 123.798 -0.931 18804 920 1 4 . 1 1 674 674 VAL HA H 674 4.081 4.081 3.765 0.316 18804 921 1 4 . 1 1 674 674 VAL C C 674 174.876 174.876 175.183 -0.307 18804 922 1 4 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.760 -1.390 18804 923 1 4 . 1 1 674 674 VAL CB C 674 31.994 31.994 29.910 2.084 18804 924 1 4 . 1 1 674 674 VAL H H 674 8.003 8.003 8.376 -0.373 18804 925 1 4 . 1 1 675 675 ARG N N 675 124.866 124.866 121.548 3.318 18804 926 1 4 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.215 -0.158 18804 927 1 4 . 1 1 675 675 ARG C C 675 174.922 174.922 175.987 -1.065 18804 928 1 4 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.435 -1.251 18804 929 1 4 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.954 -0.638 18804 930 1 4 . 1 1 675 675 ARG H H 675 8.266 8.266 8.354 -0.088 18804 931 1 4 . 1 1 676 676 LYS N N 676 123.517 123.517 120.806 2.711 18804 932 1 4 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.252 0.013 18804 933 1 4 . 1 1 676 676 LYS C C 676 174.625 174.625 176.734 -2.109 18804 934 1 4 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.731 -0.978 18804 935 1 4 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.559 -2.277 18804 936 1 4 . 1 1 676 676 LYS H H 676 8.260 8.260 8.089 0.171 18804 937 1 5 . 1 1 635 635 GLY N N 635 108.817 108.817 110.969 -2.152 18804 938 1 5 . 1 1 635 635 GLY C C 635 172.499 172.499 173.715 -1.216 18804 939 1 5 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.115 -0.846 18804 940 1 5 . 1 1 635 635 GLY H H 635 8.390 8.390 8.558 -0.168 18804 941 1 5 . 1 1 636 636 CYS N N 636 120.634 120.634 122.800 -2.166 18804 942 1 5 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.526 0.496 18804 943 1 5 . 1 1 636 636 CYS C C 636 172.181 172.181 173.033 -0.852 18804 944 1 5 . 1 1 636 636 CYS CA C 636 52.594 52.594 57.222 -4.628 18804 945 1 5 . 1 1 636 636 CYS CB C 636 39.488 39.488 29.023 10.465 18804 946 1 5 . 1 1 636 636 CYS H H 636 8.327 8.327 8.198 0.129 18804 947 1 5 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.440 0.060 18804 948 1 5 . 1 1 637 637 PRO C C 637 176.215 176.215 176.520 -0.305 18804 949 1 5 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.335 -0.657 18804 950 1 5 . 1 1 637 637 PRO CB C 637 31.342 31.342 30.316 1.026 18804 951 1 5 . 1 1 638 638 THR N N 638 113.690 113.690 112.057 1.633 18804 952 1 5 . 1 1 638 638 THR HA H 638 4.305 4.305 3.849 0.456 18804 953 1 5 . 1 1 638 638 THR C C 638 173.495 173.495 173.484 0.011 18804 954 1 5 . 1 1 638 638 THR CA C 638 60.998 60.998 63.355 -2.357 18804 955 1 5 . 1 1 638 638 THR CB C 638 68.954 68.954 67.638 1.316 18804 956 1 5 . 1 1 638 638 THR H H 638 8.114 8.114 8.252 -0.138 18804 957 1 5 . 1 1 639 639 ASN N N 639 120.695 120.695 119.099 1.596 18804 958 1 5 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.753 0.020 18804 959 1 5 . 1 1 639 639 ASN C C 639 174.216 174.216 174.575 -0.359 18804 960 1 5 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.245 -0.888 18804 961 1 5 . 1 1 639 639 ASN CB C 639 38.581 38.581 40.181 -1.600 18804 962 1 5 . 1 1 639 639 ASN H H 639 8.301 8.301 7.704 0.597 18804 963 1 5 . 1 1 640 640 GLY N N 640 108.827 108.827 108.829 -0.002 18804 964 1 5 . 1 1 640 640 GLY C C 640 170.506 170.506 172.776 -2.270 18804 965 1 5 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.193 -0.338 18804 966 1 5 . 1 1 640 640 GLY H H 640 8.111 8.111 8.265 -0.154 18804 967 1 5 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.564 -0.112 18804 968 1 5 . 1 1 641 641 PRO C C 641 175.669 175.669 175.950 -0.281 18804 969 1 5 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.689 -0.614 18804 970 1 5 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.616 -1.128 18804 971 1 5 . 1 1 642 642 LYS N N 642 121.521 121.521 122.454 -0.933 18804 972 1 5 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.533 -0.207 18804 973 1 5 . 1 1 642 642 LYS C C 642 175.106 175.106 175.207 -0.101 18804 974 1 5 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.095 -0.992 18804 975 1 5 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.718 -2.349 18804 976 1 5 . 1 1 642 642 LYS H H 642 8.417 8.417 8.165 0.252 18804 977 1 5 . 1 1 643 643 ILE N N 643 121.410 121.410 125.453 -4.043 18804 978 1 5 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.476 -0.141 18804 979 1 5 . 1 1 643 643 ILE C C 643 173.587 173.587 174.595 -1.008 18804 980 1 5 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.700 -1.827 18804 981 1 5 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.748 -0.130 18804 982 1 5 . 1 1 643 643 ILE H H 643 8.069 8.069 8.515 -0.446 18804 983 1 5 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.565 -0.112 18804 984 1 5 . 1 1 644 644 PRO C C 644 175.623 175.623 177.520 -1.897 18804 985 1 5 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.326 0.133 18804 986 1 5 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.407 -0.900 18804 987 1 5 . 1 1 645 645 SER N N 645 115.445 115.445 114.034 1.411 18804 988 1 5 . 1 1 645 645 SER HA H 645 4.374 4.374 4.239 0.135 18804 989 1 5 . 1 1 645 645 SER C C 645 174.611 174.611 176.233 -1.622 18804 990 1 5 . 1 1 645 645 SER CA C 645 58.566 58.566 60.394 -1.828 18804 991 1 5 . 1 1 645 645 SER CB C 645 62.842 62.842 62.827 0.015 18804 992 1 5 . 1 1 645 645 SER H H 645 8.267 8.267 8.483 -0.216 18804 993 1 5 . 1 1 646 646 ILE N N 646 120.612 120.612 122.292 -1.680 18804 994 1 5 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.834 0.275 18804 995 1 5 . 1 1 646 646 ILE C C 646 174.703 174.703 176.913 -2.210 18804 996 1 5 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.756 -1.534 18804 997 1 5 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.137 0.523 18804 998 1 5 . 1 1 646 646 ILE H H 646 8.252 8.252 7.949 0.303 18804 999 1 5 . 1 1 647 647 ALA N N 647 123.224 123.224 123.219 0.005 18804 1000 1 5 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.871 0.292 18804 1001 1 5 . 1 1 647 647 ALA C C 647 176.526 176.526 179.081 -2.555 18804 1002 1 5 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.156 -1.972 18804 1003 1 5 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.052 0.198 18804 1004 1 5 . 1 1 647 647 ALA H H 647 8.084 8.084 7.671 0.413 18804 1005 1 5 . 1 1 648 648 THR N N 648 111.699 111.699 114.842 -3.143 18804 1006 1 5 . 1 1 648 648 THR HA H 648 4.021 4.021 3.831 0.190 18804 1007 1 5 . 1 1 648 648 THR C C 648 175.018 175.018 176.957 -1.939 18804 1008 1 5 . 1 1 648 648 THR CA C 648 63.554 63.554 67.120 -3.566 18804 1009 1 5 . 1 1 648 648 THR CB C 648 68.098 68.098 68.484 -0.386 18804 1010 1 5 . 1 1 648 648 THR H H 648 7.757 7.757 7.734 0.023 18804 1011 1 5 . 1 1 649 649 GLY N N 649 108.587 108.587 109.422 -0.835 18804 1012 1 5 . 1 1 649 649 GLY C C 649 173.686 173.686 176.172 -2.486 18804 1013 1 5 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.808 -0.864 18804 1014 1 5 . 1 1 649 649 GLY H H 649 8.423 8.423 7.838 0.585 18804 1015 1 5 . 1 1 650 650 MET N N 650 119.486 119.486 121.408 -1.922 18804 1016 1 5 . 1 1 650 650 MET HA H 650 4.135 4.135 4.276 -0.141 18804 1017 1 5 . 1 1 650 650 MET C C 650 176.632 176.632 178.676 -2.044 18804 1018 1 5 . 1 1 650 650 MET CA C 650 57.749 57.749 56.785 0.964 18804 1019 1 5 . 1 1 650 650 MET CB C 650 32.067 32.067 31.523 0.544 18804 1020 1 5 . 1 1 650 650 MET H H 650 8.332 8.332 7.593 0.739 18804 1021 1 5 . 1 1 651 651 VAL N N 651 118.009 118.009 118.993 -0.984 18804 1022 1 5 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.712 -0.172 18804 1023 1 5 . 1 1 651 651 VAL C C 651 176.672 176.672 178.357 -1.685 18804 1024 1 5 . 1 1 651 651 VAL CA C 651 66.279 66.279 66.044 0.235 18804 1025 1 5 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.442 -0.144 18804 1026 1 5 . 1 1 651 651 VAL H H 651 8.038 8.038 8.745 -0.707 18804 1027 1 5 . 1 1 652 652 GLY N N 652 105.785 105.785 107.205 -1.420 18804 1028 1 5 . 1 1 652 652 GLY C C 652 173.359 173.359 175.402 -2.043 18804 1029 1 5 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.250 -0.262 18804 1030 1 5 . 1 1 652 652 GLY H H 652 8.157 8.157 8.013 0.144 18804 1031 1 5 . 1 1 653 653 ALA N N 653 121.803 121.803 125.008 -3.205 18804 1032 1 5 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.192 -0.265 18804 1033 1 5 . 1 1 653 653 ALA C C 653 177.608 177.608 179.604 -1.996 18804 1034 1 5 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.692 -0.045 18804 1035 1 5 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.336 -0.779 18804 1036 1 5 . 1 1 653 653 ALA H H 653 8.050 8.050 7.786 0.264 18804 1037 1 5 . 1 1 654 654 LEU N N 654 116.652 116.652 119.628 -2.976 18804 1038 1 5 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.867 0.085 18804 1039 1 5 . 1 1 654 654 LEU C C 654 177.361 177.361 179.166 -1.805 18804 1040 1 5 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.150 -0.888 18804 1041 1 5 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.735 -0.832 18804 1042 1 5 . 1 1 654 654 LEU H H 654 7.919 7.919 8.339 -0.420 18804 1043 1 5 . 1 1 655 655 LEU N N 655 117.910 117.910 118.628 -0.718 18804 1044 1 5 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.932 0.005 18804 1045 1 5 . 1 1 655 655 LEU C C 655 177.353 177.353 179.178 -1.825 18804 1046 1 5 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.848 -0.333 18804 1047 1 5 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.619 -0.809 18804 1048 1 5 . 1 1 655 655 LEU H H 655 8.189 8.189 7.976 0.213 18804 1049 1 5 . 1 1 656 656 LEU N N 656 118.140 118.140 119.322 -1.182 18804 1050 1 5 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.890 0.019 18804 1051 1 5 . 1 1 656 656 LEU C C 656 177.304 177.304 179.195 -1.891 18804 1052 1 5 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.900 -0.403 18804 1053 1 5 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.621 -0.860 18804 1054 1 5 . 1 1 656 656 LEU H H 656 8.022 8.022 7.732 0.290 18804 1055 1 5 . 1 1 657 657 LEU N N 657 118.079 118.079 119.694 -1.615 18804 1056 1 5 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.854 -0.016 18804 1057 1 5 . 1 1 657 657 LEU C C 657 177.304 177.304 179.045 -1.741 18804 1058 1 5 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.169 -0.593 18804 1059 1 5 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.582 -0.786 18804 1060 1 5 . 1 1 657 657 LEU H H 657 8.073 8.073 8.362 -0.289 18804 1061 1 5 . 1 1 658 658 LEU N N 658 118.238 118.238 118.881 -0.643 18804 1062 1 5 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.899 0.024 18804 1063 1 5 . 1 1 658 658 LEU C C 658 177.353 177.353 179.131 -1.778 18804 1064 1 5 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.155 -0.646 18804 1065 1 5 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.759 -0.870 18804 1066 1 5 . 1 1 658 658 LEU H H 658 8.148 8.148 7.683 0.465 18804 1067 1 5 . 1 1 659 659 VAL N N 659 117.951 117.951 118.887 -0.936 18804 1068 1 5 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.602 -0.098 18804 1069 1 5 . 1 1 659 659 VAL C C 659 176.888 176.888 178.029 -1.141 18804 1070 1 5 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.747 -0.255 18804 1071 1 5 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.535 -1.163 18804 1072 1 5 . 1 1 659 659 VAL H H 659 8.150 8.150 7.710 0.440 18804 1073 1 5 . 1 1 660 660 VAL N N 660 119.240 119.240 120.546 -1.306 18804 1074 1 5 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.593 -0.104 18804 1075 1 5 . 1 1 660 660 VAL C C 660 176.494 176.494 177.557 -1.063 18804 1076 1 5 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.685 -0.335 18804 1077 1 5 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.967 -0.577 18804 1078 1 5 . 1 1 660 660 VAL H H 660 8.220 8.220 8.086 0.134 18804 1079 1 5 . 1 1 661 661 ALA N N 661 121.414 121.414 122.376 -0.962 18804 1080 1 5 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.053 -0.161 18804 1081 1 5 . 1 1 661 661 ALA C C 661 178.419 178.419 179.783 -1.364 18804 1082 1 5 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.307 -0.212 18804 1083 1 5 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.203 -0.904 18804 1084 1 5 . 1 1 661 661 ALA H H 661 8.562 8.562 7.902 0.660 18804 1085 1 5 . 1 1 662 662 LEU N N 662 117.019 117.019 118.939 -1.920 18804 1086 1 5 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.892 0.085 18804 1087 1 5 . 1 1 662 662 LEU C C 662 178.078 178.078 179.197 -1.119 18804 1088 1 5 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.618 -0.302 18804 1089 1 5 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.703 -0.663 18804 1090 1 5 . 1 1 662 662 LEU H H 662 8.460 8.460 7.920 0.540 18804 1091 1 5 . 1 1 663 663 GLY N N 663 106.924 106.924 107.290 -0.366 18804 1092 1 5 . 1 1 663 663 GLY C C 663 174.372 174.372 176.150 -1.778 18804 1093 1 5 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.311 -0.212 18804 1094 1 5 . 1 1 663 663 GLY H H 663 8.683 8.683 8.159 0.524 18804 1095 1 5 . 1 1 664 664 ILE N N 664 121.523 121.523 122.562 -1.039 18804 1096 1 5 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.697 0.002 18804 1097 1 5 . 1 1 664 664 ILE C C 664 177.614 177.614 178.050 -0.436 18804 1098 1 5 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.913 0.122 18804 1099 1 5 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.691 -0.859 18804 1100 1 5 . 1 1 664 664 ILE H H 664 8.750 8.750 7.888 0.862 18804 1101 1 5 . 1 1 665 665 GLY N N 665 107.803 107.803 108.698 -0.895 18804 1102 1 5 . 1 1 665 665 GLY C C 665 174.402 174.402 176.265 -1.863 18804 1103 1 5 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.362 -0.153 18804 1104 1 5 . 1 1 665 665 GLY H H 665 8.689 8.689 8.156 0.533 18804 1105 1 5 . 1 1 666 666 LEU N N 666 121.365 121.365 122.033 -0.668 18804 1106 1 5 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.025 0.010 18804 1107 1 5 . 1 1 666 666 LEU C C 666 178.291 178.291 178.939 -0.648 18804 1108 1 5 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.178 0.153 18804 1109 1 5 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.769 -0.549 18804 1110 1 5 . 1 1 666 666 LEU H H 666 8.744 8.744 7.896 0.848 18804 1111 1 5 . 1 1 667 667 PHE N N 667 119.838 119.838 120.645 -0.807 18804 1112 1 5 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.128 -0.037 18804 1113 1 5 . 1 1 667 667 PHE C C 667 176.965 176.965 177.957 -0.992 18804 1114 1 5 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.496 -0.465 18804 1115 1 5 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.487 -0.726 18804 1116 1 5 . 1 1 667 667 PHE H H 667 8.454 8.454 8.063 0.391 18804 1117 1 5 . 1 1 668 668 MET N N 668 116.868 116.868 118.167 -1.299 18804 1118 1 5 . 1 1 668 668 MET HA H 668 4.035 4.035 3.937 0.098 18804 1119 1 5 . 1 1 668 668 MET C C 668 177.678 177.678 177.622 0.056 18804 1120 1 5 . 1 1 668 668 MET CA C 668 57.405 57.405 58.905 -1.500 18804 1121 1 5 . 1 1 668 668 MET CB C 668 31.739 31.739 32.371 -0.632 18804 1122 1 5 . 1 1 668 668 MET H H 668 8.701 8.701 8.724 -0.023 18804 1123 1 5 . 1 1 669 669 ARG N N 669 118.600 118.600 115.655 2.945 18804 1124 1 5 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.095 0.040 18804 1125 1 5 . 1 1 669 669 ARG C C 669 177.120 177.120 176.671 0.449 18804 1126 1 5 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.135 0.117 18804 1127 1 5 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.478 -0.974 18804 1128 1 5 . 1 1 669 669 ARG H H 669 8.044 8.044 7.518 0.526 18804 1129 1 5 . 1 1 670 670 ARG N N 670 118.124 118.124 116.995 1.129 18804 1130 1 5 . 1 1 670 670 ARG HA H 670 4.125 4.125 3.866 0.259 18804 1131 1 5 . 1 1 670 670 ARG C C 670 176.240 176.240 176.036 0.204 18804 1132 1 5 . 1 1 670 670 ARG CA C 670 56.738 56.738 56.767 -0.029 18804 1133 1 5 . 1 1 670 670 ARG CB C 670 29.467 29.467 28.000 1.467 18804 1134 1 5 . 1 1 670 670 ARG H H 670 7.864 7.864 7.639 0.225 18804 1135 1 5 . 1 1 671 671 ARG N N 671 117.904 117.904 118.883 -0.979 18804 1136 1 5 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.138 -0.052 18804 1137 1 5 . 1 1 671 671 ARG C C 671 175.233 175.233 176.065 -0.832 18804 1138 1 5 . 1 1 671 671 ARG CA C 671 55.731 55.731 58.087 -2.356 18804 1139 1 5 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.802 -1.308 18804 1140 1 5 . 1 1 671 671 ARG H H 671 7.677 7.677 8.225 -0.548 18804 1141 1 5 . 1 1 672 672 HIS N N 672 117.048 117.048 117.980 -0.932 18804 1142 1 5 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.648 -0.045 18804 1143 1 5 . 1 1 672 672 HIS C C 672 173.634 173.634 173.883 -0.249 18804 1144 1 5 . 1 1 672 672 HIS CA C 672 54.841 54.841 54.829 0.012 18804 1145 1 5 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.895 -1.709 18804 1146 1 5 . 1 1 672 672 HIS H H 672 7.920 7.920 8.125 -0.205 18804 1147 1 5 . 1 1 673 673 ILE N N 673 120.795 120.795 127.908 -7.113 18804 1148 1 5 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.125 -0.051 18804 1149 1 5 . 1 1 673 673 ILE C C 673 174.922 174.922 175.288 -0.366 18804 1150 1 5 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.695 0.082 18804 1151 1 5 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.227 -0.392 18804 1152 1 5 . 1 1 673 673 ILE H H 673 7.900 7.900 8.474 -0.574 18804 1153 1 5 . 1 1 674 674 VAL N N 674 122.867 122.867 127.693 -4.826 18804 1154 1 5 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.089 -0.008 18804 1155 1 5 . 1 1 674 674 VAL C C 674 174.876 174.876 175.369 -0.493 18804 1156 1 5 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.592 -0.222 18804 1157 1 5 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.451 -0.457 18804 1158 1 5 . 1 1 674 674 VAL H H 674 8.003 8.003 8.253 -0.250 18804 1159 1 5 . 1 1 675 675 ARG N N 675 124.866 124.866 128.125 -3.259 18804 1160 1 5 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.382 -0.325 18804 1161 1 5 . 1 1 675 675 ARG C C 675 174.922 174.922 175.366 -0.444 18804 1162 1 5 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.191 -1.007 18804 1163 1 5 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.655 -0.339 18804 1164 1 5 . 1 1 675 675 ARG H H 675 8.266 8.266 8.501 -0.235 18804 1165 1 5 . 1 1 676 676 LYS N N 676 123.517 123.517 122.780 0.737 18804 1166 1 5 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.773 -0.508 18804 1167 1 5 . 1 1 676 676 LYS C C 676 174.625 174.625 175.230 -0.605 18804 1168 1 5 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.470 0.283 18804 1169 1 5 . 1 1 676 676 LYS CB C 676 30.281 30.281 34.408 -4.127 18804 1170 1 5 . 1 1 676 676 LYS H H 676 8.260 8.260 8.438 -0.178 18804 1171 1 6 . 1 1 635 635 GLY N N 635 108.817 108.817 109.041 -0.224 18804 1172 1 6 . 1 1 635 635 GLY C C 635 172.499 172.499 173.901 -1.402 18804 1173 1 6 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.241 -0.972 18804 1174 1 6 . 1 1 635 635 GLY H H 635 8.390 8.390 8.712 -0.322 18804 1175 1 6 . 1 1 636 636 CYS N N 636 120.634 120.634 120.091 0.543 18804 1176 1 6 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.868 0.154 18804 1177 1 6 . 1 1 636 636 CYS C C 636 172.181 172.181 173.289 -1.108 18804 1178 1 6 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.362 -3.768 18804 1179 1 6 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.395 11.093 18804 1180 1 6 . 1 1 636 636 CYS H H 636 8.327 8.327 7.720 0.607 18804 1181 1 6 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.669 -0.169 18804 1182 1 6 . 1 1 637 637 PRO C C 637 176.215 176.215 176.348 -0.133 18804 1183 1 6 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.729 -1.051 18804 1184 1 6 . 1 1 637 637 PRO CB C 637 31.342 31.342 32.041 -0.699 18804 1185 1 6 . 1 1 638 638 THR N N 638 113.690 113.690 106.303 7.387 18804 1186 1 6 . 1 1 638 638 THR HA H 638 4.305 4.305 3.926 0.379 18804 1187 1 6 . 1 1 638 638 THR C C 638 173.495 173.495 172.933 0.562 18804 1188 1 6 . 1 1 638 638 THR CA C 638 60.998 60.998 62.897 -1.899 18804 1189 1 6 . 1 1 638 638 THR CB C 638 68.954 68.954 67.732 1.222 18804 1190 1 6 . 1 1 638 638 THR H H 638 8.114 8.114 7.739 0.375 18804 1191 1 6 . 1 1 639 639 ASN N N 639 120.695 120.695 118.813 1.882 18804 1192 1 6 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.834 -0.061 18804 1193 1 6 . 1 1 639 639 ASN C C 639 174.216 174.216 175.178 -0.962 18804 1194 1 6 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.500 -1.143 18804 1195 1 6 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.188 -0.607 18804 1196 1 6 . 1 1 639 639 ASN H H 639 8.301 8.301 7.942 0.359 18804 1197 1 6 . 1 1 640 640 GLY N N 640 108.827 108.827 109.376 -0.549 18804 1198 1 6 . 1 1 640 640 GLY C C 640 170.506 170.506 172.016 -1.510 18804 1199 1 6 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.011 -0.156 18804 1200 1 6 . 1 1 640 640 GLY H H 640 8.111 8.111 8.160 -0.049 18804 1201 1 6 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.676 -0.224 18804 1202 1 6 . 1 1 641 641 PRO C C 641 175.669 175.669 175.668 0.001 18804 1203 1 6 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.549 -0.474 18804 1204 1 6 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.756 -1.268 18804 1205 1 6 . 1 1 642 642 LYS N N 642 121.521 121.521 120.516 1.005 18804 1206 1 6 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.720 -0.394 18804 1207 1 6 . 1 1 642 642 LYS C C 642 175.106 175.106 174.894 0.212 18804 1208 1 6 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.956 -0.853 18804 1209 1 6 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.525 -2.155 18804 1210 1 6 . 1 1 642 642 LYS H H 642 8.417 8.417 8.498 -0.081 18804 1211 1 6 . 1 1 643 643 ILE N N 643 121.410 121.410 124.661 -3.251 18804 1212 1 6 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.366 -0.031 18804 1213 1 6 . 1 1 643 643 ILE C C 643 173.587 173.587 174.298 -0.711 18804 1214 1 6 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.670 -1.796 18804 1215 1 6 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.908 -0.290 18804 1216 1 6 . 1 1 643 643 ILE H H 643 8.069 8.069 8.453 -0.384 18804 1217 1 6 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.581 -0.128 18804 1218 1 6 . 1 1 644 644 PRO C C 644 175.623 175.623 177.468 -1.845 18804 1219 1 6 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.302 0.157 18804 1220 1 6 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.443 -0.935 18804 1221 1 6 . 1 1 645 645 SER N N 645 115.445 115.445 113.940 1.505 18804 1222 1 6 . 1 1 645 645 SER HA H 645 4.374 4.374 4.224 0.150 18804 1223 1 6 . 1 1 645 645 SER C C 645 174.611 174.611 175.917 -1.306 18804 1224 1 6 . 1 1 645 645 SER CA C 645 58.566 58.566 59.835 -1.269 18804 1225 1 6 . 1 1 645 645 SER CB C 645 62.842 62.842 63.011 -0.169 18804 1226 1 6 . 1 1 645 645 SER H H 645 8.267 8.267 8.402 -0.135 18804 1227 1 6 . 1 1 646 646 ILE N N 646 120.612 120.612 121.882 -1.270 18804 1228 1 6 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.816 0.293 18804 1229 1 6 . 1 1 646 646 ILE C C 646 174.703 174.703 176.433 -1.730 18804 1230 1 6 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.904 -0.682 18804 1231 1 6 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.589 0.071 18804 1232 1 6 . 1 1 646 646 ILE H H 646 8.252 8.252 7.902 0.350 18804 1233 1 6 . 1 1 647 647 ALA N N 647 123.224 123.224 122.443 0.781 18804 1234 1 6 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.896 0.267 18804 1235 1 6 . 1 1 647 647 ALA C C 647 176.526 176.526 178.989 -2.463 18804 1236 1 6 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.307 -2.123 18804 1237 1 6 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.959 0.290 18804 1238 1 6 . 1 1 647 647 ALA H H 647 8.084 8.084 7.673 0.411 18804 1239 1 6 . 1 1 648 648 THR N N 648 111.699 111.699 114.178 -2.479 18804 1240 1 6 . 1 1 648 648 THR HA H 648 4.021 4.021 3.845 0.176 18804 1241 1 6 . 1 1 648 648 THR C C 648 175.018 175.018 176.947 -1.929 18804 1242 1 6 . 1 1 648 648 THR CA C 648 63.554 63.554 67.285 -3.731 18804 1243 1 6 . 1 1 648 648 THR CB C 648 68.098 68.098 68.378 -0.280 18804 1244 1 6 . 1 1 648 648 THR H H 648 7.757 7.757 7.758 -0.001 18804 1245 1 6 . 1 1 649 649 GLY N N 649 108.587 108.587 109.604 -1.017 18804 1246 1 6 . 1 1 649 649 GLY C C 649 173.686 173.686 176.289 -2.603 18804 1247 1 6 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.720 -0.776 18804 1248 1 6 . 1 1 649 649 GLY H H 649 8.423 8.423 7.880 0.543 18804 1249 1 6 . 1 1 650 650 MET N N 650 119.486 119.486 121.887 -2.401 18804 1250 1 6 . 1 1 650 650 MET HA H 650 4.135 4.135 4.117 0.018 18804 1251 1 6 . 1 1 650 650 MET C C 650 176.632 176.632 178.531 -1.899 18804 1252 1 6 . 1 1 650 650 MET CA C 650 57.749 57.749 58.752 -1.003 18804 1253 1 6 . 1 1 650 650 MET CB C 650 32.067 32.067 32.135 -0.067 18804 1254 1 6 . 1 1 650 650 MET H H 650 8.332 8.332 7.564 0.768 18804 1255 1 6 . 1 1 651 651 VAL N N 651 118.009 118.009 118.853 -0.844 18804 1256 1 6 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.598 -0.058 18804 1257 1 6 . 1 1 651 651 VAL C C 651 176.672 176.672 178.158 -1.486 18804 1258 1 6 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.189 -0.910 18804 1259 1 6 . 1 1 651 651 VAL CB C 651 30.298 30.298 31.235 -0.937 18804 1260 1 6 . 1 1 651 651 VAL H H 651 8.038 8.038 8.839 -0.801 18804 1261 1 6 . 1 1 652 652 GLY N N 652 105.785 105.785 106.271 -0.486 18804 1262 1 6 . 1 1 652 652 GLY C C 652 173.359 173.359 175.308 -1.949 18804 1263 1 6 . 1 1 652 652 GLY CA C 652 46.988 46.988 46.980 0.008 18804 1264 1 6 . 1 1 652 652 GLY H H 652 8.157 8.157 7.988 0.169 18804 1265 1 6 . 1 1 653 653 ALA N N 653 121.803 121.803 125.188 -3.385 18804 1266 1 6 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.208 -0.281 18804 1267 1 6 . 1 1 653 653 ALA C C 653 177.608 177.608 179.694 -2.086 18804 1268 1 6 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.660 -0.013 18804 1269 1 6 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.337 -0.780 18804 1270 1 6 . 1 1 653 653 ALA H H 653 8.050 8.050 7.916 0.134 18804 1271 1 6 . 1 1 654 654 LEU N N 654 116.652 116.652 119.480 -2.828 18804 1272 1 6 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.889 0.063 18804 1273 1 6 . 1 1 654 654 LEU C C 654 177.361 177.361 179.122 -1.761 18804 1274 1 6 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.149 -0.887 18804 1275 1 6 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.779 -0.876 18804 1276 1 6 . 1 1 654 654 LEU H H 654 7.919 7.919 8.427 -0.508 18804 1277 1 6 . 1 1 655 655 LEU N N 655 117.910 117.910 118.733 -0.823 18804 1278 1 6 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.947 -0.010 18804 1279 1 6 . 1 1 655 655 LEU C C 655 177.353 177.353 179.125 -1.772 18804 1280 1 6 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.913 -0.398 18804 1281 1 6 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.581 -0.771 18804 1282 1 6 . 1 1 655 655 LEU H H 655 8.189 8.189 7.673 0.516 18804 1283 1 6 . 1 1 656 656 LEU N N 656 118.140 118.140 119.141 -1.001 18804 1284 1 6 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.900 0.009 18804 1285 1 6 . 1 1 656 656 LEU C C 656 177.304 177.304 179.227 -1.923 18804 1286 1 6 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.825 -0.328 18804 1287 1 6 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.577 -0.816 18804 1288 1 6 . 1 1 656 656 LEU H H 656 8.022 8.022 7.810 0.212 18804 1289 1 6 . 1 1 657 657 LEU N N 657 118.079 118.079 119.655 -1.576 18804 1290 1 6 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.862 -0.024 18804 1291 1 6 . 1 1 657 657 LEU C C 657 177.304 177.304 178.952 -1.648 18804 1292 1 6 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.184 -0.608 18804 1293 1 6 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.615 -0.819 18804 1294 1 6 . 1 1 657 657 LEU H H 657 8.073 8.073 8.218 -0.145 18804 1295 1 6 . 1 1 658 658 LEU N N 658 118.238 118.238 119.022 -0.784 18804 1296 1 6 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.879 0.044 18804 1297 1 6 . 1 1 658 658 LEU C C 658 177.353 177.353 179.082 -1.729 18804 1298 1 6 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.188 -0.679 18804 1299 1 6 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.727 -0.838 18804 1300 1 6 . 1 1 658 658 LEU H H 658 8.148 8.148 7.669 0.479 18804 1301 1 6 . 1 1 659 659 VAL N N 659 117.951 117.951 118.524 -0.573 18804 1302 1 6 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.573 -0.069 18804 1303 1 6 . 1 1 659 659 VAL C C 659 176.888 176.888 177.954 -1.066 18804 1304 1 6 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.933 -0.441 18804 1305 1 6 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.532 -1.160 18804 1306 1 6 . 1 1 659 659 VAL H H 659 8.150 8.150 7.713 0.437 18804 1307 1 6 . 1 1 660 660 VAL N N 660 119.240 119.240 120.139 -0.899 18804 1308 1 6 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.514 -0.025 18804 1309 1 6 . 1 1 660 660 VAL C C 660 176.494 176.494 177.498 -1.004 18804 1310 1 6 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.847 -0.497 18804 1311 1 6 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.347 -0.957 18804 1312 1 6 . 1 1 660 660 VAL H H 660 8.220 8.220 7.878 0.342 18804 1313 1 6 . 1 1 661 661 ALA N N 661 121.414 121.414 122.650 -1.236 18804 1314 1 6 . 1 1 661 661 ALA HA H 661 3.892 3.892 3.971 -0.080 18804 1315 1 6 . 1 1 661 661 ALA C C 661 178.419 178.419 179.574 -1.155 18804 1316 1 6 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.412 -0.317 18804 1317 1 6 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.135 -0.836 18804 1318 1 6 . 1 1 661 661 ALA H H 661 8.562 8.562 7.960 0.602 18804 1319 1 6 . 1 1 662 662 LEU N N 662 117.019 117.019 118.847 -1.828 18804 1320 1 6 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.841 0.136 18804 1321 1 6 . 1 1 662 662 LEU C C 662 178.078 178.078 179.253 -1.175 18804 1322 1 6 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.764 -0.448 18804 1323 1 6 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.629 -0.590 18804 1324 1 6 . 1 1 662 662 LEU H H 662 8.460 8.460 7.976 0.484 18804 1325 1 6 . 1 1 663 663 GLY N N 663 106.924 106.924 107.118 -0.194 18804 1326 1 6 . 1 1 663 663 GLY C C 663 174.372 174.372 176.165 -1.793 18804 1327 1 6 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.215 -0.117 18804 1328 1 6 . 1 1 663 663 GLY H H 663 8.683 8.683 7.850 0.833 18804 1329 1 6 . 1 1 664 664 ILE N N 664 121.523 121.523 122.732 -1.209 18804 1330 1 6 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.660 0.039 18804 1331 1 6 . 1 1 664 664 ILE C C 664 177.614 177.614 178.101 -0.487 18804 1332 1 6 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.941 0.095 18804 1333 1 6 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.645 -0.813 18804 1334 1 6 . 1 1 664 664 ILE H H 664 8.750 8.750 8.213 0.537 18804 1335 1 6 . 1 1 665 665 GLY N N 665 107.803 107.803 108.550 -0.747 18804 1336 1 6 . 1 1 665 665 GLY C C 665 174.402 174.402 176.204 -1.802 18804 1337 1 6 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.362 -0.153 18804 1338 1 6 . 1 1 665 665 GLY H H 665 8.689 8.689 8.521 0.168 18804 1339 1 6 . 1 1 666 666 LEU N N 666 121.365 121.365 122.034 -0.669 18804 1340 1 6 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.053 -0.018 18804 1341 1 6 . 1 1 666 666 LEU C C 666 178.291 178.291 178.862 -0.571 18804 1342 1 6 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.085 0.246 18804 1343 1 6 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.807 -0.587 18804 1344 1 6 . 1 1 666 666 LEU H H 666 8.744 8.744 7.890 0.854 18804 1345 1 6 . 1 1 667 667 PHE N N 667 119.838 119.838 121.258 -1.420 18804 1346 1 6 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.028 0.063 18804 1347 1 6 . 1 1 667 667 PHE C C 667 176.965 176.965 177.287 -0.322 18804 1348 1 6 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.918 -0.887 18804 1349 1 6 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.390 -0.629 18804 1350 1 6 . 1 1 667 667 PHE H H 667 8.454 8.454 8.306 0.148 18804 1351 1 6 . 1 1 668 668 MET N N 668 116.868 116.868 117.306 -0.438 18804 1352 1 6 . 1 1 668 668 MET HA H 668 4.035 4.035 3.883 0.152 18804 1353 1 6 . 1 1 668 668 MET C C 668 177.678 177.678 178.370 -0.692 18804 1354 1 6 . 1 1 668 668 MET CA C 668 57.405 57.405 59.264 -1.859 18804 1355 1 6 . 1 1 668 668 MET CB C 668 31.739 31.739 32.450 -0.711 18804 1356 1 6 . 1 1 668 668 MET H H 668 8.701 8.701 8.598 0.103 18804 1357 1 6 . 1 1 669 669 ARG N N 669 118.600 118.600 116.315 2.285 18804 1358 1 6 . 1 1 669 669 ARG HA H 669 4.135 4.135 3.865 0.270 18804 1359 1 6 . 1 1 669 669 ARG C C 669 177.120 177.120 178.962 -1.842 18804 1360 1 6 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.378 -1.126 18804 1361 1 6 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.040 -0.536 18804 1362 1 6 . 1 1 669 669 ARG H H 669 8.044 8.044 7.664 0.380 18804 1363 1 6 . 1 1 670 670 ARG N N 670 118.124 118.124 118.744 -0.620 18804 1364 1 6 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.103 0.022 18804 1365 1 6 . 1 1 670 670 ARG C C 670 176.240 176.240 177.361 -1.121 18804 1366 1 6 . 1 1 670 670 ARG CA C 670 56.738 56.738 58.085 -1.347 18804 1367 1 6 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.016 -0.549 18804 1368 1 6 . 1 1 670 670 ARG H H 670 7.864 7.864 7.767 0.097 18804 1369 1 6 . 1 1 671 671 ARG N N 671 117.904 117.904 117.939 -0.035 18804 1370 1 6 . 1 1 671 671 ARG HA H 671 4.086 4.086 3.829 0.257 18804 1371 1 6 . 1 1 671 671 ARG C C 671 175.233 175.233 176.533 -1.300 18804 1372 1 6 . 1 1 671 671 ARG CA C 671 55.731 55.731 57.730 -1.999 18804 1373 1 6 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.191 -0.697 18804 1374 1 6 . 1 1 671 671 ARG H H 671 7.677 7.677 7.195 0.482 18804 1375 1 6 . 1 1 672 672 HIS N N 672 117.048 117.048 118.997 -1.949 18804 1376 1 6 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.333 0.270 18804 1377 1 6 . 1 1 672 672 HIS C C 672 173.634 173.634 175.949 -2.315 18804 1378 1 6 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.036 -1.195 18804 1379 1 6 . 1 1 672 672 HIS CB C 672 28.186 28.186 28.809 -0.623 18804 1380 1 6 . 1 1 672 672 HIS H H 672 7.920 7.920 7.424 0.496 18804 1381 1 6 . 1 1 673 673 ILE N N 673 120.795 120.795 121.015 -0.220 18804 1382 1 6 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.098 -0.024 18804 1383 1 6 . 1 1 673 673 ILE C C 673 174.922 174.922 176.107 -1.185 18804 1384 1 6 . 1 1 673 673 ILE CA C 673 60.777 60.777 61.630 -0.854 18804 1385 1 6 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.526 -0.691 18804 1386 1 6 . 1 1 673 673 ILE H H 673 7.900 7.900 7.627 0.273 18804 1387 1 6 . 1 1 674 674 VAL N N 674 122.867 122.867 120.524 2.343 18804 1388 1 6 . 1 1 674 674 VAL HA H 674 4.081 4.081 3.962 0.119 18804 1389 1 6 . 1 1 674 674 VAL C C 674 174.876 174.876 176.611 -1.735 18804 1390 1 6 . 1 1 674 674 VAL CA C 674 61.370 61.370 63.861 -2.491 18804 1391 1 6 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.439 -0.445 18804 1392 1 6 . 1 1 674 674 VAL H H 674 8.003 8.003 7.594 0.409 18804 1393 1 6 . 1 1 675 675 ARG N N 675 124.866 124.866 124.703 0.163 18804 1394 1 6 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.413 -0.356 18804 1395 1 6 . 1 1 675 675 ARG C C 675 174.922 174.922 177.427 -2.505 18804 1396 1 6 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.558 -1.374 18804 1397 1 6 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.525 -0.209 18804 1398 1 6 . 1 1 675 675 ARG H H 675 8.266 8.266 8.539 -0.273 18804 1399 1 6 . 1 1 676 676 LYS N N 676 123.517 123.517 120.627 2.890 18804 1400 1 6 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.088 0.177 18804 1401 1 6 . 1 1 676 676 LYS C C 676 174.625 174.625 177.077 -2.452 18804 1402 1 6 . 1 1 676 676 LYS CA C 676 55.753 55.753 58.246 -2.493 18804 1403 1 6 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.320 -2.039 18804 1404 1 6 . 1 1 676 676 LYS H H 676 8.260 8.260 8.068 0.192 18804 1405 1 7 . 1 1 635 635 GLY N N 635 108.817 108.817 110.669 -1.852 18804 1406 1 7 . 1 1 635 635 GLY C C 635 172.499 172.499 173.611 -1.112 18804 1407 1 7 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.470 -0.201 18804 1408 1 7 . 1 1 635 635 GLY H H 635 8.390 8.390 8.075 0.315 18804 1409 1 7 . 1 1 636 636 CYS N N 636 120.634 120.634 122.166 -1.532 18804 1410 1 7 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.804 0.218 18804 1411 1 7 . 1 1 636 636 CYS C C 636 172.181 172.181 173.752 -1.571 18804 1412 1 7 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.725 -4.131 18804 1413 1 7 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.520 10.968 18804 1414 1 7 . 1 1 636 636 CYS H H 636 8.327 8.327 8.322 0.005 18804 1415 1 7 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.425 0.075 18804 1416 1 7 . 1 1 637 637 PRO C C 637 176.215 176.215 176.462 -0.247 18804 1417 1 7 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.781 -1.103 18804 1418 1 7 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.672 -0.330 18804 1419 1 7 . 1 1 638 638 THR N N 638 113.690 113.690 108.768 4.922 18804 1420 1 7 . 1 1 638 638 THR HA H 638 4.305 4.305 4.006 0.298 18804 1421 1 7 . 1 1 638 638 THR C C 638 173.495 173.495 173.979 -0.484 18804 1422 1 7 . 1 1 638 638 THR CA C 638 60.998 60.998 62.723 -1.725 18804 1423 1 7 . 1 1 638 638 THR CB C 638 68.954 68.954 67.634 1.320 18804 1424 1 7 . 1 1 638 638 THR H H 638 8.114 8.114 7.947 0.167 18804 1425 1 7 . 1 1 639 639 ASN N N 639 120.695 120.695 118.785 1.910 18804 1426 1 7 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.669 0.104 18804 1427 1 7 . 1 1 639 639 ASN C C 639 174.216 174.216 176.164 -1.948 18804 1428 1 7 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.918 -1.561 18804 1429 1 7 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.049 -0.468 18804 1430 1 7 . 1 1 639 639 ASN H H 639 8.301 8.301 7.984 0.317 18804 1431 1 7 . 1 1 640 640 GLY N N 640 108.827 108.827 107.699 1.128 18804 1432 1 7 . 1 1 640 640 GLY C C 640 170.506 170.506 172.970 -2.464 18804 1433 1 7 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.303 -0.449 18804 1434 1 7 . 1 1 640 640 GLY H H 640 8.111 8.111 8.255 -0.144 18804 1435 1 7 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.915 -0.463 18804 1436 1 7 . 1 1 641 641 PRO C C 641 175.669 175.669 175.795 -0.126 18804 1437 1 7 . 1 1 641 641 PRO CA C 641 62.075 62.075 63.345 -1.270 18804 1438 1 7 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.622 -1.134 18804 1439 1 7 . 1 1 642 642 LYS N N 642 121.521 121.521 119.075 2.446 18804 1440 1 7 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.355 -0.029 18804 1441 1 7 . 1 1 642 642 LYS C C 642 175.106 175.106 175.267 -0.161 18804 1442 1 7 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.806 -0.703 18804 1443 1 7 . 1 1 642 642 LYS CB C 642 32.370 32.370 33.702 -1.332 18804 1444 1 7 . 1 1 642 642 LYS H H 642 8.417 8.417 8.324 0.093 18804 1445 1 7 . 1 1 643 643 ILE N N 643 121.410 121.410 120.576 0.834 18804 1446 1 7 . 1 1 643 643 ILE HA H 643 4.335 4.335 3.889 0.446 18804 1447 1 7 . 1 1 643 643 ILE C C 643 173.587 173.587 174.562 -0.975 18804 1448 1 7 . 1 1 643 643 ILE CA C 643 57.874 57.874 61.099 -3.225 18804 1449 1 7 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.005 0.613 18804 1450 1 7 . 1 1 643 643 ILE H H 643 8.069 8.069 8.547 -0.478 18804 1451 1 7 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.618 -0.165 18804 1452 1 7 . 1 1 644 644 PRO C C 644 175.623 175.623 177.765 -2.142 18804 1453 1 7 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.442 0.017 18804 1454 1 7 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.410 -0.902 18804 1455 1 7 . 1 1 645 645 SER N N 645 115.445 115.445 114.107 1.338 18804 1456 1 7 . 1 1 645 645 SER HA H 645 4.374 4.374 4.305 0.069 18804 1457 1 7 . 1 1 645 645 SER C C 645 174.611 174.611 176.542 -1.931 18804 1458 1 7 . 1 1 645 645 SER CA C 645 58.566 58.566 60.490 -1.924 18804 1459 1 7 . 1 1 645 645 SER CB C 645 62.842 62.842 62.442 0.400 18804 1460 1 7 . 1 1 645 645 SER H H 645 8.267 8.267 8.561 -0.294 18804 1461 1 7 . 1 1 646 646 ILE N N 646 120.612 120.612 122.828 -2.216 18804 1462 1 7 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.821 0.288 18804 1463 1 7 . 1 1 646 646 ILE C C 646 174.703 174.703 176.694 -1.991 18804 1464 1 7 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.575 -1.353 18804 1465 1 7 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.195 0.465 18804 1466 1 7 . 1 1 646 646 ILE H H 646 8.252 8.252 7.899 0.353 18804 1467 1 7 . 1 1 647 647 ALA N N 647 123.224 123.224 122.502 0.722 18804 1468 1 7 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.896 0.267 18804 1469 1 7 . 1 1 647 647 ALA C C 647 176.526 176.526 178.974 -2.448 18804 1470 1 7 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.355 -2.171 18804 1471 1 7 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.901 0.348 18804 1472 1 7 . 1 1 647 647 ALA H H 647 8.084 8.084 7.608 0.476 18804 1473 1 7 . 1 1 648 648 THR N N 648 111.699 111.699 114.671 -2.972 18804 1474 1 7 . 1 1 648 648 THR HA H 648 4.021 4.021 3.831 0.190 18804 1475 1 7 . 1 1 648 648 THR C C 648 175.018 175.018 177.000 -1.982 18804 1476 1 7 . 1 1 648 648 THR CA C 648 63.554 63.554 67.581 -4.027 18804 1477 1 7 . 1 1 648 648 THR CB C 648 68.098 68.098 68.469 -0.370 18804 1478 1 7 . 1 1 648 648 THR H H 648 7.757 7.757 7.728 0.029 18804 1479 1 7 . 1 1 649 649 GLY N N 649 108.587 108.587 109.152 -0.565 18804 1480 1 7 . 1 1 649 649 GLY C C 649 173.686 173.686 176.077 -2.391 18804 1481 1 7 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.768 -0.824 18804 1482 1 7 . 1 1 649 649 GLY H H 649 8.423 8.423 7.971 0.452 18804 1483 1 7 . 1 1 650 650 MET N N 650 119.486 119.486 121.825 -2.339 18804 1484 1 7 . 1 1 650 650 MET HA H 650 4.135 4.135 4.232 -0.097 18804 1485 1 7 . 1 1 650 650 MET C C 650 176.632 176.632 178.664 -2.032 18804 1486 1 7 . 1 1 650 650 MET CA C 650 57.749 57.749 56.956 0.793 18804 1487 1 7 . 1 1 650 650 MET CB C 650 32.067 32.067 31.329 0.738 18804 1488 1 7 . 1 1 650 650 MET H H 650 8.332 8.332 7.535 0.797 18804 1489 1 7 . 1 1 651 651 VAL N N 651 118.009 118.009 118.657 -0.648 18804 1490 1 7 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.661 -0.121 18804 1491 1 7 . 1 1 651 651 VAL C C 651 176.672 176.672 178.372 -1.700 18804 1492 1 7 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.421 -1.142 18804 1493 1 7 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.785 -0.487 18804 1494 1 7 . 1 1 651 651 VAL H H 651 8.038 8.038 8.612 -0.574 18804 1495 1 7 . 1 1 652 652 GLY N N 652 105.785 105.785 106.862 -1.077 18804 1496 1 7 . 1 1 652 652 GLY C C 652 173.359 173.359 175.440 -2.081 18804 1497 1 7 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.094 -0.107 18804 1498 1 7 . 1 1 652 652 GLY H H 652 8.157 8.157 8.039 0.118 18804 1499 1 7 . 1 1 653 653 ALA N N 653 121.803 121.803 125.112 -3.309 18804 1500 1 7 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.212 -0.285 18804 1501 1 7 . 1 1 653 653 ALA C C 653 177.608 177.608 179.691 -2.083 18804 1502 1 7 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.648 -0.001 18804 1503 1 7 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.341 -0.784 18804 1504 1 7 . 1 1 653 653 ALA H H 653 8.050 8.050 8.105 -0.055 18804 1505 1 7 . 1 1 654 654 LEU N N 654 116.652 116.652 119.614 -2.962 18804 1506 1 7 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.900 0.052 18804 1507 1 7 . 1 1 654 654 LEU C C 654 177.361 177.361 179.113 -1.752 18804 1508 1 7 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.130 -0.868 18804 1509 1 7 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.822 -0.919 18804 1510 1 7 . 1 1 654 654 LEU H H 654 7.919 7.919 8.393 -0.474 18804 1511 1 7 . 1 1 655 655 LEU N N 655 117.910 117.910 118.748 -0.838 18804 1512 1 7 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.953 -0.016 18804 1513 1 7 . 1 1 655 655 LEU C C 655 177.353 177.353 179.167 -1.814 18804 1514 1 7 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.907 -0.392 18804 1515 1 7 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.557 -0.747 18804 1516 1 7 . 1 1 655 655 LEU H H 655 8.189 8.189 7.804 0.385 18804 1517 1 7 . 1 1 656 656 LEU N N 656 118.140 118.140 119.184 -1.044 18804 1518 1 7 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.912 -0.003 18804 1519 1 7 . 1 1 656 656 LEU C C 656 177.304 177.304 179.223 -1.919 18804 1520 1 7 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.782 -0.285 18804 1521 1 7 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.607 -0.846 18804 1522 1 7 . 1 1 656 656 LEU H H 656 8.022 8.022 7.812 0.210 18804 1523 1 7 . 1 1 657 657 LEU N N 657 118.079 118.079 119.729 -1.650 18804 1524 1 7 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.864 -0.026 18804 1525 1 7 . 1 1 657 657 LEU C C 657 177.304 177.304 178.967 -1.663 18804 1526 1 7 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.198 -0.622 18804 1527 1 7 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.638 -0.842 18804 1528 1 7 . 1 1 657 657 LEU H H 657 8.073 8.073 8.190 -0.117 18804 1529 1 7 . 1 1 658 658 LEU N N 658 118.238 118.238 118.960 -0.722 18804 1530 1 7 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.887 0.036 18804 1531 1 7 . 1 1 658 658 LEU C C 658 177.353 177.353 179.088 -1.735 18804 1532 1 7 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.171 -0.662 18804 1533 1 7 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.734 -0.845 18804 1534 1 7 . 1 1 658 658 LEU H H 658 8.148 8.148 7.675 0.473 18804 1535 1 7 . 1 1 659 659 VAL N N 659 117.951 117.951 118.610 -0.659 18804 1536 1 7 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.572 -0.068 18804 1537 1 7 . 1 1 659 659 VAL C C 659 176.888 176.888 177.957 -1.069 18804 1538 1 7 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.886 -0.394 18804 1539 1 7 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.547 -1.175 18804 1540 1 7 . 1 1 659 659 VAL H H 659 8.150 8.150 7.701 0.449 18804 1541 1 7 . 1 1 660 660 VAL N N 660 119.240 119.240 120.258 -1.018 18804 1542 1 7 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.514 -0.025 18804 1543 1 7 . 1 1 660 660 VAL C C 660 176.494 176.494 177.502 -1.008 18804 1544 1 7 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.941 -0.591 18804 1545 1 7 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.360 -0.970 18804 1546 1 7 . 1 1 660 660 VAL H H 660 8.220 8.220 7.879 0.341 18804 1547 1 7 . 1 1 661 661 ALA N N 661 121.414 121.414 122.587 -1.173 18804 1548 1 7 . 1 1 661 661 ALA HA H 661 3.892 3.892 3.989 -0.097 18804 1549 1 7 . 1 1 661 661 ALA C C 661 178.419 178.419 179.611 -1.192 18804 1550 1 7 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.398 -0.303 18804 1551 1 7 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.147 -0.848 18804 1552 1 7 . 1 1 661 661 ALA H H 661 8.562 8.562 7.865 0.697 18804 1553 1 7 . 1 1 662 662 LEU N N 662 117.019 117.019 118.728 -1.709 18804 1554 1 7 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.874 0.103 18804 1555 1 7 . 1 1 662 662 LEU C C 662 178.078 178.078 179.272 -1.194 18804 1556 1 7 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.584 -0.268 18804 1557 1 7 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.654 -0.615 18804 1558 1 7 . 1 1 662 662 LEU H H 662 8.460 8.460 7.986 0.474 18804 1559 1 7 . 1 1 663 663 GLY N N 663 106.924 106.924 107.258 -0.334 18804 1560 1 7 . 1 1 663 663 GLY C C 663 174.372 174.372 176.153 -1.781 18804 1561 1 7 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.279 -0.180 18804 1562 1 7 . 1 1 663 663 GLY H H 663 8.683 8.683 8.054 0.629 18804 1563 1 7 . 1 1 664 664 ILE N N 664 121.523 121.523 122.747 -1.224 18804 1564 1 7 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.673 0.026 18804 1565 1 7 . 1 1 664 664 ILE C C 664 177.614 177.614 178.083 -0.469 18804 1566 1 7 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.172 -0.137 18804 1567 1 7 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.684 -0.851 18804 1568 1 7 . 1 1 664 664 ILE H H 664 8.750 8.750 8.205 0.545 18804 1569 1 7 . 1 1 665 665 GLY N N 665 107.803 107.803 108.306 -0.503 18804 1570 1 7 . 1 1 665 665 GLY C C 665 174.402 174.402 176.223 -1.821 18804 1571 1 7 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.378 -0.169 18804 1572 1 7 . 1 1 665 665 GLY H H 665 8.689 8.689 8.210 0.479 18804 1573 1 7 . 1 1 666 666 LEU N N 666 121.365 121.365 121.895 -0.530 18804 1574 1 7 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.146 -0.111 18804 1575 1 7 . 1 1 666 666 LEU C C 666 178.291 178.291 178.986 -0.695 18804 1576 1 7 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.019 0.312 18804 1577 1 7 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.844 -0.624 18804 1578 1 7 . 1 1 666 666 LEU H H 666 8.744 8.744 7.953 0.791 18804 1579 1 7 . 1 1 667 667 PHE N N 667 119.838 119.838 121.241 -1.403 18804 1580 1 7 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.394 -0.303 18804 1581 1 7 . 1 1 667 667 PHE C C 667 176.965 176.965 176.646 0.319 18804 1582 1 7 . 1 1 667 667 PHE CA C 667 61.031 61.031 60.793 0.238 18804 1583 1 7 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.706 -0.945 18804 1584 1 7 . 1 1 667 667 PHE H H 667 8.454 8.454 8.279 0.175 18804 1585 1 7 . 1 1 668 668 MET N N 668 116.868 116.868 117.115 -0.247 18804 1586 1 7 . 1 1 668 668 MET HA H 668 4.035 4.035 4.060 -0.025 18804 1587 1 7 . 1 1 668 668 MET C C 668 177.678 177.678 178.090 -0.412 18804 1588 1 7 . 1 1 668 668 MET CA C 668 57.405 57.405 58.487 -1.082 18804 1589 1 7 . 1 1 668 668 MET CB C 668 31.739 31.739 32.762 -1.023 18804 1590 1 7 . 1 1 668 668 MET H H 668 8.701 8.701 8.454 0.247 18804 1591 1 7 . 1 1 669 669 ARG N N 669 118.600 118.600 116.079 2.521 18804 1592 1 7 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.121 0.014 18804 1593 1 7 . 1 1 669 669 ARG C C 669 177.120 177.120 177.608 -0.488 18804 1594 1 7 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.935 -0.683 18804 1595 1 7 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.750 -1.246 18804 1596 1 7 . 1 1 669 669 ARG H H 669 8.044 8.044 7.579 0.465 18804 1597 1 7 . 1 1 670 670 ARG N N 670 118.124 118.124 120.606 -2.482 18804 1598 1 7 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.417 -0.292 18804 1599 1 7 . 1 1 670 670 ARG C C 670 176.240 176.240 174.054 2.186 18804 1600 1 7 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.869 1.869 18804 1601 1 7 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.773 -1.306 18804 1602 1 7 . 1 1 670 670 ARG H H 670 7.864 7.864 7.846 0.018 18804 1603 1 7 . 1 1 671 671 ARG N N 671 117.904 117.904 124.584 -6.680 18804 1604 1 7 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.301 -0.215 18804 1605 1 7 . 1 1 671 671 ARG C C 671 175.233 175.233 175.666 -0.433 18804 1606 1 7 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.769 0.962 18804 1607 1 7 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.636 -1.142 18804 1608 1 7 . 1 1 671 671 ARG H H 671 7.677 7.677 8.231 -0.554 18804 1609 1 7 . 1 1 672 672 HIS N N 672 117.048 117.048 124.897 -7.849 18804 1610 1 7 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.476 0.127 18804 1611 1 7 . 1 1 672 672 HIS C C 672 173.634 173.634 175.594 -1.960 18804 1612 1 7 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.926 -2.085 18804 1613 1 7 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.544 -2.358 18804 1614 1 7 . 1 1 672 672 HIS H H 672 7.920 7.920 8.583 -0.663 18804 1615 1 7 . 1 1 673 673 ILE N N 673 120.795 120.795 120.783 0.012 18804 1616 1 7 . 1 1 673 673 ILE HA H 673 4.074 4.074 3.965 0.109 18804 1617 1 7 . 1 1 673 673 ILE C C 673 174.922 174.922 175.221 -0.299 18804 1618 1 7 . 1 1 673 673 ILE CA C 673 60.777 60.777 62.209 -1.432 18804 1619 1 7 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.316 -0.480 18804 1620 1 7 . 1 1 673 673 ILE H H 673 7.900 7.900 7.786 0.114 18804 1621 1 7 . 1 1 674 674 VAL N N 674 122.867 122.867 115.883 6.984 18804 1622 1 7 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.479 -0.398 18804 1623 1 7 . 1 1 674 674 VAL C C 674 174.876 174.876 174.790 0.086 18804 1624 1 7 . 1 1 674 674 VAL CA C 674 61.370 61.370 60.942 0.428 18804 1625 1 7 . 1 1 674 674 VAL CB C 674 31.994 31.994 35.412 -3.418 18804 1626 1 7 . 1 1 674 674 VAL H H 674 8.003 8.003 7.043 0.960 18804 1627 1 7 . 1 1 675 675 ARG N N 675 124.866 124.866 120.870 3.996 18804 1628 1 7 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.468 -0.411 18804 1629 1 7 . 1 1 675 675 ARG C C 675 174.922 174.922 176.518 -1.596 18804 1630 1 7 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.062 -0.878 18804 1631 1 7 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.645 -0.329 18804 1632 1 7 . 1 1 675 675 ARG H H 675 8.266 8.266 8.447 -0.181 18804 1633 1 7 . 1 1 676 676 LYS N N 676 123.517 123.517 122.731 0.786 18804 1634 1 7 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.305 -0.040 18804 1635 1 7 . 1 1 676 676 LYS C C 676 174.625 174.625 177.061 -2.436 18804 1636 1 7 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.063 -0.310 18804 1637 1 7 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.039 -2.758 18804 1638 1 7 . 1 1 676 676 LYS H H 676 8.260 8.260 7.961 0.299 18804 1639 1 8 . 1 1 635 635 GLY N N 635 108.817 108.817 110.830 -2.013 18804 1640 1 8 . 1 1 635 635 GLY C C 635 172.499 172.499 174.004 -1.505 18804 1641 1 8 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.768 -0.499 18804 1642 1 8 . 1 1 635 635 GLY H H 635 8.390 8.390 8.652 -0.262 18804 1643 1 8 . 1 1 636 636 CYS N N 636 120.634 120.634 122.155 -1.521 18804 1644 1 8 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.689 0.333 18804 1645 1 8 . 1 1 636 636 CYS C C 636 172.181 172.181 174.130 -1.949 18804 1646 1 8 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.320 -3.726 18804 1647 1 8 . 1 1 636 636 CYS CB C 636 39.488 39.488 29.608 9.880 18804 1648 1 8 . 1 1 636 636 CYS H H 636 8.327 8.327 7.714 0.613 18804 1649 1 8 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.540 -0.040 18804 1650 1 8 . 1 1 637 637 PRO C C 637 176.215 176.215 176.505 -0.290 18804 1651 1 8 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.547 -0.869 18804 1652 1 8 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.966 -0.624 18804 1653 1 8 . 1 1 638 638 THR N N 638 113.690 113.690 111.150 2.540 18804 1654 1 8 . 1 1 638 638 THR HA H 638 4.305 4.305 3.956 0.349 18804 1655 1 8 . 1 1 638 638 THR C C 638 173.495 173.495 173.109 0.386 18804 1656 1 8 . 1 1 638 638 THR CA C 638 60.998 60.998 62.753 -1.755 18804 1657 1 8 . 1 1 638 638 THR CB C 638 68.954 68.954 67.366 1.588 18804 1658 1 8 . 1 1 638 638 THR H H 638 8.114 8.114 7.950 0.164 18804 1659 1 8 . 1 1 639 639 ASN N N 639 120.695 120.695 119.652 1.043 18804 1660 1 8 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.603 0.170 18804 1661 1 8 . 1 1 639 639 ASN C C 639 174.216 174.216 175.142 -0.926 18804 1662 1 8 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.517 -1.160 18804 1663 1 8 . 1 1 639 639 ASN CB C 639 38.581 38.581 38.789 -0.208 18804 1664 1 8 . 1 1 639 639 ASN H H 639 8.301 8.301 8.097 0.204 18804 1665 1 8 . 1 1 640 640 GLY N N 640 108.827 108.827 112.875 -4.048 18804 1666 1 8 . 1 1 640 640 GLY C C 640 170.506 170.506 171.850 -1.344 18804 1667 1 8 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.440 -0.584 18804 1668 1 8 . 1 1 640 640 GLY H H 640 8.111 8.111 8.075 0.036 18804 1669 1 8 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.570 -0.118 18804 1670 1 8 . 1 1 641 641 PRO C C 641 175.669 175.669 175.976 -0.307 18804 1671 1 8 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.922 -0.847 18804 1672 1 8 . 1 1 641 641 PRO CB C 641 31.488 31.488 31.274 0.214 18804 1673 1 8 . 1 1 642 642 LYS N N 642 121.521 121.521 122.951 -1.430 18804 1674 1 8 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.422 -0.096 18804 1675 1 8 . 1 1 642 642 LYS C C 642 175.106 175.106 176.293 -1.187 18804 1676 1 8 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.862 -0.759 18804 1677 1 8 . 1 1 642 642 LYS CB C 642 32.370 32.370 33.625 -1.255 18804 1678 1 8 . 1 1 642 642 LYS H H 642 8.417 8.417 8.056 0.361 18804 1679 1 8 . 1 1 643 643 ILE N N 643 121.410 121.410 121.020 0.390 18804 1680 1 8 . 1 1 643 643 ILE HA H 643 4.335 4.335 3.846 0.489 18804 1681 1 8 . 1 1 643 643 ILE C C 643 173.587 173.587 174.113 -0.526 18804 1682 1 8 . 1 1 643 643 ILE CA C 643 57.874 57.874 60.670 -2.796 18804 1683 1 8 . 1 1 643 643 ILE CB C 643 37.618 37.618 36.600 1.018 18804 1684 1 8 . 1 1 643 643 ILE H H 643 8.069 8.069 8.259 -0.190 18804 1685 1 8 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.622 -0.169 18804 1686 1 8 . 1 1 644 644 PRO C C 644 175.623 175.623 177.514 -1.891 18804 1687 1 8 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.550 -0.091 18804 1688 1 8 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.452 -0.944 18804 1689 1 8 . 1 1 645 645 SER N N 645 115.445 115.445 113.638 1.807 18804 1690 1 8 . 1 1 645 645 SER HA H 645 4.374 4.374 4.262 0.112 18804 1691 1 8 . 1 1 645 645 SER C C 645 174.611 174.611 176.076 -1.465 18804 1692 1 8 . 1 1 645 645 SER CA C 645 58.566 58.566 60.706 -2.140 18804 1693 1 8 . 1 1 645 645 SER CB C 645 62.842 62.842 62.729 0.113 18804 1694 1 8 . 1 1 645 645 SER H H 645 8.267 8.267 8.420 -0.153 18804 1695 1 8 . 1 1 646 646 ILE N N 646 120.612 120.612 121.227 -0.615 18804 1696 1 8 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.800 0.309 18804 1697 1 8 . 1 1 646 646 ILE C C 646 174.703 174.703 177.001 -2.298 18804 1698 1 8 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.757 -1.535 18804 1699 1 8 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.064 0.596 18804 1700 1 8 . 1 1 646 646 ILE H H 646 8.252 8.252 7.986 0.266 18804 1701 1 8 . 1 1 647 647 ALA N N 647 123.224 123.224 123.084 0.140 18804 1702 1 8 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.957 0.206 18804 1703 1 8 . 1 1 647 647 ALA C C 647 176.526 176.526 178.993 -2.467 18804 1704 1 8 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.340 -2.156 18804 1705 1 8 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.008 0.241 18804 1706 1 8 . 1 1 647 647 ALA H H 647 8.084 8.084 7.675 0.409 18804 1707 1 8 . 1 1 648 648 THR N N 648 111.699 111.699 114.833 -3.134 18804 1708 1 8 . 1 1 648 648 THR HA H 648 4.021 4.021 3.901 0.120 18804 1709 1 8 . 1 1 648 648 THR C C 648 175.018 175.018 177.052 -2.034 18804 1710 1 8 . 1 1 648 648 THR CA C 648 63.554 63.554 67.127 -3.573 18804 1711 1 8 . 1 1 648 648 THR CB C 648 68.098 68.098 68.188 -0.090 18804 1712 1 8 . 1 1 648 648 THR H H 648 7.757 7.757 7.765 -0.008 18804 1713 1 8 . 1 1 649 649 GLY N N 649 108.587 108.587 109.348 -0.761 18804 1714 1 8 . 1 1 649 649 GLY C C 649 173.686 173.686 176.071 -2.385 18804 1715 1 8 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.753 -0.809 18804 1716 1 8 . 1 1 649 649 GLY H H 649 8.423 8.423 7.838 0.585 18804 1717 1 8 . 1 1 650 650 MET N N 650 119.486 119.486 121.680 -2.194 18804 1718 1 8 . 1 1 650 650 MET HA H 650 4.135 4.135 4.239 -0.104 18804 1719 1 8 . 1 1 650 650 MET C C 650 176.632 176.632 178.622 -1.990 18804 1720 1 8 . 1 1 650 650 MET CA C 650 57.749 57.749 56.911 0.838 18804 1721 1 8 . 1 1 650 650 MET CB C 650 32.067 32.067 31.716 0.351 18804 1722 1 8 . 1 1 650 650 MET H H 650 8.332 8.332 7.576 0.756 18804 1723 1 8 . 1 1 651 651 VAL N N 651 118.009 118.009 119.165 -1.156 18804 1724 1 8 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.584 -0.044 18804 1725 1 8 . 1 1 651 651 VAL C C 651 176.672 176.672 177.967 -1.295 18804 1726 1 8 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.243 -0.964 18804 1727 1 8 . 1 1 651 651 VAL CB C 651 30.298 30.298 31.218 -0.920 18804 1728 1 8 . 1 1 651 651 VAL H H 651 8.038 8.038 8.783 -0.745 18804 1729 1 8 . 1 1 652 652 GLY N N 652 105.785 105.785 106.533 -0.748 18804 1730 1 8 . 1 1 652 652 GLY C C 652 173.359 173.359 175.370 -2.011 18804 1731 1 8 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.259 -0.271 18804 1732 1 8 . 1 1 652 652 GLY H H 652 8.157 8.157 7.969 0.188 18804 1733 1 8 . 1 1 653 653 ALA N N 653 121.803 121.803 125.003 -3.200 18804 1734 1 8 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.201 -0.274 18804 1735 1 8 . 1 1 653 653 ALA C C 653 177.608 177.608 179.626 -2.018 18804 1736 1 8 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.653 -0.006 18804 1737 1 8 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.344 -0.787 18804 1738 1 8 . 1 1 653 653 ALA H H 653 8.050 8.050 7.719 0.331 18804 1739 1 8 . 1 1 654 654 LEU N N 654 116.652 116.652 119.750 -3.098 18804 1740 1 8 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.866 0.086 18804 1741 1 8 . 1 1 654 654 LEU C C 654 177.361 177.361 179.166 -1.805 18804 1742 1 8 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.186 -0.924 18804 1743 1 8 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.757 -0.854 18804 1744 1 8 . 1 1 654 654 LEU H H 654 7.919 7.919 8.409 -0.490 18804 1745 1 8 . 1 1 655 655 LEU N N 655 117.910 117.910 118.666 -0.756 18804 1746 1 8 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.928 0.009 18804 1747 1 8 . 1 1 655 655 LEU C C 655 177.353 177.353 179.148 -1.795 18804 1748 1 8 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.903 -0.388 18804 1749 1 8 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.599 -0.789 18804 1750 1 8 . 1 1 655 655 LEU H H 655 8.189 8.189 8.110 0.079 18804 1751 1 8 . 1 1 656 656 LEU N N 656 118.140 118.140 119.247 -1.107 18804 1752 1 8 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.891 0.018 18804 1753 1 8 . 1 1 656 656 LEU C C 656 177.304 177.304 179.232 -1.928 18804 1754 1 8 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.854 -0.357 18804 1755 1 8 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.611 -0.850 18804 1756 1 8 . 1 1 656 656 LEU H H 656 8.022 8.022 7.685 0.337 18804 1757 1 8 . 1 1 657 657 LEU N N 657 118.079 118.079 119.686 -1.607 18804 1758 1 8 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.857 -0.019 18804 1759 1 8 . 1 1 657 657 LEU C C 657 177.304 177.304 179.014 -1.710 18804 1760 1 8 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.161 -0.585 18804 1761 1 8 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.584 -0.788 18804 1762 1 8 . 1 1 657 657 LEU H H 657 8.073 8.073 8.309 -0.236 18804 1763 1 8 . 1 1 658 658 LEU N N 658 118.238 118.238 119.139 -0.901 18804 1764 1 8 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.890 0.033 18804 1765 1 8 . 1 1 658 658 LEU C C 658 177.353 177.353 179.173 -1.820 18804 1766 1 8 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.052 -0.543 18804 1767 1 8 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.620 -0.730 18804 1768 1 8 . 1 1 658 658 LEU H H 658 8.148 8.148 7.703 0.445 18804 1769 1 8 . 1 1 659 659 VAL N N 659 117.951 117.951 118.649 -0.698 18804 1770 1 8 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.691 -0.187 18804 1771 1 8 . 1 1 659 659 VAL C C 659 176.888 176.888 178.190 -1.302 18804 1772 1 8 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.194 0.298 18804 1773 1 8 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.761 -0.389 18804 1774 1 8 . 1 1 659 659 VAL H H 659 8.150 8.150 7.772 0.378 18804 1775 1 8 . 1 1 660 660 VAL N N 660 119.240 119.240 120.413 -1.173 18804 1776 1 8 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.586 -0.097 18804 1777 1 8 . 1 1 660 660 VAL C C 660 176.494 176.494 177.850 -1.356 18804 1778 1 8 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.534 -0.184 18804 1779 1 8 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.575 -0.185 18804 1780 1 8 . 1 1 660 660 VAL H H 660 8.220 8.220 8.064 0.156 18804 1781 1 8 . 1 1 661 661 ALA N N 661 121.414 121.414 123.186 -1.772 18804 1782 1 8 . 1 1 661 661 ALA HA H 661 3.892 3.892 3.931 -0.039 18804 1783 1 8 . 1 1 661 661 ALA C C 661 178.419 178.419 179.624 -1.205 18804 1784 1 8 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.417 -0.322 18804 1785 1 8 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.292 -0.993 18804 1786 1 8 . 1 1 661 661 ALA H H 661 8.562 8.562 8.074 0.488 18804 1787 1 8 . 1 1 662 662 LEU N N 662 117.019 117.019 118.852 -1.833 18804 1788 1 8 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.852 0.125 18804 1789 1 8 . 1 1 662 662 LEU C C 662 178.078 178.078 179.275 -1.197 18804 1790 1 8 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.766 -0.450 18804 1791 1 8 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.643 -0.604 18804 1792 1 8 . 1 1 662 662 LEU H H 662 8.460 8.460 7.952 0.508 18804 1793 1 8 . 1 1 663 663 GLY N N 663 106.924 106.924 107.145 -0.221 18804 1794 1 8 . 1 1 663 663 GLY C C 663 174.372 174.372 176.178 -1.806 18804 1795 1 8 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.147 -0.048 18804 1796 1 8 . 1 1 663 663 GLY H H 663 8.683 8.683 7.852 0.831 18804 1797 1 8 . 1 1 664 664 ILE N N 664 121.523 121.523 122.643 -1.120 18804 1798 1 8 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.671 0.028 18804 1799 1 8 . 1 1 664 664 ILE C C 664 177.614 177.614 178.119 -0.505 18804 1800 1 8 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.823 0.212 18804 1801 1 8 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.664 -0.832 18804 1802 1 8 . 1 1 664 664 ILE H H 664 8.750 8.750 8.319 0.431 18804 1803 1 8 . 1 1 665 665 GLY N N 665 107.803 107.803 108.705 -0.902 18804 1804 1 8 . 1 1 665 665 GLY C C 665 174.402 174.402 176.136 -1.734 18804 1805 1 8 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.316 -0.107 18804 1806 1 8 . 1 1 665 665 GLY H H 665 8.689 8.689 8.514 0.175 18804 1807 1 8 . 1 1 666 666 LEU N N 666 121.365 121.365 121.865 -0.500 18804 1808 1 8 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.028 0.007 18804 1809 1 8 . 1 1 666 666 LEU C C 666 178.291 178.291 178.523 -0.232 18804 1810 1 8 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.156 0.175 18804 1811 1 8 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.836 -0.616 18804 1812 1 8 . 1 1 666 666 LEU H H 666 8.744 8.744 7.804 0.940 18804 1813 1 8 . 1 1 667 667 PHE N N 667 119.838 119.838 120.206 -0.368 18804 1814 1 8 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.229 -0.138 18804 1815 1 8 . 1 1 667 667 PHE C C 667 176.965 176.965 177.773 -0.808 18804 1816 1 8 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.004 0.027 18804 1817 1 8 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.857 -1.096 18804 1818 1 8 . 1 1 667 667 PHE H H 667 8.454 8.454 7.857 0.597 18804 1819 1 8 . 1 1 668 668 MET N N 668 116.868 116.868 118.373 -1.505 18804 1820 1 8 . 1 1 668 668 MET HA H 668 4.035 4.035 3.941 0.094 18804 1821 1 8 . 1 1 668 668 MET C C 668 177.678 177.678 178.181 -0.503 18804 1822 1 8 . 1 1 668 668 MET CA C 668 57.405 57.405 58.672 -1.267 18804 1823 1 8 . 1 1 668 668 MET CB C 668 31.739 31.739 32.438 -0.699 18804 1824 1 8 . 1 1 668 668 MET H H 668 8.701 8.701 8.736 -0.035 18804 1825 1 8 . 1 1 669 669 ARG N N 669 118.600 118.600 116.587 2.013 18804 1826 1 8 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.066 0.069 18804 1827 1 8 . 1 1 669 669 ARG C C 669 177.120 177.120 176.945 0.175 18804 1828 1 8 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.756 -0.504 18804 1829 1 8 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.588 -1.084 18804 1830 1 8 . 1 1 669 669 ARG H H 669 8.044 8.044 7.606 0.438 18804 1831 1 8 . 1 1 670 670 ARG N N 670 118.124 118.124 119.165 -1.041 18804 1832 1 8 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.435 -0.310 18804 1833 1 8 . 1 1 670 670 ARG C C 670 176.240 176.240 174.273 1.967 18804 1834 1 8 . 1 1 670 670 ARG CA C 670 56.738 56.738 55.154 1.584 18804 1835 1 8 . 1 1 670 670 ARG CB C 670 29.467 29.467 31.124 -1.657 18804 1836 1 8 . 1 1 670 670 ARG H H 670 7.864 7.864 7.662 0.202 18804 1837 1 8 . 1 1 671 671 ARG N N 671 117.904 117.904 122.056 -4.152 18804 1838 1 8 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.411 -0.325 18804 1839 1 8 . 1 1 671 671 ARG C C 671 175.233 175.233 175.417 -0.184 18804 1840 1 8 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.581 0.150 18804 1841 1 8 . 1 1 671 671 ARG CB C 671 29.494 29.494 31.856 -2.362 18804 1842 1 8 . 1 1 671 671 ARG H H 671 7.677 7.677 8.351 -0.674 18804 1843 1 8 . 1 1 672 672 HIS N N 672 117.048 117.048 121.603 -4.555 18804 1844 1 8 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.853 -0.250 18804 1845 1 8 . 1 1 672 672 HIS C C 672 173.634 173.634 174.878 -1.244 18804 1846 1 8 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.096 -0.255 18804 1847 1 8 . 1 1 672 672 HIS CB C 672 28.186 28.186 32.100 -3.914 18804 1848 1 8 . 1 1 672 672 HIS H H 672 7.920 7.920 8.504 -0.584 18804 1849 1 8 . 1 1 673 673 ILE N N 673 120.795 120.795 123.860 -3.065 18804 1850 1 8 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.346 -0.272 18804 1851 1 8 . 1 1 673 673 ILE C C 673 174.922 174.922 175.358 -0.436 18804 1852 1 8 . 1 1 673 673 ILE CA C 673 60.777 60.777 61.107 -0.330 18804 1853 1 8 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.102 -0.266 18804 1854 1 8 . 1 1 673 673 ILE H H 673 7.900 7.900 8.392 -0.492 18804 1855 1 8 . 1 1 674 674 VAL N N 674 122.867 122.867 126.959 -4.092 18804 1856 1 8 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.442 -0.361 18804 1857 1 8 . 1 1 674 674 VAL C C 674 174.876 174.876 175.301 -0.425 18804 1858 1 8 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.599 -0.229 18804 1859 1 8 . 1 1 674 674 VAL CB C 674 31.994 31.994 33.748 -1.754 18804 1860 1 8 . 1 1 674 674 VAL H H 674 8.003 8.003 8.453 -0.450 18804 1861 1 8 . 1 1 675 675 ARG N N 675 124.866 124.866 124.516 0.350 18804 1862 1 8 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.856 -0.799 18804 1863 1 8 . 1 1 675 675 ARG C C 675 174.922 174.922 175.594 -0.672 18804 1864 1 8 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.220 -0.036 18804 1865 1 8 . 1 1 675 675 ARG CB C 675 30.316 30.316 32.139 -1.823 18804 1866 1 8 . 1 1 675 675 ARG H H 675 8.266 8.266 8.431 -0.165 18804 1867 1 8 . 1 1 676 676 LYS N N 676 123.517 123.517 121.065 2.452 18804 1868 1 8 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.631 -0.366 18804 1869 1 8 . 1 1 676 676 LYS C C 676 174.625 174.625 176.818 -2.193 18804 1870 1 8 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.398 0.355 18804 1871 1 8 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.830 -3.549 18804 1872 1 8 . 1 1 676 676 LYS H H 676 8.260 8.260 8.339 -0.079 18804 1873 1 9 . 1 1 635 635 GLY N N 635 108.817 108.817 110.910 -2.093 18804 1874 1 9 . 1 1 635 635 GLY C C 635 172.499 172.499 173.381 -0.882 18804 1875 1 9 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.882 -0.613 18804 1876 1 9 . 1 1 635 635 GLY H H 635 8.390 8.390 8.884 -0.494 18804 1877 1 9 . 1 1 636 636 CYS N N 636 120.634 120.634 121.073 -0.439 18804 1878 1 9 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.705 0.317 18804 1879 1 9 . 1 1 636 636 CYS C C 636 172.181 172.181 173.916 -1.735 18804 1880 1 9 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.524 -5.930 18804 1881 1 9 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.831 10.658 18804 1882 1 9 . 1 1 636 636 CYS H H 636 8.327 8.327 8.419 -0.092 18804 1883 1 9 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.417 0.083 18804 1884 1 9 . 1 1 637 637 PRO C C 637 176.215 176.215 176.582 -0.367 18804 1885 1 9 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.935 -1.257 18804 1886 1 9 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.619 -0.277 18804 1887 1 9 . 1 1 638 638 THR N N 638 113.690 113.690 108.379 5.311 18804 1888 1 9 . 1 1 638 638 THR HA H 638 4.305 4.305 3.933 0.372 18804 1889 1 9 . 1 1 638 638 THR C C 638 173.495 173.495 173.266 0.229 18804 1890 1 9 . 1 1 638 638 THR CA C 638 60.998 60.998 62.496 -1.498 18804 1891 1 9 . 1 1 638 638 THR CB C 638 68.954 68.954 67.507 1.447 18804 1892 1 9 . 1 1 638 638 THR H H 638 8.114 8.114 7.793 0.321 18804 1893 1 9 . 1 1 639 639 ASN N N 639 120.695 120.695 118.343 2.352 18804 1894 1 9 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.539 0.234 18804 1895 1 9 . 1 1 639 639 ASN C C 639 174.216 174.216 175.687 -1.471 18804 1896 1 9 . 1 1 639 639 ASN CA C 639 52.357 52.357 54.349 -1.992 18804 1897 1 9 . 1 1 639 639 ASN CB C 639 38.581 38.581 38.664 -0.083 18804 1898 1 9 . 1 1 639 639 ASN H H 639 8.301 8.301 8.029 0.272 18804 1899 1 9 . 1 1 640 640 GLY N N 640 108.827 108.827 108.988 -0.161 18804 1900 1 9 . 1 1 640 640 GLY C C 640 170.506 170.506 172.955 -2.449 18804 1901 1 9 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.383 -0.528 18804 1902 1 9 . 1 1 640 640 GLY H H 640 8.111 8.111 8.375 -0.264 18804 1903 1 9 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.731 -0.279 18804 1904 1 9 . 1 1 641 641 PRO C C 641 175.669 175.669 176.037 -0.368 18804 1905 1 9 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.295 -0.221 18804 1906 1 9 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.437 -0.949 18804 1907 1 9 . 1 1 642 642 LYS N N 642 121.521 121.521 119.798 1.723 18804 1908 1 9 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.657 -0.331 18804 1909 1 9 . 1 1 642 642 LYS C C 642 175.106 175.106 174.721 0.385 18804 1910 1 9 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.047 -0.944 18804 1911 1 9 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.382 -2.012 18804 1912 1 9 . 1 1 642 642 LYS H H 642 8.417 8.417 8.428 -0.011 18804 1913 1 9 . 1 1 643 643 ILE N N 643 121.410 121.410 124.836 -3.426 18804 1914 1 9 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.415 -0.080 18804 1915 1 9 . 1 1 643 643 ILE C C 643 173.587 173.587 174.584 -0.997 18804 1916 1 9 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.536 -1.662 18804 1917 1 9 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.625 -0.007 18804 1918 1 9 . 1 1 643 643 ILE H H 643 8.069 8.069 8.416 -0.347 18804 1919 1 9 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.553 -0.100 18804 1920 1 9 . 1 1 644 644 PRO C C 644 175.623 175.623 177.549 -1.926 18804 1921 1 9 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.337 0.122 18804 1922 1 9 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.393 -0.885 18804 1923 1 9 . 1 1 645 645 SER N N 645 115.445 115.445 114.062 1.383 18804 1924 1 9 . 1 1 645 645 SER HA H 645 4.374 4.374 4.267 0.107 18804 1925 1 9 . 1 1 645 645 SER C C 645 174.611 174.611 176.223 -1.612 18804 1926 1 9 . 1 1 645 645 SER CA C 645 58.566 58.566 60.330 -1.764 18804 1927 1 9 . 1 1 645 645 SER CB C 645 62.842 62.842 62.828 0.014 18804 1928 1 9 . 1 1 645 645 SER H H 645 8.267 8.267 8.456 -0.189 18804 1929 1 9 . 1 1 646 646 ILE N N 646 120.612 120.612 121.813 -1.201 18804 1930 1 9 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.810 0.299 18804 1931 1 9 . 1 1 646 646 ILE C C 646 174.703 174.703 177.048 -2.345 18804 1932 1 9 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.769 -1.547 18804 1933 1 9 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.014 0.646 18804 1934 1 9 . 1 1 646 646 ILE H H 646 8.252 8.252 7.999 0.253 18804 1935 1 9 . 1 1 647 647 ALA N N 647 123.224 123.224 123.024 0.200 18804 1936 1 9 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.946 0.217 18804 1937 1 9 . 1 1 647 647 ALA C C 647 176.526 176.526 179.005 -2.479 18804 1938 1 9 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.398 -2.214 18804 1939 1 9 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.996 0.253 18804 1940 1 9 . 1 1 647 647 ALA H H 647 8.084 8.084 7.668 0.416 18804 1941 1 9 . 1 1 648 648 THR N N 648 111.699 111.699 114.713 -3.014 18804 1942 1 9 . 1 1 648 648 THR HA H 648 4.021 4.021 3.890 0.131 18804 1943 1 9 . 1 1 648 648 THR C C 648 175.018 175.018 177.059 -2.041 18804 1944 1 9 . 1 1 648 648 THR CA C 648 63.554 63.554 66.926 -3.372 18804 1945 1 9 . 1 1 648 648 THR CB C 648 68.098 68.098 68.124 -0.026 18804 1946 1 9 . 1 1 648 648 THR H H 648 7.757 7.757 7.788 -0.031 18804 1947 1 9 . 1 1 649 649 GLY N N 649 108.587 108.587 109.372 -0.785 18804 1948 1 9 . 1 1 649 649 GLY C C 649 173.686 173.686 176.070 -2.384 18804 1949 1 9 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.747 -0.803 18804 1950 1 9 . 1 1 649 649 GLY H H 649 8.423 8.423 7.843 0.580 18804 1951 1 9 . 1 1 650 650 MET N N 650 119.486 119.486 121.690 -2.204 18804 1952 1 9 . 1 1 650 650 MET HA H 650 4.135 4.135 4.262 -0.127 18804 1953 1 9 . 1 1 650 650 MET C C 650 176.632 176.632 178.646 -2.014 18804 1954 1 9 . 1 1 650 650 MET CA C 650 57.749 57.749 56.983 0.766 18804 1955 1 9 . 1 1 650 650 MET CB C 650 32.067 32.067 31.630 0.437 18804 1956 1 9 . 1 1 650 650 MET H H 650 8.332 8.332 7.560 0.772 18804 1957 1 9 . 1 1 651 651 VAL N N 651 118.009 118.009 118.751 -0.742 18804 1958 1 9 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.644 -0.104 18804 1959 1 9 . 1 1 651 651 VAL C C 651 176.672 176.672 178.212 -1.540 18804 1960 1 9 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.495 -1.216 18804 1961 1 9 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.641 -0.343 18804 1962 1 9 . 1 1 651 651 VAL H H 651 8.038 8.038 8.823 -0.785 18804 1963 1 9 . 1 1 652 652 GLY N N 652 105.785 105.785 107.146 -1.361 18804 1964 1 9 . 1 1 652 652 GLY C C 652 173.359 173.359 175.516 -2.157 18804 1965 1 9 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.290 -0.302 18804 1966 1 9 . 1 1 652 652 GLY H H 652 8.157 8.157 8.033 0.124 18804 1967 1 9 . 1 1 653 653 ALA N N 653 121.803 121.803 124.939 -3.136 18804 1968 1 9 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.201 -0.274 18804 1969 1 9 . 1 1 653 653 ALA C C 653 177.608 177.608 179.675 -2.067 18804 1970 1 9 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.642 0.005 18804 1971 1 9 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.364 -0.807 18804 1972 1 9 . 1 1 653 653 ALA H H 653 8.050 8.050 7.796 0.254 18804 1973 1 9 . 1 1 654 654 LEU N N 654 116.652 116.652 119.795 -3.143 18804 1974 1 9 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.890 0.062 18804 1975 1 9 . 1 1 654 654 LEU C C 654 177.361 177.361 179.128 -1.767 18804 1976 1 9 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.171 -0.909 18804 1977 1 9 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.810 -0.907 18804 1978 1 9 . 1 1 654 654 LEU H H 654 7.919 7.919 8.389 -0.470 18804 1979 1 9 . 1 1 655 655 LEU N N 655 117.910 117.910 118.750 -0.840 18804 1980 1 9 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.939 -0.002 18804 1981 1 9 . 1 1 655 655 LEU C C 655 177.353 177.353 179.238 -1.885 18804 1982 1 9 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.932 -0.417 18804 1983 1 9 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.587 -0.777 18804 1984 1 9 . 1 1 655 655 LEU H H 655 8.189 8.189 8.278 -0.089 18804 1985 1 9 . 1 1 656 656 LEU N N 656 118.140 118.140 119.178 -1.038 18804 1986 1 9 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.922 -0.013 18804 1987 1 9 . 1 1 656 656 LEU C C 656 177.304 177.304 179.180 -1.876 18804 1988 1 9 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.741 -0.244 18804 1989 1 9 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.653 -0.892 18804 1990 1 9 . 1 1 656 656 LEU H H 656 8.022 8.022 7.715 0.307 18804 1991 1 9 . 1 1 657 657 LEU N N 657 118.079 118.079 119.941 -1.862 18804 1992 1 9 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.864 -0.026 18804 1993 1 9 . 1 1 657 657 LEU C C 657 177.304 177.304 179.016 -1.712 18804 1994 1 9 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.253 -0.677 18804 1995 1 9 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.648 -0.852 18804 1996 1 9 . 1 1 657 657 LEU H H 657 8.073 8.073 8.119 -0.046 18804 1997 1 9 . 1 1 658 658 LEU N N 658 118.238 118.238 118.881 -0.643 18804 1998 1 9 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.925 -0.002 18804 1999 1 9 . 1 1 658 658 LEU C C 658 177.353 177.353 179.190 -1.837 18804 2000 1 9 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.068 -0.559 18804 2001 1 9 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.619 -0.730 18804 2002 1 9 . 1 1 658 658 LEU H H 658 8.148 8.148 7.729 0.419 18804 2003 1 9 . 1 1 659 659 VAL N N 659 117.951 117.951 118.679 -0.728 18804 2004 1 9 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.657 -0.153 18804 2005 1 9 . 1 1 659 659 VAL C C 659 176.888 176.888 178.347 -1.459 18804 2006 1 9 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.577 -0.085 18804 2007 1 9 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.940 -0.568 18804 2008 1 9 . 1 1 659 659 VAL H H 659 8.150 8.150 7.710 0.440 18804 2009 1 9 . 1 1 660 660 VAL N N 660 119.240 119.240 120.984 -1.744 18804 2010 1 9 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.635 -0.146 18804 2011 1 9 . 1 1 660 660 VAL C C 660 176.494 176.494 177.673 -1.179 18804 2012 1 9 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.540 -0.189 18804 2013 1 9 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.679 -0.289 18804 2014 1 9 . 1 1 660 660 VAL H H 660 8.220 8.220 8.079 0.141 18804 2015 1 9 . 1 1 661 661 ALA N N 661 121.414 121.414 122.417 -1.003 18804 2016 1 9 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.036 -0.144 18804 2017 1 9 . 1 1 661 661 ALA C C 661 178.419 178.419 179.838 -1.419 18804 2018 1 9 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.314 -0.219 18804 2019 1 9 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.166 -0.868 18804 2020 1 9 . 1 1 661 661 ALA H H 661 8.562 8.562 7.799 0.763 18804 2021 1 9 . 1 1 662 662 LEU N N 662 117.019 117.019 118.836 -1.817 18804 2022 1 9 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.888 0.089 18804 2023 1 9 . 1 1 662 662 LEU C C 662 178.078 178.078 179.191 -1.113 18804 2024 1 9 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.598 -0.282 18804 2025 1 9 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.682 -0.643 18804 2026 1 9 . 1 1 662 662 LEU H H 662 8.460 8.460 7.947 0.513 18804 2027 1 9 . 1 1 663 663 GLY N N 663 106.924 106.924 107.289 -0.365 18804 2028 1 9 . 1 1 663 663 GLY C C 663 174.372 174.372 176.132 -1.760 18804 2029 1 9 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.288 -0.189 18804 2030 1 9 . 1 1 663 663 GLY H H 663 8.683 8.683 8.019 0.664 18804 2031 1 9 . 1 1 664 664 ILE N N 664 121.523 121.523 122.690 -1.167 18804 2032 1 9 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.664 0.034 18804 2033 1 9 . 1 1 664 664 ILE C C 664 177.614 177.614 178.099 -0.485 18804 2034 1 9 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.080 -0.045 18804 2035 1 9 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.673 -0.841 18804 2036 1 9 . 1 1 664 664 ILE H H 664 8.750 8.750 8.071 0.679 18804 2037 1 9 . 1 1 665 665 GLY N N 665 107.803 107.803 108.493 -0.690 18804 2038 1 9 . 1 1 665 665 GLY C C 665 174.402 174.402 176.249 -1.847 18804 2039 1 9 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.317 -0.108 18804 2040 1 9 . 1 1 665 665 GLY H H 665 8.689 8.689 8.114 0.575 18804 2041 1 9 . 1 1 666 666 LEU N N 666 121.365 121.365 122.090 -0.725 18804 2042 1 9 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.031 0.004 18804 2043 1 9 . 1 1 666 666 LEU C C 666 178.291 178.291 178.919 -0.628 18804 2044 1 9 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.141 0.190 18804 2045 1 9 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.783 -0.563 18804 2046 1 9 . 1 1 666 666 LEU H H 666 8.744 8.744 7.903 0.841 18804 2047 1 9 . 1 1 667 667 PHE N N 667 119.838 119.838 120.908 -1.070 18804 2048 1 9 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.121 -0.030 18804 2049 1 9 . 1 1 667 667 PHE C C 667 176.965 176.965 177.959 -0.994 18804 2050 1 9 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.578 -0.547 18804 2051 1 9 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.450 -0.689 18804 2052 1 9 . 1 1 667 667 PHE H H 667 8.454 8.454 8.380 0.074 18804 2053 1 9 . 1 1 668 668 MET N N 668 116.868 116.868 118.219 -1.351 18804 2054 1 9 . 1 1 668 668 MET HA H 668 4.035 4.035 3.990 0.045 18804 2055 1 9 . 1 1 668 668 MET C C 668 177.678 177.678 178.685 -1.007 18804 2056 1 9 . 1 1 668 668 MET CA C 668 57.405 57.405 59.089 -1.684 18804 2057 1 9 . 1 1 668 668 MET CB C 668 31.739 31.739 32.360 -0.621 18804 2058 1 9 . 1 1 668 668 MET H H 668 8.701 8.701 8.802 -0.101 18804 2059 1 9 . 1 1 669 669 ARG N N 669 118.600 118.600 117.094 1.506 18804 2060 1 9 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.039 0.096 18804 2061 1 9 . 1 1 669 669 ARG C C 669 177.120 177.120 177.411 -0.291 18804 2062 1 9 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.430 -1.178 18804 2063 1 9 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.016 -0.512 18804 2064 1 9 . 1 1 669 669 ARG H H 669 8.044 8.044 7.693 0.351 18804 2065 1 9 . 1 1 670 670 ARG N N 670 118.124 118.124 117.100 1.024 18804 2066 1 9 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.032 0.093 18804 2067 1 9 . 1 1 670 670 ARG C C 670 176.240 176.240 176.928 -0.688 18804 2068 1 9 . 1 1 670 670 ARG CA C 670 56.738 56.738 57.674 -0.936 18804 2069 1 9 . 1 1 670 670 ARG CB C 670 29.467 29.467 29.816 -0.349 18804 2070 1 9 . 1 1 670 670 ARG H H 670 7.864 7.864 7.459 0.405 18804 2071 1 9 . 1 1 671 671 ARG N N 671 117.904 117.904 118.656 -0.752 18804 2072 1 9 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.397 -0.311 18804 2073 1 9 . 1 1 671 671 ARG C C 671 175.233 175.233 175.386 -0.153 18804 2074 1 9 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.491 0.240 18804 2075 1 9 . 1 1 671 671 ARG CB C 671 29.494 29.494 31.674 -2.180 18804 2076 1 9 . 1 1 671 671 ARG H H 671 7.677 7.677 7.396 0.281 18804 2077 1 9 . 1 1 672 672 HIS N N 672 117.048 117.048 117.183 -0.135 18804 2078 1 9 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.827 -0.224 18804 2079 1 9 . 1 1 672 672 HIS C C 672 173.634 173.634 175.874 -2.240 18804 2080 1 9 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.186 -0.345 18804 2081 1 9 . 1 1 672 672 HIS CB C 672 28.186 28.186 31.955 -3.769 18804 2082 1 9 . 1 1 672 672 HIS H H 672 7.920 7.920 8.439 -0.519 18804 2083 1 9 . 1 1 673 673 ILE N N 673 120.795 120.795 123.966 -3.171 18804 2084 1 9 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.028 0.046 18804 2085 1 9 . 1 1 673 673 ILE C C 673 174.922 174.922 175.656 -0.734 18804 2086 1 9 . 1 1 673 673 ILE CA C 673 60.777 60.777 61.935 -1.159 18804 2087 1 9 . 1 1 673 673 ILE CB C 673 37.836 37.836 37.393 0.443 18804 2088 1 9 . 1 1 673 673 ILE H H 673 7.900 7.900 8.356 -0.456 18804 2089 1 9 . 1 1 674 674 VAL N N 674 122.867 122.867 124.742 -1.875 18804 2090 1 9 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.409 -0.328 18804 2091 1 9 . 1 1 674 674 VAL C C 674 174.876 174.876 175.304 -0.428 18804 2092 1 9 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.465 -0.095 18804 2093 1 9 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.959 -0.965 18804 2094 1 9 . 1 1 674 674 VAL H H 674 8.003 8.003 8.126 -0.123 18804 2095 1 9 . 1 1 675 675 ARG N N 675 124.866 124.866 126.623 -1.757 18804 2096 1 9 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.258 -0.201 18804 2097 1 9 . 1 1 675 675 ARG C C 675 174.922 174.922 176.203 -1.281 18804 2098 1 9 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.206 -1.022 18804 2099 1 9 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.630 -0.314 18804 2100 1 9 . 1 1 675 675 ARG H H 675 8.266 8.266 8.610 -0.344 18804 2101 1 9 . 1 1 676 676 LYS N N 676 123.517 123.517 121.784 1.733 18804 2102 1 9 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.166 0.099 18804 2103 1 9 . 1 1 676 676 LYS C C 676 174.625 174.625 176.238 -1.613 18804 2104 1 9 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.463 -0.710 18804 2105 1 9 . 1 1 676 676 LYS CB C 676 30.281 30.281 31.923 -1.642 18804 2106 1 9 . 1 1 676 676 LYS H H 676 8.260 8.260 8.321 -0.061 18804 2107 1 10 . 1 1 635 635 GLY N N 635 108.817 108.817 111.957 -3.140 18804 2108 1 10 . 1 1 635 635 GLY C C 635 172.499 172.499 173.717 -1.218 18804 2109 1 10 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.508 -1.239 18804 2110 1 10 . 1 1 635 635 GLY H H 635 8.390 8.390 8.272 0.118 18804 2111 1 10 . 1 1 636 636 CYS N N 636 120.634 120.634 120.296 0.338 18804 2112 1 10 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.622 0.400 18804 2113 1 10 . 1 1 636 636 CYS C C 636 172.181 172.181 173.791 -1.610 18804 2114 1 10 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.590 -3.996 18804 2115 1 10 . 1 1 636 636 CYS CB C 636 39.488 39.488 29.179 10.309 18804 2116 1 10 . 1 1 636 636 CYS H H 636 8.327 8.327 7.808 0.519 18804 2117 1 10 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.395 0.105 18804 2118 1 10 . 1 1 637 637 PRO C C 637 176.215 176.215 177.001 -0.786 18804 2119 1 10 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.093 -1.415 18804 2120 1 10 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.683 -0.341 18804 2121 1 10 . 1 1 638 638 THR N N 638 113.690 113.690 109.454 4.236 18804 2122 1 10 . 1 1 638 638 THR HA H 638 4.305 4.305 4.024 0.281 18804 2123 1 10 . 1 1 638 638 THR C C 638 173.495 173.495 173.475 0.020 18804 2124 1 10 . 1 1 638 638 THR CA C 638 60.998 60.998 62.908 -1.910 18804 2125 1 10 . 1 1 638 638 THR CB C 638 68.954 68.954 67.698 1.256 18804 2126 1 10 . 1 1 638 638 THR H H 638 8.114 8.114 7.933 0.181 18804 2127 1 10 . 1 1 639 639 ASN N N 639 120.695 120.695 119.367 1.328 18804 2128 1 10 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.883 -0.110 18804 2129 1 10 . 1 1 639 639 ASN C C 639 174.216 174.216 174.608 -0.392 18804 2130 1 10 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.098 -0.741 18804 2131 1 10 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.082 -0.501 18804 2132 1 10 . 1 1 639 639 ASN H H 639 8.301 8.301 8.179 0.122 18804 2133 1 10 . 1 1 640 640 GLY N N 640 108.827 108.827 111.775 -2.948 18804 2134 1 10 . 1 1 640 640 GLY C C 640 170.506 170.506 172.364 -1.858 18804 2135 1 10 . 1 1 640 640 GLY CA C 640 43.855 43.855 45.164 -1.309 18804 2136 1 10 . 1 1 640 640 GLY H H 640 8.111 8.111 8.397 -0.286 18804 2137 1 10 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.491 -0.039 18804 2138 1 10 . 1 1 641 641 PRO C C 641 175.669 175.669 176.105 -0.436 18804 2139 1 10 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.844 -0.769 18804 2140 1 10 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.209 -0.721 18804 2141 1 10 . 1 1 642 642 LYS N N 642 121.521 121.521 122.708 -1.187 18804 2142 1 10 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.573 -0.247 18804 2143 1 10 . 1 1 642 642 LYS C C 642 175.106 175.106 175.177 -0.071 18804 2144 1 10 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.740 -1.637 18804 2145 1 10 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.462 -2.092 18804 2146 1 10 . 1 1 642 642 LYS H H 642 8.417 8.417 8.499 -0.082 18804 2147 1 10 . 1 1 643 643 ILE N N 643 121.410 121.410 125.487 -4.077 18804 2148 1 10 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.410 -0.075 18804 2149 1 10 . 1 1 643 643 ILE C C 643 173.587 173.587 174.752 -1.165 18804 2150 1 10 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.411 -1.537 18804 2151 1 10 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.461 -0.843 18804 2152 1 10 . 1 1 643 643 ILE H H 643 8.069 8.069 8.417 -0.348 18804 2153 1 10 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.581 -0.128 18804 2154 1 10 . 1 1 644 644 PRO C C 644 175.623 175.623 177.402 -1.779 18804 2155 1 10 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.354 0.105 18804 2156 1 10 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.470 -0.962 18804 2157 1 10 . 1 1 645 645 SER N N 645 115.445 115.445 113.716 1.729 18804 2158 1 10 . 1 1 645 645 SER HA H 645 4.374 4.374 4.254 0.120 18804 2159 1 10 . 1 1 645 645 SER C C 645 174.611 174.611 175.590 -0.979 18804 2160 1 10 . 1 1 645 645 SER CA C 645 58.566 58.566 60.176 -1.611 18804 2161 1 10 . 1 1 645 645 SER CB C 645 62.842 62.842 62.861 -0.019 18804 2162 1 10 . 1 1 645 645 SER H H 645 8.267 8.267 8.372 -0.105 18804 2163 1 10 . 1 1 646 646 ILE N N 646 120.612 120.612 121.278 -0.666 18804 2164 1 10 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.888 0.221 18804 2165 1 10 . 1 1 646 646 ILE C C 646 174.703 174.703 177.308 -2.605 18804 2166 1 10 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.425 -0.203 18804 2167 1 10 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.146 1.514 18804 2168 1 10 . 1 1 646 646 ILE H H 646 8.252 8.252 7.932 0.320 18804 2169 1 10 . 1 1 647 647 ALA N N 647 123.224 123.224 122.981 0.243 18804 2170 1 10 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.922 0.241 18804 2171 1 10 . 1 1 647 647 ALA C C 647 176.526 176.526 179.036 -2.510 18804 2172 1 10 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.294 -2.110 18804 2173 1 10 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.068 0.181 18804 2174 1 10 . 1 1 647 647 ALA H H 647 8.084 8.084 7.645 0.439 18804 2175 1 10 . 1 1 648 648 THR N N 648 111.699 111.699 114.770 -3.071 18804 2176 1 10 . 1 1 648 648 THR HA H 648 4.021 4.021 3.819 0.202 18804 2177 1 10 . 1 1 648 648 THR C C 648 175.018 175.018 176.940 -1.922 18804 2178 1 10 . 1 1 648 648 THR CA C 648 63.554 63.554 67.148 -3.594 18804 2179 1 10 . 1 1 648 648 THR CB C 648 68.098 68.098 68.466 -0.368 18804 2180 1 10 . 1 1 648 648 THR H H 648 7.757 7.757 7.748 0.009 18804 2181 1 10 . 1 1 649 649 GLY N N 649 108.587 108.587 109.429 -0.842 18804 2182 1 10 . 1 1 649 649 GLY C C 649 173.686 173.686 176.189 -2.503 18804 2183 1 10 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.813 -0.869 18804 2184 1 10 . 1 1 649 649 GLY H H 649 8.423 8.423 7.843 0.580 18804 2185 1 10 . 1 1 650 650 MET N N 650 119.486 119.486 121.625 -2.139 18804 2186 1 10 . 1 1 650 650 MET HA H 650 4.135 4.135 4.266 -0.131 18804 2187 1 10 . 1 1 650 650 MET C C 650 176.632 176.632 178.641 -2.009 18804 2188 1 10 . 1 1 650 650 MET CA C 650 57.749 57.749 56.929 0.820 18804 2189 1 10 . 1 1 650 650 MET CB C 650 32.067 32.067 31.594 0.473 18804 2190 1 10 . 1 1 650 650 MET H H 650 8.332 8.332 7.559 0.773 18804 2191 1 10 . 1 1 651 651 VAL N N 651 118.009 118.009 118.879 -0.870 18804 2192 1 10 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.646 -0.106 18804 2193 1 10 . 1 1 651 651 VAL C C 651 176.672 176.672 178.221 -1.549 18804 2194 1 10 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.534 -1.255 18804 2195 1 10 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.699 -0.401 18804 2196 1 10 . 1 1 651 651 VAL H H 651 8.038 8.038 8.815 -0.777 18804 2197 1 10 . 1 1 652 652 GLY N N 652 105.785 105.785 107.085 -1.300 18804 2198 1 10 . 1 1 652 652 GLY C C 652 173.359 173.359 175.493 -2.134 18804 2199 1 10 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.274 -0.286 18804 2200 1 10 . 1 1 652 652 GLY H H 652 8.157 8.157 8.018 0.139 18804 2201 1 10 . 1 1 653 653 ALA N N 653 121.803 121.803 124.951 -3.148 18804 2202 1 10 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.196 -0.269 18804 2203 1 10 . 1 1 653 653 ALA C C 653 177.608 177.608 179.653 -2.045 18804 2204 1 10 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.646 0.001 18804 2205 1 10 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.355 -0.798 18804 2206 1 10 . 1 1 653 653 ALA H H 653 8.050 8.050 7.791 0.259 18804 2207 1 10 . 1 1 654 654 LEU N N 654 116.652 116.652 119.768 -3.116 18804 2208 1 10 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.877 0.075 18804 2209 1 10 . 1 1 654 654 LEU C C 654 177.361 177.361 179.120 -1.759 18804 2210 1 10 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.162 -0.900 18804 2211 1 10 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.781 -0.878 18804 2212 1 10 . 1 1 654 654 LEU H H 654 7.919 7.919 8.392 -0.473 18804 2213 1 10 . 1 1 655 655 LEU N N 655 117.910 117.910 118.731 -0.821 18804 2214 1 10 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.930 0.007 18804 2215 1 10 . 1 1 655 655 LEU C C 655 177.353 177.353 179.225 -1.872 18804 2216 1 10 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.928 -0.413 18804 2217 1 10 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.593 -0.783 18804 2218 1 10 . 1 1 655 655 LEU H H 655 8.189 8.189 8.161 0.028 18804 2219 1 10 . 1 1 656 656 LEU N N 656 118.140 118.140 119.154 -1.014 18804 2220 1 10 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.919 -0.010 18804 2221 1 10 . 1 1 656 656 LEU C C 656 177.304 177.304 179.199 -1.895 18804 2222 1 10 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.739 -0.242 18804 2223 1 10 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.645 -0.884 18804 2224 1 10 . 1 1 656 656 LEU H H 656 8.022 8.022 7.663 0.359 18804 2225 1 10 . 1 1 657 657 LEU N N 657 118.079 118.079 119.952 -1.873 18804 2226 1 10 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.865 -0.027 18804 2227 1 10 . 1 1 657 657 LEU C C 657 177.304 177.304 179.010 -1.706 18804 2228 1 10 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.235 -0.659 18804 2229 1 10 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.640 -0.844 18804 2230 1 10 . 1 1 657 657 LEU H H 657 8.073 8.073 8.120 -0.047 18804 2231 1 10 . 1 1 658 658 LEU N N 658 118.238 118.238 118.950 -0.712 18804 2232 1 10 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.922 0.001 18804 2233 1 10 . 1 1 658 658 LEU C C 658 177.353 177.353 179.191 -1.838 18804 2234 1 10 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.074 -0.565 18804 2235 1 10 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.607 -0.718 18804 2236 1 10 . 1 1 658 658 LEU H H 658 8.148 8.148 7.758 0.390 18804 2237 1 10 . 1 1 659 659 VAL N N 659 117.951 117.951 118.626 -0.675 18804 2238 1 10 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.658 -0.154 18804 2239 1 10 . 1 1 659 659 VAL C C 659 176.888 176.888 178.359 -1.471 18804 2240 1 10 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.552 -0.060 18804 2241 1 10 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.894 -0.522 18804 2242 1 10 . 1 1 659 659 VAL H H 659 8.150 8.150 7.724 0.426 18804 2243 1 10 . 1 1 660 660 VAL N N 660 119.240 119.240 120.980 -1.740 18804 2244 1 10 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.627 -0.139 18804 2245 1 10 . 1 1 660 660 VAL C C 660 176.494 176.494 177.668 -1.174 18804 2246 1 10 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.565 -0.215 18804 2247 1 10 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.689 -0.299 18804 2248 1 10 . 1 1 660 660 VAL H H 660 8.220 8.220 8.018 0.202 18804 2249 1 10 . 1 1 661 661 ALA N N 661 121.414 121.414 122.413 -0.999 18804 2250 1 10 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.023 -0.131 18804 2251 1 10 . 1 1 661 661 ALA C C 661 178.419 178.419 179.818 -1.399 18804 2252 1 10 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.321 -0.226 18804 2253 1 10 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.156 -0.857 18804 2254 1 10 . 1 1 661 661 ALA H H 661 8.562 8.562 7.800 0.762 18804 2255 1 10 . 1 1 662 662 LEU N N 662 117.019 117.019 118.813 -1.794 18804 2256 1 10 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.880 0.097 18804 2257 1 10 . 1 1 662 662 LEU C C 662 178.078 178.078 179.196 -1.118 18804 2258 1 10 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.606 -0.290 18804 2259 1 10 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.672 -0.633 18804 2260 1 10 . 1 1 662 662 LEU H H 662 8.460 8.460 7.953 0.507 18804 2261 1 10 . 1 1 663 663 GLY N N 663 106.924 106.924 107.263 -0.339 18804 2262 1 10 . 1 1 663 663 GLY C C 663 174.372 174.372 176.131 -1.759 18804 2263 1 10 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.293 -0.194 18804 2264 1 10 . 1 1 663 663 GLY H H 663 8.683 8.683 8.011 0.672 18804 2265 1 10 . 1 1 664 664 ILE N N 664 121.523 121.523 122.740 -1.217 18804 2266 1 10 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.661 0.038 18804 2267 1 10 . 1 1 664 664 ILE C C 664 177.614 177.614 178.087 -0.473 18804 2268 1 10 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.103 -0.068 18804 2269 1 10 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.671 -0.839 18804 2270 1 10 . 1 1 664 664 ILE H H 664 8.750 8.750 8.078 0.672 18804 2271 1 10 . 1 1 665 665 GLY N N 665 107.803 107.803 108.461 -0.658 18804 2272 1 10 . 1 1 665 665 GLY C C 665 174.402 174.402 176.254 -1.852 18804 2273 1 10 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.350 -0.141 18804 2274 1 10 . 1 1 665 665 GLY H H 665 8.689 8.689 8.139 0.550 18804 2275 1 10 . 1 1 666 666 LEU N N 666 121.365 121.365 122.097 -0.732 18804 2276 1 10 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.050 -0.015 18804 2277 1 10 . 1 1 666 666 LEU C C 666 178.291 178.291 178.894 -0.603 18804 2278 1 10 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.117 0.214 18804 2279 1 10 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.787 -0.567 18804 2280 1 10 . 1 1 666 666 LEU H H 666 8.744 8.744 7.900 0.844 18804 2281 1 10 . 1 1 667 667 PHE N N 667 119.838 119.838 121.372 -1.534 18804 2282 1 10 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.128 -0.037 18804 2283 1 10 . 1 1 667 667 PHE C C 667 176.965 176.965 177.951 -0.986 18804 2284 1 10 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.447 -0.416 18804 2285 1 10 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.486 -0.725 18804 2286 1 10 . 1 1 667 667 PHE H H 667 8.454 8.454 8.424 0.030 18804 2287 1 10 . 1 1 668 668 MET N N 668 116.868 116.868 117.935 -1.067 18804 2288 1 10 . 1 1 668 668 MET HA H 668 4.035 4.035 3.998 0.037 18804 2289 1 10 . 1 1 668 668 MET C C 668 177.678 177.678 178.419 -0.741 18804 2290 1 10 . 1 1 668 668 MET CA C 668 57.405 57.405 58.971 -1.566 18804 2291 1 10 . 1 1 668 668 MET CB C 668 31.739 31.739 32.334 -0.595 18804 2292 1 10 . 1 1 668 668 MET H H 668 8.701 8.701 8.697 0.004 18804 2293 1 10 . 1 1 669 669 ARG N N 669 118.600 118.600 116.589 2.011 18804 2294 1 10 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.111 0.024 18804 2295 1 10 . 1 1 669 669 ARG C C 669 177.120 177.120 176.689 0.431 18804 2296 1 10 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.095 -0.843 18804 2297 1 10 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.561 -1.057 18804 2298 1 10 . 1 1 669 669 ARG H H 669 8.044 8.044 7.586 0.458 18804 2299 1 10 . 1 1 670 670 ARG N N 670 118.124 118.124 119.918 -1.794 18804 2300 1 10 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.408 -0.283 18804 2301 1 10 . 1 1 670 670 ARG C C 670 176.240 176.240 174.393 1.847 18804 2302 1 10 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.459 2.280 18804 2303 1 10 . 1 1 670 670 ARG CB C 670 29.467 29.467 29.781 -0.314 18804 2304 1 10 . 1 1 670 670 ARG H H 670 7.864 7.864 7.377 0.487 18804 2305 1 10 . 1 1 671 671 ARG N N 671 117.904 117.904 121.366 -3.462 18804 2306 1 10 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.229 -0.143 18804 2307 1 10 . 1 1 671 671 ARG C C 671 175.233 175.233 175.066 0.167 18804 2308 1 10 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.194 0.537 18804 2309 1 10 . 1 1 671 671 ARG CB C 671 29.494 29.494 33.224 -3.730 18804 2310 1 10 . 1 1 671 671 ARG H H 671 7.677 7.677 8.295 -0.618 18804 2311 1 10 . 1 1 672 672 HIS N N 672 117.048 117.048 122.305 -5.257 18804 2312 1 10 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.532 0.071 18804 2313 1 10 . 1 1 672 672 HIS C C 672 173.634 173.634 174.876 -1.242 18804 2314 1 10 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.925 -1.083 18804 2315 1 10 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.929 -1.743 18804 2316 1 10 . 1 1 672 672 HIS H H 672 7.920 7.920 8.250 -0.330 18804 2317 1 10 . 1 1 673 673 ILE N N 673 120.795 120.795 125.657 -4.862 18804 2318 1 10 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.346 -0.272 18804 2319 1 10 . 1 1 673 673 ILE C C 673 174.922 174.922 175.461 -0.539 18804 2320 1 10 . 1 1 673 673 ILE CA C 673 60.777 60.777 59.583 1.194 18804 2321 1 10 . 1 1 673 673 ILE CB C 673 37.836 37.836 39.039 -1.203 18804 2322 1 10 . 1 1 673 673 ILE H H 673 7.900 7.900 8.490 -0.590 18804 2323 1 10 . 1 1 674 674 VAL N N 674 122.867 122.867 125.633 -2.766 18804 2324 1 10 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.103 -0.022 18804 2325 1 10 . 1 1 674 674 VAL C C 674 174.876 174.876 176.116 -1.240 18804 2326 1 10 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.434 -1.064 18804 2327 1 10 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.587 -0.593 18804 2328 1 10 . 1 1 674 674 VAL H H 674 8.003 8.003 8.242 -0.239 18804 2329 1 10 . 1 1 675 675 ARG N N 675 124.866 124.866 125.912 -1.046 18804 2330 1 10 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.684 -0.627 18804 2331 1 10 . 1 1 675 675 ARG C C 675 174.922 174.922 175.024 -0.102 18804 2332 1 10 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.052 0.132 18804 2333 1 10 . 1 1 675 675 ARG CB C 675 30.316 30.316 32.544 -2.228 18804 2334 1 10 . 1 1 675 675 ARG H H 675 8.266 8.266 8.410 -0.144 18804 2335 1 10 . 1 1 676 676 LYS N N 676 123.517 123.517 121.553 1.964 18804 2336 1 10 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.452 -0.187 18804 2337 1 10 . 1 1 676 676 LYS C C 676 174.625 174.625 176.768 -2.143 18804 2338 1 10 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.664 0.089 18804 2339 1 10 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.126 -2.845 18804 2340 1 10 . 1 1 676 676 LYS H H 676 8.260 8.260 8.369 -0.109 18804 2341 1 11 . 1 1 635 635 GLY N N 635 108.817 108.817 110.413 -1.596 18804 2342 1 11 . 1 1 635 635 GLY C C 635 172.499 172.499 173.508 -1.009 18804 2343 1 11 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.492 -0.223 18804 2344 1 11 . 1 1 635 635 GLY H H 635 8.390 8.390 8.332 0.058 18804 2345 1 11 . 1 1 636 636 CYS N N 636 120.634 120.634 119.449 1.185 18804 2346 1 11 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.215 0.807 18804 2347 1 11 . 1 1 636 636 CYS C C 636 172.181 172.181 174.575 -2.394 18804 2348 1 11 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.198 -5.604 18804 2349 1 11 . 1 1 636 636 CYS CB C 636 39.488 39.488 27.918 11.570 18804 2350 1 11 . 1 1 636 636 CYS H H 636 8.327 8.327 8.215 0.112 18804 2351 1 11 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.366 0.134 18804 2352 1 11 . 1 1 637 637 PRO C C 637 176.215 176.215 176.560 -0.345 18804 2353 1 11 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.424 -1.746 18804 2354 1 11 . 1 1 637 637 PRO CB C 637 31.342 31.342 32.139 -0.797 18804 2355 1 11 . 1 1 638 638 THR N N 638 113.690 113.690 111.432 2.258 18804 2356 1 11 . 1 1 638 638 THR HA H 638 4.305 4.305 4.480 -0.175 18804 2357 1 11 . 1 1 638 638 THR C C 638 173.495 173.495 173.001 0.494 18804 2358 1 11 . 1 1 638 638 THR CA C 638 60.998 60.998 61.727 -0.729 18804 2359 1 11 . 1 1 638 638 THR CB C 638 68.954 68.954 69.026 -0.072 18804 2360 1 11 . 1 1 638 638 THR H H 638 8.114 8.114 7.825 0.289 18804 2361 1 11 . 1 1 639 639 ASN N N 639 120.695 120.695 120.936 -0.241 18804 2362 1 11 . 1 1 639 639 ASN HA H 639 4.773 4.773 5.036 -0.263 18804 2363 1 11 . 1 1 639 639 ASN C C 639 174.216 174.216 174.592 -0.376 18804 2364 1 11 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.925 -0.568 18804 2365 1 11 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.456 -0.875 18804 2366 1 11 . 1 1 639 639 ASN H H 639 8.301 8.301 8.166 0.135 18804 2367 1 11 . 1 1 640 640 GLY N N 640 108.827 108.827 108.319 0.508 18804 2368 1 11 . 1 1 640 640 GLY C C 640 170.506 170.506 171.901 -1.395 18804 2369 1 11 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.854 -0.999 18804 2370 1 11 . 1 1 640 640 GLY H H 640 8.111 8.111 8.300 -0.189 18804 2371 1 11 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.464 -0.012 18804 2372 1 11 . 1 1 641 641 PRO C C 641 175.669 175.669 176.066 -0.397 18804 2373 1 11 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.866 -0.791 18804 2374 1 11 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.131 -0.643 18804 2375 1 11 . 1 1 642 642 LYS N N 642 121.521 121.521 123.595 -2.074 18804 2376 1 11 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.575 -0.249 18804 2377 1 11 . 1 1 642 642 LYS C C 642 175.106 175.106 175.680 -0.574 18804 2378 1 11 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.392 -1.289 18804 2379 1 11 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.619 -2.249 18804 2380 1 11 . 1 1 642 642 LYS H H 642 8.417 8.417 8.309 0.108 18804 2381 1 11 . 1 1 643 643 ILE N N 643 121.410 121.410 126.208 -4.798 18804 2382 1 11 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.478 -0.143 18804 2383 1 11 . 1 1 643 643 ILE C C 643 173.587 173.587 174.740 -1.153 18804 2384 1 11 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.424 -1.550 18804 2385 1 11 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.051 -0.433 18804 2386 1 11 . 1 1 643 643 ILE H H 643 8.069 8.069 8.449 -0.380 18804 2387 1 11 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.567 -0.114 18804 2388 1 11 . 1 1 644 644 PRO C C 644 175.623 175.623 177.722 -2.099 18804 2389 1 11 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.425 0.034 18804 2390 1 11 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.379 -0.871 18804 2391 1 11 . 1 1 645 645 SER N N 645 115.445 115.445 114.036 1.409 18804 2392 1 11 . 1 1 645 645 SER HA H 645 4.374 4.374 4.276 0.098 18804 2393 1 11 . 1 1 645 645 SER C C 645 174.611 174.611 176.128 -1.517 18804 2394 1 11 . 1 1 645 645 SER CA C 645 58.566 58.566 60.530 -1.964 18804 2395 1 11 . 1 1 645 645 SER CB C 645 62.842 62.842 62.637 0.205 18804 2396 1 11 . 1 1 645 645 SER H H 645 8.267 8.267 8.508 -0.241 18804 2397 1 11 . 1 1 646 646 ILE N N 646 120.612 120.612 121.406 -0.794 18804 2398 1 11 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.817 0.292 18804 2399 1 11 . 1 1 646 646 ILE C C 646 174.703 174.703 176.992 -2.289 18804 2400 1 11 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.643 -1.421 18804 2401 1 11 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.969 0.691 18804 2402 1 11 . 1 1 646 646 ILE H H 646 8.252 8.252 7.923 0.329 18804 2403 1 11 . 1 1 647 647 ALA N N 647 123.224 123.224 123.549 -0.325 18804 2404 1 11 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.878 0.285 18804 2405 1 11 . 1 1 647 647 ALA C C 647 176.526 176.526 179.125 -2.599 18804 2406 1 11 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.182 -1.998 18804 2407 1 11 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.037 0.212 18804 2408 1 11 . 1 1 647 647 ALA H H 647 8.084 8.084 7.675 0.409 18804 2409 1 11 . 1 1 648 648 THR N N 648 111.699 111.699 114.598 -2.899 18804 2410 1 11 . 1 1 648 648 THR HA H 648 4.021 4.021 3.904 0.117 18804 2411 1 11 . 1 1 648 648 THR C C 648 175.018 175.018 177.056 -2.038 18804 2412 1 11 . 1 1 648 648 THR CA C 648 63.554 63.554 66.743 -3.188 18804 2413 1 11 . 1 1 648 648 THR CB C 648 68.098 68.098 68.163 -0.065 18804 2414 1 11 . 1 1 648 648 THR H H 648 7.757 7.757 7.744 0.013 18804 2415 1 11 . 1 1 649 649 GLY N N 649 108.587 108.587 109.425 -0.838 18804 2416 1 11 . 1 1 649 649 GLY C C 649 173.686 173.686 176.154 -2.468 18804 2417 1 11 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.771 -0.827 18804 2418 1 11 . 1 1 649 649 GLY H H 649 8.423 8.423 7.879 0.544 18804 2419 1 11 . 1 1 650 650 MET N N 650 119.486 119.486 121.684 -2.198 18804 2420 1 11 . 1 1 650 650 MET HA H 650 4.135 4.135 4.257 -0.122 18804 2421 1 11 . 1 1 650 650 MET C C 650 176.632 176.632 178.630 -1.998 18804 2422 1 11 . 1 1 650 650 MET CA C 650 57.749 57.749 57.037 0.712 18804 2423 1 11 . 1 1 650 650 MET CB C 650 32.067 32.067 31.614 0.453 18804 2424 1 11 . 1 1 650 650 MET H H 650 8.332 8.332 7.559 0.773 18804 2425 1 11 . 1 1 651 651 VAL N N 651 118.009 118.009 118.805 -0.796 18804 2426 1 11 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.643 -0.103 18804 2427 1 11 . 1 1 651 651 VAL C C 651 176.672 176.672 178.235 -1.563 18804 2428 1 11 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.528 -1.249 18804 2429 1 11 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.695 -0.397 18804 2430 1 11 . 1 1 651 651 VAL H H 651 8.038 8.038 8.829 -0.791 18804 2431 1 11 . 1 1 652 652 GLY N N 652 105.785 105.785 106.968 -1.183 18804 2432 1 11 . 1 1 652 652 GLY C C 652 173.359 173.359 175.480 -2.121 18804 2433 1 11 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.252 -0.264 18804 2434 1 11 . 1 1 652 652 GLY H H 652 8.157 8.157 8.017 0.140 18804 2435 1 11 . 1 1 653 653 ALA N N 653 121.803 121.803 125.032 -3.229 18804 2436 1 11 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.201 -0.274 18804 2437 1 11 . 1 1 653 653 ALA C C 653 177.608 177.608 179.614 -2.006 18804 2438 1 11 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.645 0.002 18804 2439 1 11 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.346 -0.789 18804 2440 1 11 . 1 1 653 653 ALA H H 653 8.050 8.050 7.819 0.231 18804 2441 1 11 . 1 1 654 654 LEU N N 654 116.652 116.652 119.780 -3.128 18804 2442 1 11 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.867 0.085 18804 2443 1 11 . 1 1 654 654 LEU C C 654 177.361 177.361 179.145 -1.784 18804 2444 1 11 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.193 -0.931 18804 2445 1 11 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.775 -0.872 18804 2446 1 11 . 1 1 654 654 LEU H H 654 7.919 7.919 8.430 -0.511 18804 2447 1 11 . 1 1 655 655 LEU N N 655 117.910 117.910 118.642 -0.732 18804 2448 1 11 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.932 0.005 18804 2449 1 11 . 1 1 655 655 LEU C C 655 177.353 177.353 179.194 -1.841 18804 2450 1 11 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.904 -0.389 18804 2451 1 11 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.593 -0.783 18804 2452 1 11 . 1 1 655 655 LEU H H 655 8.189 8.189 8.055 0.134 18804 2453 1 11 . 1 1 656 656 LEU N N 656 118.140 118.140 119.240 -1.100 18804 2454 1 11 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.913 -0.004 18804 2455 1 11 . 1 1 656 656 LEU C C 656 177.304 177.304 179.223 -1.919 18804 2456 1 11 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.788 -0.291 18804 2457 1 11 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.643 -0.882 18804 2458 1 11 . 1 1 656 656 LEU H H 656 8.022 8.022 7.641 0.381 18804 2459 1 11 . 1 1 657 657 LEU N N 657 118.079 118.079 119.864 -1.785 18804 2460 1 11 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.865 -0.027 18804 2461 1 11 . 1 1 657 657 LEU C C 657 177.304 177.304 179.027 -1.723 18804 2462 1 11 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.184 -0.608 18804 2463 1 11 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.619 -0.823 18804 2464 1 11 . 1 1 657 657 LEU H H 657 8.073 8.073 8.212 -0.139 18804 2465 1 11 . 1 1 658 658 LEU N N 658 118.238 118.238 119.082 -0.844 18804 2466 1 11 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.905 0.018 18804 2467 1 11 . 1 1 658 658 LEU C C 658 177.353 177.353 179.165 -1.812 18804 2468 1 11 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.027 -0.518 18804 2469 1 11 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.625 -0.736 18804 2470 1 11 . 1 1 658 658 LEU H H 658 8.148 8.148 7.741 0.407 18804 2471 1 11 . 1 1 659 659 VAL N N 659 117.951 117.951 118.664 -0.713 18804 2472 1 11 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.681 -0.177 18804 2473 1 11 . 1 1 659 659 VAL C C 659 176.888 176.888 178.089 -1.201 18804 2474 1 11 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.085 0.407 18804 2475 1 11 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.862 -0.490 18804 2476 1 11 . 1 1 659 659 VAL H H 659 8.150 8.150 7.740 0.410 18804 2477 1 11 . 1 1 660 660 VAL N N 660 119.240 119.240 120.336 -1.096 18804 2478 1 11 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.537 -0.048 18804 2479 1 11 . 1 1 660 660 VAL C C 660 176.494 176.494 177.524 -1.030 18804 2480 1 11 . 1 1 660 660 VAL CA C 660 66.350 66.350 67.055 -0.704 18804 2481 1 11 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.190 -0.800 18804 2482 1 11 . 1 1 660 660 VAL H H 660 8.220 8.220 7.927 0.293 18804 2483 1 11 . 1 1 661 661 ALA N N 661 121.414 121.414 122.679 -1.265 18804 2484 1 11 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.012 -0.120 18804 2485 1 11 . 1 1 661 661 ALA C C 661 178.419 178.419 179.587 -1.168 18804 2486 1 11 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.361 -0.266 18804 2487 1 11 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.164 -0.865 18804 2488 1 11 . 1 1 661 661 ALA H H 661 8.562 8.562 7.821 0.741 18804 2489 1 11 . 1 1 662 662 LEU N N 662 117.019 117.019 118.916 -1.897 18804 2490 1 11 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.868 0.109 18804 2491 1 11 . 1 1 662 662 LEU C C 662 178.078 178.078 179.232 -1.154 18804 2492 1 11 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.720 -0.404 18804 2493 1 11 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.671 -0.632 18804 2494 1 11 . 1 1 662 662 LEU H H 662 8.460 8.460 7.957 0.503 18804 2495 1 11 . 1 1 663 663 GLY N N 663 106.924 106.924 107.166 -0.242 18804 2496 1 11 . 1 1 663 663 GLY C C 663 174.372 174.372 176.152 -1.780 18804 2497 1 11 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.264 -0.165 18804 2498 1 11 . 1 1 663 663 GLY H H 663 8.683 8.683 7.911 0.772 18804 2499 1 11 . 1 1 664 664 ILE N N 664 121.523 121.523 122.786 -1.263 18804 2500 1 11 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.679 0.020 18804 2501 1 11 . 1 1 664 664 ILE C C 664 177.614 177.614 178.102 -0.488 18804 2502 1 11 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.045 -0.010 18804 2503 1 11 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.685 -0.853 18804 2504 1 11 . 1 1 664 664 ILE H H 664 8.750 8.750 8.073 0.677 18804 2505 1 11 . 1 1 665 665 GLY N N 665 107.803 107.803 108.445 -0.642 18804 2506 1 11 . 1 1 665 665 GLY C C 665 174.402 174.402 176.166 -1.764 18804 2507 1 11 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.372 -0.163 18804 2508 1 11 . 1 1 665 665 GLY H H 665 8.689 8.689 8.279 0.410 18804 2509 1 11 . 1 1 666 666 LEU N N 666 121.365 121.365 122.039 -0.674 18804 2510 1 11 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.061 -0.026 18804 2511 1 11 . 1 1 666 666 LEU C C 666 178.291 178.291 178.937 -0.646 18804 2512 1 11 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.071 0.260 18804 2513 1 11 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.799 -0.579 18804 2514 1 11 . 1 1 666 666 LEU H H 666 8.744 8.744 7.915 0.829 18804 2515 1 11 . 1 1 667 667 PHE N N 667 119.838 119.838 121.267 -1.429 18804 2516 1 11 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.161 -0.070 18804 2517 1 11 . 1 1 667 667 PHE C C 667 176.965 176.965 176.832 0.133 18804 2518 1 11 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.514 -0.483 18804 2519 1 11 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.438 -0.677 18804 2520 1 11 . 1 1 667 667 PHE H H 667 8.454 8.454 8.446 0.008 18804 2521 1 11 . 1 1 668 668 MET N N 668 116.868 116.868 116.512 0.356 18804 2522 1 11 . 1 1 668 668 MET HA H 668 4.035 4.035 3.963 0.072 18804 2523 1 11 . 1 1 668 668 MET C C 668 177.678 177.678 178.472 -0.794 18804 2524 1 11 . 1 1 668 668 MET CA C 668 57.405 57.405 59.099 -1.694 18804 2525 1 11 . 1 1 668 668 MET CB C 668 31.739 31.739 32.689 -0.950 18804 2526 1 11 . 1 1 668 668 MET H H 668 8.701 8.701 8.383 0.318 18804 2527 1 11 . 1 1 669 669 ARG N N 669 118.600 118.600 116.396 2.204 18804 2528 1 11 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.065 0.070 18804 2529 1 11 . 1 1 669 669 ARG C C 669 177.120 177.120 177.071 0.049 18804 2530 1 11 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.403 -0.151 18804 2531 1 11 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.543 -1.039 18804 2532 1 11 . 1 1 669 669 ARG H H 669 8.044 8.044 7.645 0.399 18804 2533 1 11 . 1 1 670 670 ARG N N 670 118.124 118.124 116.106 2.018 18804 2534 1 11 . 1 1 670 670 ARG HA H 670 4.125 4.125 3.936 0.189 18804 2535 1 11 . 1 1 670 670 ARG C C 670 176.240 176.240 174.830 1.410 18804 2536 1 11 . 1 1 670 670 ARG CA C 670 56.738 56.738 56.643 0.095 18804 2537 1 11 . 1 1 670 670 ARG CB C 670 29.467 29.467 27.530 1.937 18804 2538 1 11 . 1 1 670 670 ARG H H 670 7.864 7.864 7.744 0.120 18804 2539 1 11 . 1 1 671 671 ARG N N 671 117.904 117.904 120.342 -2.438 18804 2540 1 11 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.317 -0.231 18804 2541 1 11 . 1 1 671 671 ARG C C 671 175.233 175.233 174.775 0.458 18804 2542 1 11 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.793 -0.062 18804 2543 1 11 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.183 -0.689 18804 2544 1 11 . 1 1 671 671 ARG H H 671 7.677 7.677 7.498 0.179 18804 2545 1 11 . 1 1 672 672 HIS N N 672 117.048 117.048 122.758 -5.710 18804 2546 1 11 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.753 -0.150 18804 2547 1 11 . 1 1 672 672 HIS C C 672 173.634 173.634 175.057 -1.423 18804 2548 1 11 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.203 -0.362 18804 2549 1 11 . 1 1 672 672 HIS CB C 672 28.186 28.186 32.519 -4.333 18804 2550 1 11 . 1 1 672 672 HIS H H 672 7.920 7.920 8.443 -0.523 18804 2551 1 11 . 1 1 673 673 ILE N N 673 120.795 120.795 124.377 -3.582 18804 2552 1 11 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.184 -0.110 18804 2553 1 11 . 1 1 673 673 ILE C C 673 174.922 174.922 175.522 -0.600 18804 2554 1 11 . 1 1 673 673 ILE CA C 673 60.777 60.777 61.868 -1.091 18804 2555 1 11 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.227 -0.391 18804 2556 1 11 . 1 1 673 673 ILE H H 673 7.900 7.900 8.690 -0.790 18804 2557 1 11 . 1 1 674 674 VAL N N 674 122.867 122.867 125.601 -2.734 18804 2558 1 11 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.119 -0.038 18804 2559 1 11 . 1 1 674 674 VAL C C 674 174.876 174.876 176.080 -1.204 18804 2560 1 11 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.608 -1.238 18804 2561 1 11 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.329 -0.335 18804 2562 1 11 . 1 1 674 674 VAL H H 674 8.003 8.003 8.685 -0.682 18804 2563 1 11 . 1 1 675 675 ARG N N 675 124.866 124.866 123.432 1.434 18804 2564 1 11 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.258 -0.201 18804 2565 1 11 . 1 1 675 675 ARG C C 675 174.922 174.922 175.702 -0.780 18804 2566 1 11 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.693 -1.509 18804 2567 1 11 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.856 -0.540 18804 2568 1 11 . 1 1 675 675 ARG H H 675 8.266 8.266 8.040 0.226 18804 2569 1 11 . 1 1 676 676 LYS N N 676 123.517 123.517 126.039 -2.522 18804 2570 1 11 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.469 -0.204 18804 2571 1 11 . 1 1 676 676 LYS C C 676 174.625 174.625 175.903 -1.278 18804 2572 1 11 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.019 0.734 18804 2573 1 11 . 1 1 676 676 LYS CB C 676 30.281 30.281 34.228 -3.947 18804 2574 1 11 . 1 1 676 676 LYS H H 676 8.260 8.260 8.279 -0.019 18804 2575 1 12 . 1 1 635 635 GLY N N 635 108.817 108.817 110.949 -2.132 18804 2576 1 12 . 1 1 635 635 GLY C C 635 172.499 172.499 173.732 -1.233 18804 2577 1 12 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.214 0.055 18804 2578 1 12 . 1 1 635 635 GLY H H 635 8.390 8.390 8.839 -0.449 18804 2579 1 12 . 1 1 636 636 CYS N N 636 120.634 120.634 120.976 -0.342 18804 2580 1 12 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.277 0.745 18804 2581 1 12 . 1 1 636 636 CYS C C 636 172.181 172.181 174.600 -2.419 18804 2582 1 12 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.257 -5.663 18804 2583 1 12 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.502 10.986 18804 2584 1 12 . 1 1 636 636 CYS H H 636 8.327 8.327 8.207 0.120 18804 2585 1 12 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.479 0.021 18804 2586 1 12 . 1 1 637 637 PRO C C 637 176.215 176.215 176.313 -0.098 18804 2587 1 12 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.541 -1.863 18804 2588 1 12 . 1 1 637 637 PRO CB C 637 31.342 31.342 32.093 -0.751 18804 2589 1 12 . 1 1 638 638 THR N N 638 113.690 113.690 111.303 2.387 18804 2590 1 12 . 1 1 638 638 THR HA H 638 4.305 4.305 4.403 -0.098 18804 2591 1 12 . 1 1 638 638 THR C C 638 173.495 173.495 172.980 0.515 18804 2592 1 12 . 1 1 638 638 THR CA C 638 60.998 60.998 61.720 -0.722 18804 2593 1 12 . 1 1 638 638 THR CB C 638 68.954 68.954 68.972 -0.018 18804 2594 1 12 . 1 1 638 638 THR H H 638 8.114 8.114 7.699 0.415 18804 2595 1 12 . 1 1 639 639 ASN N N 639 120.695 120.695 123.588 -2.893 18804 2596 1 12 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.967 -0.194 18804 2597 1 12 . 1 1 639 639 ASN C C 639 174.216 174.216 174.955 -0.739 18804 2598 1 12 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.426 -1.069 18804 2599 1 12 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.044 -0.463 18804 2600 1 12 . 1 1 639 639 ASN H H 639 8.301 8.301 8.817 -0.516 18804 2601 1 12 . 1 1 640 640 GLY N N 640 108.827 108.827 111.455 -2.628 18804 2602 1 12 . 1 1 640 640 GLY C C 640 170.506 170.506 172.245 -1.739 18804 2603 1 12 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.792 -0.937 18804 2604 1 12 . 1 1 640 640 GLY H H 640 8.111 8.111 8.400 -0.289 18804 2605 1 12 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.609 -0.157 18804 2606 1 12 . 1 1 641 641 PRO C C 641 175.669 175.669 176.023 -0.354 18804 2607 1 12 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.805 -0.730 18804 2608 1 12 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.364 -0.876 18804 2609 1 12 . 1 1 642 642 LYS N N 642 121.521 121.521 123.228 -1.707 18804 2610 1 12 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.508 -0.182 18804 2611 1 12 . 1 1 642 642 LYS C C 642 175.106 175.106 175.220 -0.114 18804 2612 1 12 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.080 -0.977 18804 2613 1 12 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.723 -2.353 18804 2614 1 12 . 1 1 642 642 LYS H H 642 8.417 8.417 8.206 0.211 18804 2615 1 12 . 1 1 643 643 ILE N N 643 121.410 121.410 125.842 -4.432 18804 2616 1 12 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.458 -0.123 18804 2617 1 12 . 1 1 643 643 ILE C C 643 173.587 173.587 174.631 -1.044 18804 2618 1 12 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.700 -1.826 18804 2619 1 12 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.731 -0.113 18804 2620 1 12 . 1 1 643 643 ILE H H 643 8.069 8.069 8.458 -0.389 18804 2621 1 12 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.563 -0.110 18804 2622 1 12 . 1 1 644 644 PRO C C 644 175.623 175.623 177.680 -2.057 18804 2623 1 12 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.409 0.050 18804 2624 1 12 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.393 -0.885 18804 2625 1 12 . 1 1 645 645 SER N N 645 115.445 115.445 113.914 1.531 18804 2626 1 12 . 1 1 645 645 SER HA H 645 4.374 4.374 4.276 0.098 18804 2627 1 12 . 1 1 645 645 SER C C 645 174.611 174.611 176.093 -1.482 18804 2628 1 12 . 1 1 645 645 SER CA C 645 58.566 58.566 60.667 -2.102 18804 2629 1 12 . 1 1 645 645 SER CB C 645 62.842 62.842 62.699 0.143 18804 2630 1 12 . 1 1 645 645 SER H H 645 8.267 8.267 8.540 -0.273 18804 2631 1 12 . 1 1 646 646 ILE N N 646 120.612 120.612 121.922 -1.310 18804 2632 1 12 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.834 0.275 18804 2633 1 12 . 1 1 646 646 ILE C C 646 174.703 174.703 176.928 -2.225 18804 2634 1 12 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.622 -1.400 18804 2635 1 12 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.044 0.617 18804 2636 1 12 . 1 1 646 646 ILE H H 646 8.252 8.252 7.894 0.358 18804 2637 1 12 . 1 1 647 647 ALA N N 647 123.224 123.224 123.270 -0.046 18804 2638 1 12 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.858 0.305 18804 2639 1 12 . 1 1 647 647 ALA C C 647 176.526 176.526 179.212 -2.686 18804 2640 1 12 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.307 -2.123 18804 2641 1 12 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.033 0.216 18804 2642 1 12 . 1 1 647 647 ALA H H 647 8.084 8.084 7.621 0.463 18804 2643 1 12 . 1 1 648 648 THR N N 648 111.699 111.699 114.213 -2.514 18804 2644 1 12 . 1 1 648 648 THR HA H 648 4.021 4.021 3.873 0.148 18804 2645 1 12 . 1 1 648 648 THR C C 648 175.018 175.018 176.937 -1.919 18804 2646 1 12 . 1 1 648 648 THR CA C 648 63.554 63.554 67.270 -3.716 18804 2647 1 12 . 1 1 648 648 THR CB C 648 68.098 68.098 68.347 -0.249 18804 2648 1 12 . 1 1 648 648 THR H H 648 7.757 7.757 7.733 0.024 18804 2649 1 12 . 1 1 649 649 GLY N N 649 108.587 108.587 109.721 -1.134 18804 2650 1 12 . 1 1 649 649 GLY C C 649 173.686 173.686 176.305 -2.619 18804 2651 1 12 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.810 -0.867 18804 2652 1 12 . 1 1 649 649 GLY H H 649 8.423 8.423 7.887 0.536 18804 2653 1 12 . 1 1 650 650 MET N N 650 119.486 119.486 121.684 -2.198 18804 2654 1 12 . 1 1 650 650 MET HA H 650 4.135 4.135 4.278 -0.143 18804 2655 1 12 . 1 1 650 650 MET C C 650 176.632 176.632 178.614 -1.982 18804 2656 1 12 . 1 1 650 650 MET CA C 650 57.749 57.749 56.939 0.810 18804 2657 1 12 . 1 1 650 650 MET CB C 650 32.067 32.067 31.605 0.462 18804 2658 1 12 . 1 1 650 650 MET H H 650 8.332 8.332 7.556 0.776 18804 2659 1 12 . 1 1 651 651 VAL N N 651 118.009 118.009 118.865 -0.856 18804 2660 1 12 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.645 -0.105 18804 2661 1 12 . 1 1 651 651 VAL C C 651 176.672 176.672 178.264 -1.592 18804 2662 1 12 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.529 -1.250 18804 2663 1 12 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.719 -0.421 18804 2664 1 12 . 1 1 651 651 VAL H H 651 8.038 8.038 8.883 -0.846 18804 2665 1 12 . 1 1 652 652 GLY N N 652 105.785 105.785 106.953 -1.168 18804 2666 1 12 . 1 1 652 652 GLY C C 652 173.359 173.359 175.450 -2.091 18804 2667 1 12 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.240 -0.252 18804 2668 1 12 . 1 1 652 652 GLY H H 652 8.157 8.157 8.033 0.124 18804 2669 1 12 . 1 1 653 653 ALA N N 653 121.803 121.803 125.021 -3.218 18804 2670 1 12 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.203 -0.276 18804 2671 1 12 . 1 1 653 653 ALA C C 653 177.608 177.608 179.614 -2.006 18804 2672 1 12 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.643 0.004 18804 2673 1 12 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.340 -0.783 18804 2674 1 12 . 1 1 653 653 ALA H H 653 8.050 8.050 7.790 0.260 18804 2675 1 12 . 1 1 654 654 LEU N N 654 116.652 116.652 119.770 -3.118 18804 2676 1 12 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.866 0.086 18804 2677 1 12 . 1 1 654 654 LEU C C 654 177.361 177.361 179.149 -1.788 18804 2678 1 12 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.193 -0.930 18804 2679 1 12 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.763 -0.860 18804 2680 1 12 . 1 1 654 654 LEU H H 654 7.919 7.919 8.445 -0.526 18804 2681 1 12 . 1 1 655 655 LEU N N 655 117.910 117.910 118.660 -0.750 18804 2682 1 12 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.932 0.005 18804 2683 1 12 . 1 1 655 655 LEU C C 655 177.353 177.353 179.159 -1.806 18804 2684 1 12 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.884 -0.369 18804 2685 1 12 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.604 -0.794 18804 2686 1 12 . 1 1 655 655 LEU H H 655 8.189 8.189 7.966 0.223 18804 2687 1 12 . 1 1 656 656 LEU N N 656 118.140 118.140 119.310 -1.170 18804 2688 1 12 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.901 0.008 18804 2689 1 12 . 1 1 656 656 LEU C C 656 177.304 177.304 179.233 -1.929 18804 2690 1 12 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.859 -0.362 18804 2691 1 12 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.638 -0.877 18804 2692 1 12 . 1 1 656 656 LEU H H 656 8.022 8.022 7.639 0.383 18804 2693 1 12 . 1 1 657 657 LEU N N 657 118.079 118.079 119.721 -1.642 18804 2694 1 12 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.864 -0.026 18804 2695 1 12 . 1 1 657 657 LEU C C 657 177.304 177.304 178.995 -1.691 18804 2696 1 12 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.161 -0.585 18804 2697 1 12 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.596 -0.800 18804 2698 1 12 . 1 1 657 657 LEU H H 657 8.073 8.073 8.293 -0.220 18804 2699 1 12 . 1 1 658 658 LEU N N 658 118.238 118.238 119.050 -0.812 18804 2700 1 12 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.889 0.034 18804 2701 1 12 . 1 1 658 658 LEU C C 658 177.353 177.353 179.128 -1.775 18804 2702 1 12 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.212 -0.703 18804 2703 1 12 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.724 -0.835 18804 2704 1 12 . 1 1 658 658 LEU H H 658 8.148 8.148 7.711 0.437 18804 2705 1 12 . 1 1 659 659 VAL N N 659 117.951 117.951 118.490 -0.539 18804 2706 1 12 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.566 -0.062 18804 2707 1 12 . 1 1 659 659 VAL C C 659 176.888 176.888 177.997 -1.109 18804 2708 1 12 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.711 -0.219 18804 2709 1 12 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.481 -1.109 18804 2710 1 12 . 1 1 659 659 VAL H H 659 8.150 8.150 7.718 0.432 18804 2711 1 12 . 1 1 660 660 VAL N N 660 119.240 119.240 120.211 -0.971 18804 2712 1 12 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.519 -0.030 18804 2713 1 12 . 1 1 660 660 VAL C C 660 176.494 176.494 177.509 -1.015 18804 2714 1 12 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.859 -0.509 18804 2715 1 12 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.352 -0.962 18804 2716 1 12 . 1 1 660 660 VAL H H 660 8.220 8.220 7.873 0.347 18804 2717 1 12 . 1 1 661 661 ALA N N 661 121.414 121.414 122.575 -1.161 18804 2718 1 12 . 1 1 661 661 ALA HA H 661 3.892 3.892 3.931 -0.039 18804 2719 1 12 . 1 1 661 661 ALA C C 661 178.419 178.419 179.563 -1.144 18804 2720 1 12 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.381 -0.286 18804 2721 1 12 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.288 -0.989 18804 2722 1 12 . 1 1 661 661 ALA H H 661 8.562 8.562 7.939 0.623 18804 2723 1 12 . 1 1 662 662 LEU N N 662 117.019 117.019 118.810 -1.791 18804 2724 1 12 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.859 0.118 18804 2725 1 12 . 1 1 662 662 LEU C C 662 178.078 178.078 179.295 -1.217 18804 2726 1 12 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.760 -0.444 18804 2727 1 12 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.648 -0.609 18804 2728 1 12 . 1 1 662 662 LEU H H 662 8.460 8.460 7.962 0.498 18804 2729 1 12 . 1 1 663 663 GLY N N 663 106.924 106.924 107.183 -0.259 18804 2730 1 12 . 1 1 663 663 GLY C C 663 174.372 174.372 176.212 -1.840 18804 2731 1 12 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.101 -0.002 18804 2732 1 12 . 1 1 663 663 GLY H H 663 8.683 8.683 7.850 0.833 18804 2733 1 12 . 1 1 664 664 ILE N N 664 121.523 121.523 122.539 -1.016 18804 2734 1 12 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.684 0.015 18804 2735 1 12 . 1 1 664 664 ILE C C 664 177.614 177.614 178.112 -0.498 18804 2736 1 12 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.723 0.312 18804 2737 1 12 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.657 -0.825 18804 2738 1 12 . 1 1 664 664 ILE H H 664 8.750 8.750 8.493 0.257 18804 2739 1 12 . 1 1 665 665 GLY N N 665 107.803 107.803 108.783 -0.980 18804 2740 1 12 . 1 1 665 665 GLY C C 665 174.402 174.402 176.099 -1.697 18804 2741 1 12 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.300 -0.091 18804 2742 1 12 . 1 1 665 665 GLY H H 665 8.689 8.689 8.459 0.230 18804 2743 1 12 . 1 1 666 666 LEU N N 666 121.365 121.365 122.153 -0.788 18804 2744 1 12 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.027 0.008 18804 2745 1 12 . 1 1 666 666 LEU C C 666 178.291 178.291 178.927 -0.636 18804 2746 1 12 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.212 0.119 18804 2747 1 12 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.825 -0.605 18804 2748 1 12 . 1 1 666 666 LEU H H 666 8.744 8.744 7.788 0.956 18804 2749 1 12 . 1 1 667 667 PHE N N 667 119.838 119.838 120.749 -0.911 18804 2750 1 12 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.204 -0.113 18804 2751 1 12 . 1 1 667 667 PHE C C 667 176.965 176.965 177.682 -0.717 18804 2752 1 12 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.193 -0.162 18804 2753 1 12 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.704 -0.943 18804 2754 1 12 . 1 1 667 667 PHE H H 667 8.454 8.454 7.887 0.567 18804 2755 1 12 . 1 1 668 668 MET N N 668 116.868 116.868 117.813 -0.945 18804 2756 1 12 . 1 1 668 668 MET HA H 668 4.035 4.035 3.980 0.055 18804 2757 1 12 . 1 1 668 668 MET C C 668 177.678 177.678 177.743 -0.065 18804 2758 1 12 . 1 1 668 668 MET CA C 668 57.405 57.405 58.504 -1.099 18804 2759 1 12 . 1 1 668 668 MET CB C 668 31.739 31.739 32.299 -0.560 18804 2760 1 12 . 1 1 668 668 MET H H 668 8.701 8.701 8.661 0.040 18804 2761 1 12 . 1 1 669 669 ARG N N 669 118.600 118.600 116.479 2.121 18804 2762 1 12 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.082 0.053 18804 2763 1 12 . 1 1 669 669 ARG C C 669 177.120 177.120 176.744 0.376 18804 2764 1 12 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.545 -0.293 18804 2765 1 12 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.435 -0.931 18804 2766 1 12 . 1 1 669 669 ARG H H 669 8.044 8.044 7.742 0.302 18804 2767 1 12 . 1 1 670 670 ARG N N 670 118.124 118.124 117.385 0.739 18804 2768 1 12 . 1 1 670 670 ARG HA H 670 4.125 4.125 3.841 0.284 18804 2769 1 12 . 1 1 670 670 ARG C C 670 176.240 176.240 174.693 1.547 18804 2770 1 12 . 1 1 670 670 ARG CA C 670 56.738 56.738 56.735 0.003 18804 2771 1 12 . 1 1 670 670 ARG CB C 670 29.467 29.467 28.839 0.628 18804 2772 1 12 . 1 1 670 670 ARG H H 670 7.864 7.864 7.655 0.209 18804 2773 1 12 . 1 1 671 671 ARG N N 671 117.904 117.904 118.235 -0.331 18804 2774 1 12 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.347 -0.261 18804 2775 1 12 . 1 1 671 671 ARG C C 671 175.233 175.233 175.187 0.046 18804 2776 1 12 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.999 0.732 18804 2777 1 12 . 1 1 671 671 ARG CB C 671 29.494 29.494 32.051 -2.557 18804 2778 1 12 . 1 1 671 671 ARG H H 671 7.677 7.677 8.071 -0.394 18804 2779 1 12 . 1 1 672 672 HIS N N 672 117.048 117.048 121.383 -4.335 18804 2780 1 12 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.759 -0.156 18804 2781 1 12 . 1 1 672 672 HIS C C 672 173.634 173.634 175.471 -1.837 18804 2782 1 12 . 1 1 672 672 HIS CA C 672 54.841 54.841 54.523 0.318 18804 2783 1 12 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.858 -2.672 18804 2784 1 12 . 1 1 672 672 HIS H H 672 7.920 7.920 8.139 -0.219 18804 2785 1 12 . 1 1 673 673 ILE N N 673 120.795 120.795 122.820 -2.025 18804 2786 1 12 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.400 -0.326 18804 2787 1 12 . 1 1 673 673 ILE C C 673 174.922 174.922 175.425 -0.503 18804 2788 1 12 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.963 -0.186 18804 2789 1 12 . 1 1 673 673 ILE CB C 673 37.836 37.836 39.572 -1.736 18804 2790 1 12 . 1 1 673 673 ILE H H 673 7.900 7.900 8.375 -0.475 18804 2791 1 12 . 1 1 674 674 VAL N N 674 122.867 122.867 126.399 -3.532 18804 2792 1 12 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.306 -0.225 18804 2793 1 12 . 1 1 674 674 VAL C C 674 174.876 174.876 175.536 -0.660 18804 2794 1 12 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.522 -0.152 18804 2795 1 12 . 1 1 674 674 VAL CB C 674 31.994 31.994 33.052 -1.058 18804 2796 1 12 . 1 1 674 674 VAL H H 674 8.003 8.003 8.353 -0.350 18804 2797 1 12 . 1 1 675 675 ARG N N 675 124.866 124.866 125.479 -0.613 18804 2798 1 12 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.459 -0.402 18804 2799 1 12 . 1 1 675 675 ARG C C 675 174.922 174.922 176.075 -1.153 18804 2800 1 12 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.731 -0.547 18804 2801 1 12 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.890 -0.574 18804 2802 1 12 . 1 1 675 675 ARG H H 675 8.266 8.266 8.386 -0.120 18804 2803 1 12 . 1 1 676 676 LYS N N 676 123.517 123.517 124.607 -1.090 18804 2804 1 12 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.334 -0.069 18804 2805 1 12 . 1 1 676 676 LYS C C 676 174.625 174.625 177.201 -2.576 18804 2806 1 12 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.228 -0.475 18804 2807 1 12 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.631 -2.350 18804 2808 1 12 . 1 1 676 676 LYS H H 676 8.260 8.260 8.519 -0.259 18804 2809 1 13 . 1 1 635 635 GLY N N 635 108.817 108.817 110.584 -1.767 18804 2810 1 13 . 1 1 635 635 GLY C C 635 172.499 172.499 174.087 -1.588 18804 2811 1 13 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.522 -0.253 18804 2812 1 13 . 1 1 635 635 GLY H H 635 8.390 8.390 8.723 -0.333 18804 2813 1 13 . 1 1 636 636 CYS N N 636 120.634 120.634 120.888 -0.254 18804 2814 1 13 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.372 0.650 18804 2815 1 13 . 1 1 636 636 CYS C C 636 172.181 172.181 174.296 -2.115 18804 2816 1 13 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.286 -5.692 18804 2817 1 13 . 1 1 636 636 CYS CB C 636 39.488 39.488 27.571 11.917 18804 2818 1 13 . 1 1 636 636 CYS H H 636 8.327 8.327 8.528 -0.201 18804 2819 1 13 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.394 0.106 18804 2820 1 13 . 1 1 637 637 PRO C C 637 176.215 176.215 176.612 -0.397 18804 2821 1 13 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.033 -1.355 18804 2822 1 13 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.810 -0.468 18804 2823 1 13 . 1 1 638 638 THR N N 638 113.690 113.690 111.196 2.494 18804 2824 1 13 . 1 1 638 638 THR HA H 638 4.305 4.305 4.013 0.292 18804 2825 1 13 . 1 1 638 638 THR C C 638 173.495 173.495 173.747 -0.252 18804 2826 1 13 . 1 1 638 638 THR CA C 638 60.998 60.998 62.415 -1.417 18804 2827 1 13 . 1 1 638 638 THR CB C 638 68.954 68.954 67.014 1.940 18804 2828 1 13 . 1 1 638 638 THR H H 638 8.114 8.114 7.879 0.235 18804 2829 1 13 . 1 1 639 639 ASN N N 639 120.695 120.695 117.833 2.862 18804 2830 1 13 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.532 0.241 18804 2831 1 13 . 1 1 639 639 ASN C C 639 174.216 174.216 175.912 -1.696 18804 2832 1 13 . 1 1 639 639 ASN CA C 639 52.357 52.357 54.661 -2.304 18804 2833 1 13 . 1 1 639 639 ASN CB C 639 38.581 38.581 38.703 -0.122 18804 2834 1 13 . 1 1 639 639 ASN H H 639 8.301 8.301 7.944 0.357 18804 2835 1 13 . 1 1 640 640 GLY N N 640 108.827 108.827 107.535 1.292 18804 2836 1 13 . 1 1 640 640 GLY C C 640 170.506 170.506 172.475 -1.969 18804 2837 1 13 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.338 -0.483 18804 2838 1 13 . 1 1 640 640 GLY H H 640 8.111 8.111 8.342 -0.231 18804 2839 1 13 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.521 -0.069 18804 2840 1 13 . 1 1 641 641 PRO C C 641 175.669 175.669 176.123 -0.454 18804 2841 1 13 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.699 -0.624 18804 2842 1 13 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.408 -0.920 18804 2843 1 13 . 1 1 642 642 LYS N N 642 121.521 121.521 123.621 -2.100 18804 2844 1 13 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.611 -0.285 18804 2845 1 13 . 1 1 642 642 LYS C C 642 175.106 175.106 175.826 -0.720 18804 2846 1 13 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.994 -0.891 18804 2847 1 13 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.589 -2.219 18804 2848 1 13 . 1 1 642 642 LYS H H 642 8.417 8.417 8.353 0.064 18804 2849 1 13 . 1 1 643 643 ILE N N 643 121.410 121.410 126.054 -4.644 18804 2850 1 13 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.480 -0.145 18804 2851 1 13 . 1 1 643 643 ILE C C 643 173.587 173.587 174.775 -1.188 18804 2852 1 13 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.325 -1.451 18804 2853 1 13 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.041 -0.423 18804 2854 1 13 . 1 1 643 643 ILE H H 643 8.069 8.069 8.430 -0.361 18804 2855 1 13 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.561 -0.108 18804 2856 1 13 . 1 1 644 644 PRO C C 644 175.623 175.623 177.579 -1.956 18804 2857 1 13 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.360 0.099 18804 2858 1 13 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.403 -0.895 18804 2859 1 13 . 1 1 645 645 SER N N 645 115.445 115.445 113.983 1.462 18804 2860 1 13 . 1 1 645 645 SER HA H 645 4.374 4.374 4.253 0.121 18804 2861 1 13 . 1 1 645 645 SER C C 645 174.611 174.611 176.162 -1.551 18804 2862 1 13 . 1 1 645 645 SER CA C 645 58.566 58.566 60.605 -2.039 18804 2863 1 13 . 1 1 645 645 SER CB C 645 62.842 62.842 62.822 0.020 18804 2864 1 13 . 1 1 645 645 SER H H 645 8.267 8.267 8.504 -0.237 18804 2865 1 13 . 1 1 646 646 ILE N N 646 120.612 120.612 122.039 -1.427 18804 2866 1 13 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.844 0.265 18804 2867 1 13 . 1 1 646 646 ILE C C 646 174.703 174.703 176.893 -2.190 18804 2868 1 13 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.567 -1.345 18804 2869 1 13 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.037 0.623 18804 2870 1 13 . 1 1 646 646 ILE H H 646 8.252 8.252 7.937 0.315 18804 2871 1 13 . 1 1 647 647 ALA N N 647 123.224 123.224 123.084 0.140 18804 2872 1 13 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.882 0.281 18804 2873 1 13 . 1 1 647 647 ALA C C 647 176.526 176.526 179.153 -2.627 18804 2874 1 13 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.154 -1.970 18804 2875 1 13 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.097 0.152 18804 2876 1 13 . 1 1 647 647 ALA H H 647 8.084 8.084 7.625 0.459 18804 2877 1 13 . 1 1 648 648 THR N N 648 111.699 111.699 114.703 -3.004 18804 2878 1 13 . 1 1 648 648 THR HA H 648 4.021 4.021 3.920 0.101 18804 2879 1 13 . 1 1 648 648 THR C C 648 175.018 175.018 177.043 -2.025 18804 2880 1 13 . 1 1 648 648 THR CA C 648 63.554 63.554 66.697 -3.143 18804 2881 1 13 . 1 1 648 648 THR CB C 648 68.098 68.098 68.153 -0.055 18804 2882 1 13 . 1 1 648 648 THR H H 648 7.757 7.757 7.739 0.018 18804 2883 1 13 . 1 1 649 649 GLY N N 649 108.587 108.587 109.380 -0.793 18804 2884 1 13 . 1 1 649 649 GLY C C 649 173.686 173.686 176.118 -2.432 18804 2885 1 13 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.757 -0.812 18804 2886 1 13 . 1 1 649 649 GLY H H 649 8.423 8.423 7.872 0.551 18804 2887 1 13 . 1 1 650 650 MET N N 650 119.486 119.486 121.605 -2.119 18804 2888 1 13 . 1 1 650 650 MET HA H 650 4.135 4.135 4.286 -0.151 18804 2889 1 13 . 1 1 650 650 MET C C 650 176.632 176.632 178.614 -1.982 18804 2890 1 13 . 1 1 650 650 MET CA C 650 57.749 57.749 56.913 0.835 18804 2891 1 13 . 1 1 650 650 MET CB C 650 32.067 32.067 31.643 0.424 18804 2892 1 13 . 1 1 650 650 MET H H 650 8.332 8.332 7.559 0.773 18804 2893 1 13 . 1 1 651 651 VAL N N 651 118.009 118.009 118.862 -0.853 18804 2894 1 13 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.652 -0.112 18804 2895 1 13 . 1 1 651 651 VAL C C 651 176.672 176.672 178.205 -1.533 18804 2896 1 13 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.510 -1.231 18804 2897 1 13 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.716 -0.418 18804 2898 1 13 . 1 1 651 651 VAL H H 651 8.038 8.038 8.875 -0.837 18804 2899 1 13 . 1 1 652 652 GLY N N 652 105.785 105.785 107.081 -1.296 18804 2900 1 13 . 1 1 652 652 GLY C C 652 173.359 173.359 175.479 -2.120 18804 2901 1 13 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.303 -0.315 18804 2902 1 13 . 1 1 652 652 GLY H H 652 8.157 8.157 8.029 0.128 18804 2903 1 13 . 1 1 653 653 ALA N N 653 121.803 121.803 124.971 -3.168 18804 2904 1 13 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.199 -0.272 18804 2905 1 13 . 1 1 653 653 ALA C C 653 177.608 177.608 179.606 -1.998 18804 2906 1 13 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.632 0.015 18804 2907 1 13 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.350 -0.793 18804 2908 1 13 . 1 1 653 653 ALA H H 653 8.050 8.050 7.709 0.341 18804 2909 1 13 . 1 1 654 654 LEU N N 654 116.652 116.652 119.765 -3.113 18804 2910 1 13 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.862 0.090 18804 2911 1 13 . 1 1 654 654 LEU C C 654 177.361 177.361 179.155 -1.794 18804 2912 1 13 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.169 -0.907 18804 2913 1 13 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.752 -0.849 18804 2914 1 13 . 1 1 654 654 LEU H H 654 7.919 7.919 8.450 -0.531 18804 2915 1 13 . 1 1 655 655 LEU N N 655 117.910 117.910 118.592 -0.682 18804 2916 1 13 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.933 0.004 18804 2917 1 13 . 1 1 655 655 LEU C C 655 177.353 177.353 179.218 -1.865 18804 2918 1 13 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.889 -0.374 18804 2919 1 13 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.600 -0.790 18804 2920 1 13 . 1 1 655 655 LEU H H 655 8.189 8.189 8.158 0.031 18804 2921 1 13 . 1 1 656 656 LEU N N 656 118.140 118.140 119.255 -1.115 18804 2922 1 13 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.914 -0.005 18804 2923 1 13 . 1 1 656 656 LEU C C 656 177.304 177.304 179.202 -1.898 18804 2924 1 13 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.785 -0.288 18804 2925 1 13 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.653 -0.891 18804 2926 1 13 . 1 1 656 656 LEU H H 656 8.022 8.022 7.634 0.388 18804 2927 1 13 . 1 1 657 657 LEU N N 657 118.079 118.079 119.921 -1.842 18804 2928 1 13 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.866 -0.028 18804 2929 1 13 . 1 1 657 657 LEU C C 657 177.304 177.304 179.022 -1.718 18804 2930 1 13 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.197 -0.621 18804 2931 1 13 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.621 -0.825 18804 2932 1 13 . 1 1 657 657 LEU H H 657 8.073 8.073 8.227 -0.154 18804 2933 1 13 . 1 1 658 658 LEU N N 658 118.238 118.238 119.034 -0.796 18804 2934 1 13 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.911 0.012 18804 2935 1 13 . 1 1 658 658 LEU C C 658 177.353 177.353 179.176 -1.823 18804 2936 1 13 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.018 -0.509 18804 2937 1 13 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.641 -0.752 18804 2938 1 13 . 1 1 658 658 LEU H H 658 8.148 8.148 7.747 0.401 18804 2939 1 13 . 1 1 659 659 VAL N N 659 117.951 117.951 118.836 -0.885 18804 2940 1 13 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.694 -0.190 18804 2941 1 13 . 1 1 659 659 VAL C C 659 176.888 176.888 178.160 -1.272 18804 2942 1 13 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.165 0.327 18804 2943 1 13 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.773 -0.401 18804 2944 1 13 . 1 1 659 659 VAL H H 659 8.150 8.150 7.716 0.434 18804 2945 1 13 . 1 1 660 660 VAL N N 660 119.240 119.240 120.804 -1.564 18804 2946 1 13 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.595 -0.106 18804 2947 1 13 . 1 1 660 660 VAL C C 660 176.494 176.494 177.610 -1.116 18804 2948 1 13 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.602 -0.252 18804 2949 1 13 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.828 -0.438 18804 2950 1 13 . 1 1 660 660 VAL H H 660 8.220 8.220 7.944 0.276 18804 2951 1 13 . 1 1 661 661 ALA N N 661 121.414 121.414 122.446 -1.032 18804 2952 1 13 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.028 -0.136 18804 2953 1 13 . 1 1 661 661 ALA C C 661 178.419 178.419 179.802 -1.383 18804 2954 1 13 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.328 -0.233 18804 2955 1 13 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.158 -0.859 18804 2956 1 13 . 1 1 661 661 ALA H H 661 8.562 8.562 7.818 0.744 18804 2957 1 13 . 1 1 662 662 LEU N N 662 117.019 117.019 118.851 -1.832 18804 2958 1 13 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.878 0.099 18804 2959 1 13 . 1 1 662 662 LEU C C 662 178.078 178.078 179.215 -1.137 18804 2960 1 13 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.634 -0.318 18804 2961 1 13 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.673 -0.634 18804 2962 1 13 . 1 1 662 662 LEU H H 662 8.460 8.460 7.944 0.516 18804 2963 1 13 . 1 1 663 663 GLY N N 663 106.924 106.924 107.231 -0.307 18804 2964 1 13 . 1 1 663 663 GLY C C 663 174.372 174.372 176.117 -1.745 18804 2965 1 13 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.282 -0.183 18804 2966 1 13 . 1 1 663 663 GLY H H 663 8.683 8.683 7.985 0.698 18804 2967 1 13 . 1 1 664 664 ILE N N 664 121.523 121.523 122.784 -1.261 18804 2968 1 13 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.658 0.041 18804 2969 1 13 . 1 1 664 664 ILE C C 664 177.614 177.614 178.102 -0.488 18804 2970 1 13 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.121 -0.086 18804 2971 1 13 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.674 -0.842 18804 2972 1 13 . 1 1 664 664 ILE H H 664 8.750 8.750 8.077 0.673 18804 2973 1 13 . 1 1 665 665 GLY N N 665 107.803 107.803 108.391 -0.588 18804 2974 1 13 . 1 1 665 665 GLY C C 665 174.402 174.402 176.270 -1.868 18804 2975 1 13 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.346 -0.137 18804 2976 1 13 . 1 1 665 665 GLY H H 665 8.689 8.689 8.163 0.526 18804 2977 1 13 . 1 1 666 666 LEU N N 666 121.365 121.365 122.141 -0.776 18804 2978 1 13 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.078 -0.043 18804 2979 1 13 . 1 1 666 666 LEU C C 666 178.291 178.291 178.862 -0.571 18804 2980 1 13 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.130 0.201 18804 2981 1 13 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.803 -0.583 18804 2982 1 13 . 1 1 666 666 LEU H H 666 8.744 8.744 7.897 0.847 18804 2983 1 13 . 1 1 667 667 PHE N N 667 119.838 119.838 121.410 -1.572 18804 2984 1 13 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.138 -0.047 18804 2985 1 13 . 1 1 667 667 PHE C C 667 176.965 176.965 177.737 -0.772 18804 2986 1 13 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.438 -0.407 18804 2987 1 13 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.502 -0.741 18804 2988 1 13 . 1 1 667 667 PHE H H 667 8.454 8.454 8.449 0.005 18804 2989 1 13 . 1 1 668 668 MET N N 668 116.868 116.868 117.676 -0.808 18804 2990 1 13 . 1 1 668 668 MET HA H 668 4.035 4.035 3.952 0.083 18804 2991 1 13 . 1 1 668 668 MET C C 668 177.678 177.678 177.847 -0.169 18804 2992 1 13 . 1 1 668 668 MET CA C 668 57.405 57.405 58.698 -1.293 18804 2993 1 13 . 1 1 668 668 MET CB C 668 31.739 31.739 32.453 -0.714 18804 2994 1 13 . 1 1 668 668 MET H H 668 8.701 8.701 8.632 0.069 18804 2995 1 13 . 1 1 669 669 ARG N N 669 118.600 118.600 115.665 2.935 18804 2996 1 13 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.081 0.054 18804 2997 1 13 . 1 1 669 669 ARG C C 669 177.120 177.120 177.057 0.063 18804 2998 1 13 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.010 -0.758 18804 2999 1 13 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.519 -1.015 18804 3000 1 13 . 1 1 669 669 ARG H H 669 8.044 8.044 7.604 0.440 18804 3001 1 13 . 1 1 670 670 ARG N N 670 118.124 118.124 119.962 -1.838 18804 3002 1 13 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.403 -0.278 18804 3003 1 13 . 1 1 670 670 ARG C C 670 176.240 176.240 174.544 1.696 18804 3004 1 13 . 1 1 670 670 ARG CA C 670 56.738 56.738 55.439 1.299 18804 3005 1 13 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.367 -0.901 18804 3006 1 13 . 1 1 670 670 ARG H H 670 7.864 7.864 7.346 0.518 18804 3007 1 13 . 1 1 671 671 ARG N N 671 117.904 117.904 124.051 -6.147 18804 3008 1 13 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.301 -0.215 18804 3009 1 13 . 1 1 671 671 ARG C C 671 175.233 175.233 175.631 -0.398 18804 3010 1 13 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.379 0.352 18804 3011 1 13 . 1 1 671 671 ARG CB C 671 29.494 29.494 32.193 -2.699 18804 3012 1 13 . 1 1 671 671 ARG H H 671 7.677 7.677 8.366 -0.689 18804 3013 1 13 . 1 1 672 672 HIS N N 672 117.048 117.048 120.881 -3.833 18804 3014 1 13 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.669 -0.066 18804 3015 1 13 . 1 1 672 672 HIS C C 672 173.634 173.634 174.862 -1.228 18804 3016 1 13 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.799 -0.958 18804 3017 1 13 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.641 -2.455 18804 3018 1 13 . 1 1 672 672 HIS H H 672 7.920 7.920 8.298 -0.378 18804 3019 1 13 . 1 1 673 673 ILE N N 673 120.795 120.795 119.443 1.352 18804 3020 1 13 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.377 -0.303 18804 3021 1 13 . 1 1 673 673 ILE C C 673 174.922 174.922 174.854 0.068 18804 3022 1 13 . 1 1 673 673 ILE CA C 673 60.777 60.777 59.832 0.945 18804 3023 1 13 . 1 1 673 673 ILE CB C 673 37.836 37.836 39.708 -1.872 18804 3024 1 13 . 1 1 673 673 ILE H H 673 7.900 7.900 8.293 -0.393 18804 3025 1 13 . 1 1 674 674 VAL N N 674 122.867 122.867 122.870 -0.003 18804 3026 1 13 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.363 -0.282 18804 3027 1 13 . 1 1 674 674 VAL C C 674 174.876 174.876 176.428 -1.552 18804 3028 1 13 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.563 -0.193 18804 3029 1 13 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.619 -0.625 18804 3030 1 13 . 1 1 674 674 VAL H H 674 8.003 8.003 8.216 -0.213 18804 3031 1 13 . 1 1 675 675 ARG N N 675 124.866 124.866 123.077 1.789 18804 3032 1 13 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.262 -0.205 18804 3033 1 13 . 1 1 675 675 ARG C C 675 174.922 174.922 175.513 -0.591 18804 3034 1 13 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.625 -1.441 18804 3035 1 13 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.899 -0.583 18804 3036 1 13 . 1 1 675 675 ARG H H 675 8.266 8.266 8.433 -0.167 18804 3037 1 13 . 1 1 676 676 LYS N N 676 123.517 123.517 120.867 2.650 18804 3038 1 13 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.536 -0.271 18804 3039 1 13 . 1 1 676 676 LYS C C 676 174.625 174.625 176.743 -2.118 18804 3040 1 13 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.292 0.461 18804 3041 1 13 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.636 -3.356 18804 3042 1 13 . 1 1 676 676 LYS H H 676 8.260 8.260 8.260 0.000 18804 3043 1 14 . 1 1 635 635 GLY N N 635 108.817 108.817 110.738 -1.921 18804 3044 1 14 . 1 1 635 635 GLY C C 635 172.499 172.499 174.492 -1.993 18804 3045 1 14 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.406 -1.137 18804 3046 1 14 . 1 1 635 635 GLY H H 635 8.390 8.390 8.375 0.015 18804 3047 1 14 . 1 1 636 636 CYS N N 636 120.634 120.634 120.281 0.353 18804 3048 1 14 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.921 0.101 18804 3049 1 14 . 1 1 636 636 CYS C C 636 172.181 172.181 173.690 -1.509 18804 3050 1 14 . 1 1 636 636 CYS CA C 636 52.594 52.594 55.713 -3.119 18804 3051 1 14 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.887 10.601 18804 3052 1 14 . 1 1 636 636 CYS H H 636 8.327 8.327 8.299 0.028 18804 3053 1 14 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.507 -0.007 18804 3054 1 14 . 1 1 637 637 PRO C C 637 176.215 176.215 177.279 -1.064 18804 3055 1 14 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.883 -1.205 18804 3056 1 14 . 1 1 637 637 PRO CB C 637 31.342 31.342 32.076 -0.734 18804 3057 1 14 . 1 1 638 638 THR N N 638 113.690 113.690 114.654 -0.964 18804 3058 1 14 . 1 1 638 638 THR HA H 638 4.305 4.305 4.063 0.242 18804 3059 1 14 . 1 1 638 638 THR C C 638 173.495 173.495 175.007 -1.512 18804 3060 1 14 . 1 1 638 638 THR CA C 638 60.998 60.998 64.361 -3.363 18804 3061 1 14 . 1 1 638 638 THR CB C 638 68.954 68.954 69.081 -0.127 18804 3062 1 14 . 1 1 638 638 THR H H 638 8.114 8.114 8.345 -0.231 18804 3063 1 14 . 1 1 639 639 ASN N N 639 120.695 120.695 118.204 2.491 18804 3064 1 14 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.782 -0.009 18804 3065 1 14 . 1 1 639 639 ASN C C 639 174.216 174.216 173.987 0.229 18804 3066 1 14 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.994 -0.637 18804 3067 1 14 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.643 -1.062 18804 3068 1 14 . 1 1 639 639 ASN H H 639 8.301 8.301 8.103 0.198 18804 3069 1 14 . 1 1 640 640 GLY N N 640 108.827 108.827 107.505 1.322 18804 3070 1 14 . 1 1 640 640 GLY C C 640 170.506 170.506 172.085 -1.579 18804 3071 1 14 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.530 -0.675 18804 3072 1 14 . 1 1 640 640 GLY H H 640 8.111 8.111 8.365 -0.254 18804 3073 1 14 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.596 -0.144 18804 3074 1 14 . 1 1 641 641 PRO C C 641 175.669 175.669 175.961 -0.292 18804 3075 1 14 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.736 -0.661 18804 3076 1 14 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.565 -1.077 18804 3077 1 14 . 1 1 642 642 LYS N N 642 121.521 121.521 122.450 -0.929 18804 3078 1 14 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.514 -0.188 18804 3079 1 14 . 1 1 642 642 LYS C C 642 175.106 175.106 175.242 -0.136 18804 3080 1 14 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.228 -1.125 18804 3081 1 14 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.643 -2.273 18804 3082 1 14 . 1 1 642 642 LYS H H 642 8.417 8.417 8.164 0.253 18804 3083 1 14 . 1 1 643 643 ILE N N 643 121.410 121.410 125.963 -4.553 18804 3084 1 14 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.461 -0.126 18804 3085 1 14 . 1 1 643 643 ILE C C 643 173.587 173.587 174.625 -1.038 18804 3086 1 14 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.694 -1.820 18804 3087 1 14 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.716 -0.098 18804 3088 1 14 . 1 1 643 643 ILE H H 643 8.069 8.069 8.494 -0.425 18804 3089 1 14 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.566 -0.113 18804 3090 1 14 . 1 1 644 644 PRO C C 644 175.623 175.623 177.435 -1.812 18804 3091 1 14 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.306 0.153 18804 3092 1 14 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.437 -0.929 18804 3093 1 14 . 1 1 645 645 SER N N 645 115.445 115.445 113.964 1.481 18804 3094 1 14 . 1 1 645 645 SER HA H 645 4.374 4.374 4.261 0.113 18804 3095 1 14 . 1 1 645 645 SER C C 645 174.611 174.611 176.141 -1.530 18804 3096 1 14 . 1 1 645 645 SER CA C 645 58.566 58.566 60.063 -1.498 18804 3097 1 14 . 1 1 645 645 SER CB C 645 62.842 62.842 62.879 -0.037 18804 3098 1 14 . 1 1 645 645 SER H H 645 8.267 8.267 8.415 -0.148 18804 3099 1 14 . 1 1 646 646 ILE N N 646 120.612 120.612 121.588 -0.976 18804 3100 1 14 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.830 0.279 18804 3101 1 14 . 1 1 646 646 ILE C C 646 174.703 174.703 176.978 -2.275 18804 3102 1 14 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.638 -1.416 18804 3103 1 14 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.036 0.624 18804 3104 1 14 . 1 1 646 646 ILE H H 646 8.252 8.252 7.997 0.255 18804 3105 1 14 . 1 1 647 647 ALA N N 647 123.224 123.224 123.583 -0.359 18804 3106 1 14 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.895 0.268 18804 3107 1 14 . 1 1 647 647 ALA C C 647 176.526 176.526 179.172 -2.646 18804 3108 1 14 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.065 -1.881 18804 3109 1 14 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.065 0.184 18804 3110 1 14 . 1 1 647 647 ALA H H 647 8.084 8.084 7.639 0.445 18804 3111 1 14 . 1 1 648 648 THR N N 648 111.699 111.699 114.438 -2.739 18804 3112 1 14 . 1 1 648 648 THR HA H 648 4.021 4.021 3.864 0.157 18804 3113 1 14 . 1 1 648 648 THR C C 648 175.018 175.018 176.882 -1.864 18804 3114 1 14 . 1 1 648 648 THR CA C 648 63.554 63.554 67.387 -3.833 18804 3115 1 14 . 1 1 648 648 THR CB C 648 68.098 68.098 68.484 -0.386 18804 3116 1 14 . 1 1 648 648 THR H H 648 7.757 7.757 7.745 0.012 18804 3117 1 14 . 1 1 649 649 GLY N N 649 108.587 108.587 109.665 -1.078 18804 3118 1 14 . 1 1 649 649 GLY C C 649 173.686 173.686 176.312 -2.626 18804 3119 1 14 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.768 -0.824 18804 3120 1 14 . 1 1 649 649 GLY H H 649 8.423 8.423 7.818 0.605 18804 3121 1 14 . 1 1 650 650 MET N N 650 119.486 119.486 121.414 -1.928 18804 3122 1 14 . 1 1 650 650 MET HA H 650 4.135 4.135 4.283 -0.148 18804 3123 1 14 . 1 1 650 650 MET C C 650 176.632 176.632 178.661 -2.029 18804 3124 1 14 . 1 1 650 650 MET CA C 650 57.749 57.749 56.875 0.874 18804 3125 1 14 . 1 1 650 650 MET CB C 650 32.067 32.067 31.587 0.480 18804 3126 1 14 . 1 1 650 650 MET H H 650 8.332 8.332 7.598 0.734 18804 3127 1 14 . 1 1 651 651 VAL N N 651 118.009 118.009 119.112 -1.103 18804 3128 1 14 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.701 -0.161 18804 3129 1 14 . 1 1 651 651 VAL C C 651 176.672 176.672 178.264 -1.592 18804 3130 1 14 . 1 1 651 651 VAL CA C 651 66.279 66.279 66.265 0.014 18804 3131 1 14 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.547 -0.249 18804 3132 1 14 . 1 1 651 651 VAL H H 651 8.038 8.038 8.731 -0.693 18804 3133 1 14 . 1 1 652 652 GLY N N 652 105.785 105.785 106.951 -1.166 18804 3134 1 14 . 1 1 652 652 GLY C C 652 173.359 173.359 175.412 -2.053 18804 3135 1 14 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.293 -0.305 18804 3136 1 14 . 1 1 652 652 GLY H H 652 8.157 8.157 8.000 0.157 18804 3137 1 14 . 1 1 653 653 ALA N N 653 121.803 121.803 124.917 -3.114 18804 3138 1 14 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.202 -0.275 18804 3139 1 14 . 1 1 653 653 ALA C C 653 177.608 177.608 179.616 -2.008 18804 3140 1 14 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.630 0.017 18804 3141 1 14 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.341 -0.784 18804 3142 1 14 . 1 1 653 653 ALA H H 653 8.050 8.050 7.760 0.290 18804 3143 1 14 . 1 1 654 654 LEU N N 654 116.652 116.652 119.787 -3.135 18804 3144 1 14 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.869 0.083 18804 3145 1 14 . 1 1 654 654 LEU C C 654 177.361 177.361 179.131 -1.770 18804 3146 1 14 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.161 -0.899 18804 3147 1 14 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.789 -0.886 18804 3148 1 14 . 1 1 654 654 LEU H H 654 7.919 7.919 8.370 -0.451 18804 3149 1 14 . 1 1 655 655 LEU N N 655 117.910 117.910 118.652 -0.742 18804 3150 1 14 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.936 0.001 18804 3151 1 14 . 1 1 655 655 LEU C C 655 177.353 177.353 179.163 -1.810 18804 3152 1 14 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.894 -0.379 18804 3153 1 14 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.607 -0.797 18804 3154 1 14 . 1 1 655 655 LEU H H 655 8.189 8.189 7.996 0.193 18804 3155 1 14 . 1 1 656 656 LEU N N 656 118.140 118.140 119.266 -1.126 18804 3156 1 14 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.907 0.002 18804 3157 1 14 . 1 1 656 656 LEU C C 656 177.304 177.304 179.257 -1.953 18804 3158 1 14 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.815 -0.317 18804 3159 1 14 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.619 -0.858 18804 3160 1 14 . 1 1 656 656 LEU H H 656 8.022 8.022 7.663 0.359 18804 3161 1 14 . 1 1 657 657 LEU N N 657 118.079 118.079 119.787 -1.708 18804 3162 1 14 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.873 -0.035 18804 3163 1 14 . 1 1 657 657 LEU C C 657 177.304 177.304 179.005 -1.701 18804 3164 1 14 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.145 -0.569 18804 3165 1 14 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.624 -0.828 18804 3166 1 14 . 1 1 657 657 LEU H H 657 8.073 8.073 8.190 -0.117 18804 3167 1 14 . 1 1 658 658 LEU N N 658 118.238 118.238 119.087 -0.849 18804 3168 1 14 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.889 0.034 18804 3169 1 14 . 1 1 658 658 LEU C C 658 177.353 177.353 179.107 -1.754 18804 3170 1 14 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.215 -0.706 18804 3171 1 14 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.731 -0.842 18804 3172 1 14 . 1 1 658 658 LEU H H 658 8.148 8.148 7.710 0.438 18804 3173 1 14 . 1 1 659 659 VAL N N 659 117.951 117.951 118.688 -0.737 18804 3174 1 14 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.589 -0.085 18804 3175 1 14 . 1 1 659 659 VAL C C 659 176.888 176.888 178.096 -1.208 18804 3176 1 14 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.565 -0.073 18804 3177 1 14 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.480 -1.108 18804 3178 1 14 . 1 1 659 659 VAL H H 659 8.150 8.150 7.728 0.422 18804 3179 1 14 . 1 1 660 660 VAL N N 660 119.240 119.240 120.353 -1.113 18804 3180 1 14 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.606 -0.117 18804 3181 1 14 . 1 1 660 660 VAL C C 660 176.494 176.494 177.539 -1.045 18804 3182 1 14 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.408 -0.058 18804 3183 1 14 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.888 -0.498 18804 3184 1 14 . 1 1 660 660 VAL H H 660 8.220 8.220 7.833 0.387 18804 3185 1 14 . 1 1 661 661 ALA N N 661 121.414 121.414 122.501 -1.087 18804 3186 1 14 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.028 -0.136 18804 3187 1 14 . 1 1 661 661 ALA C C 661 178.419 178.419 179.801 -1.382 18804 3188 1 14 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.344 -0.249 18804 3189 1 14 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.159 -0.860 18804 3190 1 14 . 1 1 661 661 ALA H H 661 8.562 8.562 7.899 0.663 18804 3191 1 14 . 1 1 662 662 LEU N N 662 117.019 117.019 118.858 -1.839 18804 3192 1 14 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.862 0.115 18804 3193 1 14 . 1 1 662 662 LEU C C 662 178.078 178.078 179.253 -1.175 18804 3194 1 14 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.740 -0.424 18804 3195 1 14 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.650 -0.611 18804 3196 1 14 . 1 1 662 662 LEU H H 662 8.460 8.460 7.967 0.493 18804 3197 1 14 . 1 1 663 663 GLY N N 663 106.924 106.924 107.176 -0.252 18804 3198 1 14 . 1 1 663 663 GLY C C 663 174.372 174.372 176.165 -1.793 18804 3199 1 14 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.173 -0.074 18804 3200 1 14 . 1 1 663 663 GLY H H 663 8.683 8.683 7.881 0.802 18804 3201 1 14 . 1 1 664 664 ILE N N 664 121.523 121.523 122.533 -1.010 18804 3202 1 14 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.684 0.015 18804 3203 1 14 . 1 1 664 664 ILE C C 664 177.614 177.614 178.092 -0.478 18804 3204 1 14 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.839 0.196 18804 3205 1 14 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.673 -0.841 18804 3206 1 14 . 1 1 664 664 ILE H H 664 8.750 8.750 8.151 0.599 18804 3207 1 14 . 1 1 665 665 GLY N N 665 107.803 107.803 108.754 -0.951 18804 3208 1 14 . 1 1 665 665 GLY C C 665 174.402 174.402 176.111 -1.709 18804 3209 1 14 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.302 -0.093 18804 3210 1 14 . 1 1 665 665 GLY H H 665 8.689 8.689 8.380 0.309 18804 3211 1 14 . 1 1 666 666 LEU N N 666 121.365 121.365 121.998 -0.633 18804 3212 1 14 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.011 0.024 18804 3213 1 14 . 1 1 666 666 LEU C C 666 178.291 178.291 178.834 -0.543 18804 3214 1 14 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.182 0.149 18804 3215 1 14 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.820 -0.600 18804 3216 1 14 . 1 1 666 666 LEU H H 666 8.744 8.744 7.830 0.914 18804 3217 1 14 . 1 1 667 667 PHE N N 667 119.838 119.838 120.828 -0.990 18804 3218 1 14 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.272 -0.181 18804 3219 1 14 . 1 1 667 667 PHE C C 667 176.965 176.965 177.693 -0.728 18804 3220 1 14 . 1 1 667 667 PHE CA C 667 61.031 61.031 60.852 0.179 18804 3221 1 14 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.907 -1.146 18804 3222 1 14 . 1 1 667 667 PHE H H 667 8.454 8.454 7.830 0.624 18804 3223 1 14 . 1 1 668 668 MET N N 668 116.868 116.868 118.465 -1.597 18804 3224 1 14 . 1 1 668 668 MET HA H 668 4.035 4.035 3.908 0.127 18804 3225 1 14 . 1 1 668 668 MET C C 668 177.678 177.678 178.426 -0.748 18804 3226 1 14 . 1 1 668 668 MET CA C 668 57.405 57.405 58.763 -1.358 18804 3227 1 14 . 1 1 668 668 MET CB C 668 31.739 31.739 32.396 -0.657 18804 3228 1 14 . 1 1 668 668 MET H H 668 8.701 8.701 8.776 -0.075 18804 3229 1 14 . 1 1 669 669 ARG N N 669 118.600 118.600 117.340 1.260 18804 3230 1 14 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.053 0.082 18804 3231 1 14 . 1 1 669 669 ARG C C 669 177.120 177.120 177.073 0.047 18804 3232 1 14 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.899 -0.647 18804 3233 1 14 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.638 -1.134 18804 3234 1 14 . 1 1 669 669 ARG H H 669 8.044 8.044 7.666 0.378 18804 3235 1 14 . 1 1 670 670 ARG N N 670 118.124 118.124 117.763 0.361 18804 3236 1 14 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.444 -0.319 18804 3237 1 14 . 1 1 670 670 ARG C C 670 176.240 176.240 174.531 1.709 18804 3238 1 14 . 1 1 670 670 ARG CA C 670 56.738 56.738 55.820 0.918 18804 3239 1 14 . 1 1 670 670 ARG CB C 670 29.467 29.467 31.413 -1.946 18804 3240 1 14 . 1 1 670 670 ARG H H 670 7.864 7.864 7.694 0.170 18804 3241 1 14 . 1 1 671 671 ARG N N 671 117.904 117.904 123.401 -5.497 18804 3242 1 14 . 1 1 671 671 ARG HA H 671 4.086 4.086 3.974 0.112 18804 3243 1 14 . 1 1 671 671 ARG C C 671 175.233 175.233 176.070 -0.837 18804 3244 1 14 . 1 1 671 671 ARG CA C 671 55.731 55.731 56.792 -1.061 18804 3245 1 14 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.842 -1.348 18804 3246 1 14 . 1 1 671 671 ARG H H 671 7.677 7.677 8.468 -0.791 18804 3247 1 14 . 1 1 672 672 HIS N N 672 117.048 117.048 118.067 -1.019 18804 3248 1 14 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.677 -0.074 18804 3249 1 14 . 1 1 672 672 HIS C C 672 173.634 173.634 176.061 -2.427 18804 3250 1 14 . 1 1 672 672 HIS CA C 672 54.841 54.841 54.924 -0.083 18804 3251 1 14 . 1 1 672 672 HIS CB C 672 28.186 28.186 31.729 -3.543 18804 3252 1 14 . 1 1 672 672 HIS H H 672 7.920 7.920 7.751 0.169 18804 3253 1 14 . 1 1 673 673 ILE N N 673 120.795 120.795 120.933 -0.138 18804 3254 1 14 . 1 1 673 673 ILE HA H 673 4.074 4.074 3.821 0.253 18804 3255 1 14 . 1 1 673 673 ILE C C 673 174.922 174.922 176.135 -1.213 18804 3256 1 14 . 1 1 673 673 ILE CA C 673 60.777 60.777 62.202 -1.425 18804 3257 1 14 . 1 1 673 673 ILE CB C 673 37.836 37.836 37.836 0.000 18804 3258 1 14 . 1 1 673 673 ILE H H 673 7.900 7.900 7.733 0.167 18804 3259 1 14 . 1 1 674 674 VAL N N 674 122.867 122.867 114.148 8.719 18804 3260 1 14 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.239 -0.158 18804 3261 1 14 . 1 1 674 674 VAL C C 674 174.876 174.876 175.241 -0.365 18804 3262 1 14 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.536 -0.167 18804 3263 1 14 . 1 1 674 674 VAL CB C 674 31.994 31.994 33.706 -1.712 18804 3264 1 14 . 1 1 674 674 VAL H H 674 8.003 8.003 7.699 0.304 18804 3265 1 14 . 1 1 675 675 ARG N N 675 124.866 124.866 118.940 5.926 18804 3266 1 14 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.452 -0.395 18804 3267 1 14 . 1 1 675 675 ARG C C 675 174.922 174.922 176.837 -1.915 18804 3268 1 14 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.208 -1.024 18804 3269 1 14 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.334 -0.018 18804 3270 1 14 . 1 1 675 675 ARG H H 675 8.266 8.266 8.351 -0.085 18804 3271 1 14 . 1 1 676 676 LYS N N 676 123.517 123.517 121.756 1.761 18804 3272 1 14 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.244 0.021 18804 3273 1 14 . 1 1 676 676 LYS C C 676 174.625 174.625 177.211 -2.586 18804 3274 1 14 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.480 -0.727 18804 3275 1 14 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.972 -2.691 18804 3276 1 14 . 1 1 676 676 LYS H H 676 8.260 8.260 8.006 0.254 18804 3277 1 15 . 1 1 635 635 GLY N N 635 108.817 108.817 111.598 -2.781 18804 3278 1 15 . 1 1 635 635 GLY C C 635 172.499 172.499 173.608 -1.109 18804 3279 1 15 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.630 -0.361 18804 3280 1 15 . 1 1 635 635 GLY H H 635 8.390 8.390 8.685 -0.295 18804 3281 1 15 . 1 1 636 636 CYS N N 636 120.634 120.634 122.909 -2.275 18804 3282 1 15 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.323 0.699 18804 3283 1 15 . 1 1 636 636 CYS C C 636 172.181 172.181 174.407 -2.226 18804 3284 1 15 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.237 -5.643 18804 3285 1 15 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.402 11.086 18804 3286 1 15 . 1 1 636 636 CYS H H 636 8.327 8.327 8.433 -0.106 18804 3287 1 15 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.418 0.082 18804 3288 1 15 . 1 1 637 637 PRO C C 637 176.215 176.215 176.377 -0.162 18804 3289 1 15 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.373 -1.695 18804 3290 1 15 . 1 1 637 637 PRO CB C 637 31.342 31.342 32.166 -0.824 18804 3291 1 15 . 1 1 638 638 THR N N 638 113.690 113.690 112.825 0.865 18804 3292 1 15 . 1 1 638 638 THR HA H 638 4.305 4.305 4.477 -0.172 18804 3293 1 15 . 1 1 638 638 THR C C 638 173.495 173.495 172.960 0.535 18804 3294 1 15 . 1 1 638 638 THR CA C 638 60.998 60.998 61.788 -0.791 18804 3295 1 15 . 1 1 638 638 THR CB C 638 68.954 68.954 68.561 0.393 18804 3296 1 15 . 1 1 638 638 THR H H 638 8.114 8.114 7.896 0.218 18804 3297 1 15 . 1 1 639 639 ASN N N 639 120.695 120.695 124.245 -3.550 18804 3298 1 15 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.773 0.000 18804 3299 1 15 . 1 1 639 639 ASN C C 639 174.216 174.216 174.391 -0.175 18804 3300 1 15 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.120 -0.763 18804 3301 1 15 . 1 1 639 639 ASN CB C 639 38.581 38.581 40.111 -1.530 18804 3302 1 15 . 1 1 639 639 ASN H H 639 8.301 8.301 8.722 -0.421 18804 3303 1 15 . 1 1 640 640 GLY N N 640 108.827 108.827 107.811 1.016 18804 3304 1 15 . 1 1 640 640 GLY C C 640 170.506 170.506 172.323 -1.817 18804 3305 1 15 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.364 -0.509 18804 3306 1 15 . 1 1 640 640 GLY H H 640 8.111 8.111 8.473 -0.362 18804 3307 1 15 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.413 0.039 18804 3308 1 15 . 1 1 641 641 PRO C C 641 175.669 175.669 176.264 -0.595 18804 3309 1 15 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.770 -0.695 18804 3310 1 15 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.150 -0.662 18804 3311 1 15 . 1 1 642 642 LYS N N 642 121.521 121.521 123.544 -2.023 18804 3312 1 15 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.603 -0.277 18804 3313 1 15 . 1 1 642 642 LYS C C 642 175.106 175.106 175.610 -0.504 18804 3314 1 15 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.081 -0.978 18804 3315 1 15 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.353 -1.983 18804 3316 1 15 . 1 1 642 642 LYS H H 642 8.417 8.417 8.513 -0.096 18804 3317 1 15 . 1 1 643 643 ILE N N 643 121.410 121.410 125.577 -4.167 18804 3318 1 15 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.427 -0.092 18804 3319 1 15 . 1 1 643 643 ILE C C 643 173.587 173.587 174.787 -1.200 18804 3320 1 15 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.104 -1.230 18804 3321 1 15 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.065 -0.447 18804 3322 1 15 . 1 1 643 643 ILE H H 643 8.069 8.069 8.519 -0.450 18804 3323 1 15 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.576 -0.123 18804 3324 1 15 . 1 1 644 644 PRO C C 644 175.623 175.623 177.710 -2.087 18804 3325 1 15 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.441 0.018 18804 3326 1 15 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.381 -0.873 18804 3327 1 15 . 1 1 645 645 SER N N 645 115.445 115.445 114.094 1.351 18804 3328 1 15 . 1 1 645 645 SER HA H 645 4.374 4.374 4.293 0.081 18804 3329 1 15 . 1 1 645 645 SER C C 645 174.611 174.611 176.274 -1.663 18804 3330 1 15 . 1 1 645 645 SER CA C 645 58.566 58.566 60.206 -1.640 18804 3331 1 15 . 1 1 645 645 SER CB C 645 62.842 62.842 62.478 0.364 18804 3332 1 15 . 1 1 645 645 SER H H 645 8.267 8.267 8.538 -0.271 18804 3333 1 15 . 1 1 646 646 ILE N N 646 120.612 120.612 122.978 -2.366 18804 3334 1 15 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.821 0.288 18804 3335 1 15 . 1 1 646 646 ILE C C 646 174.703 174.703 176.389 -1.686 18804 3336 1 15 . 1 1 646 646 ILE CA C 646 61.222 61.222 61.725 -0.503 18804 3337 1 15 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.608 0.052 18804 3338 1 15 . 1 1 646 646 ILE H H 646 8.252 8.252 7.904 0.348 18804 3339 1 15 . 1 1 647 647 ALA N N 647 123.224 123.224 122.316 0.908 18804 3340 1 15 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.886 0.277 18804 3341 1 15 . 1 1 647 647 ALA C C 647 176.526 176.526 179.191 -2.665 18804 3342 1 15 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.306 -2.122 18804 3343 1 15 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.863 0.386 18804 3344 1 15 . 1 1 647 647 ALA H H 647 8.084 8.084 7.622 0.462 18804 3345 1 15 . 1 1 648 648 THR N N 648 111.699 111.699 114.265 -2.566 18804 3346 1 15 . 1 1 648 648 THR HA H 648 4.021 4.021 3.863 0.158 18804 3347 1 15 . 1 1 648 648 THR C C 648 175.018 175.018 176.913 -1.895 18804 3348 1 15 . 1 1 648 648 THR CA C 648 63.554 63.554 67.456 -3.902 18804 3349 1 15 . 1 1 648 648 THR CB C 648 68.098 68.098 68.417 -0.319 18804 3350 1 15 . 1 1 648 648 THR H H 648 7.757 7.757 7.733 0.024 18804 3351 1 15 . 1 1 649 649 GLY N N 649 108.587 108.587 109.546 -0.959 18804 3352 1 15 . 1 1 649 649 GLY C C 649 173.686 173.686 176.343 -2.657 18804 3353 1 15 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.833 -0.889 18804 3354 1 15 . 1 1 649 649 GLY H H 649 8.423 8.423 7.965 0.458 18804 3355 1 15 . 1 1 650 650 MET N N 650 119.486 119.486 121.830 -2.344 18804 3356 1 15 . 1 1 650 650 MET HA H 650 4.135 4.135 4.195 -0.060 18804 3357 1 15 . 1 1 650 650 MET C C 650 176.632 176.632 178.637 -2.005 18804 3358 1 15 . 1 1 650 650 MET CA C 650 57.749 57.749 57.217 0.532 18804 3359 1 15 . 1 1 650 650 MET CB C 650 32.067 32.067 31.720 0.347 18804 3360 1 15 . 1 1 650 650 MET H H 650 8.332 8.332 7.554 0.778 18804 3361 1 15 . 1 1 651 651 VAL N N 651 118.009 118.009 118.872 -0.863 18804 3362 1 15 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.596 -0.056 18804 3363 1 15 . 1 1 651 651 VAL C C 651 176.672 176.672 178.062 -1.390 18804 3364 1 15 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.275 -0.996 18804 3365 1 15 . 1 1 651 651 VAL CB C 651 30.298 30.298 31.159 -0.861 18804 3366 1 15 . 1 1 651 651 VAL H H 651 8.038 8.038 8.648 -0.610 18804 3367 1 15 . 1 1 652 652 GLY N N 652 105.785 105.785 106.502 -0.717 18804 3368 1 15 . 1 1 652 652 GLY C C 652 173.359 173.359 175.422 -2.063 18804 3369 1 15 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.170 -0.182 18804 3370 1 15 . 1 1 652 652 GLY H H 652 8.157 8.157 8.039 0.118 18804 3371 1 15 . 1 1 653 653 ALA N N 653 121.803 121.803 125.094 -3.291 18804 3372 1 15 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.213 -0.286 18804 3373 1 15 . 1 1 653 653 ALA C C 653 177.608 177.608 179.648 -2.040 18804 3374 1 15 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.633 0.014 18804 3375 1 15 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.368 -0.811 18804 3376 1 15 . 1 1 653 653 ALA H H 653 8.050 8.050 7.846 0.204 18804 3377 1 15 . 1 1 654 654 LEU N N 654 116.652 116.652 119.827 -3.175 18804 3378 1 15 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.902 0.050 18804 3379 1 15 . 1 1 654 654 LEU C C 654 177.361 177.361 179.101 -1.740 18804 3380 1 15 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.187 -0.925 18804 3381 1 15 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.867 -0.964 18804 3382 1 15 . 1 1 654 654 LEU H H 654 7.919 7.919 8.447 -0.528 18804 3383 1 15 . 1 1 655 655 LEU N N 655 117.910 117.910 118.780 -0.870 18804 3384 1 15 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.934 0.003 18804 3385 1 15 . 1 1 655 655 LEU C C 655 177.353 177.353 179.228 -1.875 18804 3386 1 15 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.955 -0.440 18804 3387 1 15 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.626 -0.816 18804 3388 1 15 . 1 1 655 655 LEU H H 655 8.189 8.189 8.194 -0.005 18804 3389 1 15 . 1 1 656 656 LEU N N 656 118.140 118.140 119.118 -0.978 18804 3390 1 15 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.922 -0.013 18804 3391 1 15 . 1 1 656 656 LEU C C 656 177.304 177.304 179.131 -1.827 18804 3392 1 15 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.719 -0.222 18804 3393 1 15 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.652 -0.891 18804 3394 1 15 . 1 1 656 656 LEU H H 656 8.022 8.022 7.690 0.332 18804 3395 1 15 . 1 1 657 657 LEU N N 657 118.079 118.079 119.983 -1.904 18804 3396 1 15 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.855 -0.017 18804 3397 1 15 . 1 1 657 657 LEU C C 657 177.304 177.304 179.046 -1.742 18804 3398 1 15 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.285 -0.709 18804 3399 1 15 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.629 -0.833 18804 3400 1 15 . 1 1 657 657 LEU H H 657 8.073 8.073 8.139 -0.066 18804 3401 1 15 . 1 1 658 658 LEU N N 658 118.238 118.238 118.735 -0.497 18804 3402 1 15 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.921 0.002 18804 3403 1 15 . 1 1 658 658 LEU C C 658 177.353 177.353 179.119 -1.766 18804 3404 1 15 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.109 -0.600 18804 3405 1 15 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.796 -0.907 18804 3406 1 15 . 1 1 658 658 LEU H H 658 8.148 8.148 7.713 0.435 18804 3407 1 15 . 1 1 659 659 VAL N N 659 117.951 117.951 119.119 -1.168 18804 3408 1 15 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.604 -0.100 18804 3409 1 15 . 1 1 659 659 VAL C C 659 176.888 176.888 178.024 -1.136 18804 3410 1 15 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.745 -0.253 18804 3411 1 15 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.519 -1.147 18804 3412 1 15 . 1 1 659 659 VAL H H 659 8.150 8.150 7.586 0.564 18804 3413 1 15 . 1 1 660 660 VAL N N 660 119.240 119.240 120.530 -1.290 18804 3414 1 15 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.603 -0.114 18804 3415 1 15 . 1 1 660 660 VAL C C 660 176.494 176.494 177.571 -1.077 18804 3416 1 15 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.280 0.070 18804 3417 1 15 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.828 -0.438 18804 3418 1 15 . 1 1 660 660 VAL H H 660 8.220 8.220 8.126 0.094 18804 3419 1 15 . 1 1 661 661 ALA N N 661 121.414 121.414 122.424 -1.010 18804 3420 1 15 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.034 -0.142 18804 3421 1 15 . 1 1 661 661 ALA C C 661 178.419 178.419 179.866 -1.447 18804 3422 1 15 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.328 -0.233 18804 3423 1 15 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.162 -0.863 18804 3424 1 15 . 1 1 661 661 ALA H H 661 8.562 8.562 7.801 0.761 18804 3425 1 15 . 1 1 662 662 LEU N N 662 117.019 117.019 118.813 -1.794 18804 3426 1 15 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.891 0.086 18804 3427 1 15 . 1 1 662 662 LEU C C 662 178.078 178.078 179.211 -1.133 18804 3428 1 15 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.569 -0.253 18804 3429 1 15 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.676 -0.637 18804 3430 1 15 . 1 1 662 662 LEU H H 662 8.460 8.460 7.924 0.536 18804 3431 1 15 . 1 1 663 663 GLY N N 663 106.924 106.924 107.298 -0.374 18804 3432 1 15 . 1 1 663 663 GLY C C 663 174.372 174.372 176.128 -1.756 18804 3433 1 15 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.280 -0.181 18804 3434 1 15 . 1 1 663 663 GLY H H 663 8.683 8.683 8.026 0.657 18804 3435 1 15 . 1 1 664 664 ILE N N 664 121.523 121.523 122.749 -1.226 18804 3436 1 15 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.671 0.028 18804 3437 1 15 . 1 1 664 664 ILE C C 664 177.614 177.614 178.120 -0.506 18804 3438 1 15 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.094 -0.059 18804 3439 1 15 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.681 -0.849 18804 3440 1 15 . 1 1 664 664 ILE H H 664 8.750 8.750 8.167 0.583 18804 3441 1 15 . 1 1 665 665 GLY N N 665 107.803 107.803 108.455 -0.652 18804 3442 1 15 . 1 1 665 665 GLY C C 665 174.402 174.402 176.216 -1.814 18804 3443 1 15 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.341 -0.132 18804 3444 1 15 . 1 1 665 665 GLY H H 665 8.689 8.689 8.150 0.539 18804 3445 1 15 . 1 1 666 666 LEU N N 666 121.365 121.365 122.137 -0.772 18804 3446 1 15 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.070 -0.035 18804 3447 1 15 . 1 1 666 666 LEU C C 666 178.291 178.291 178.955 -0.664 18804 3448 1 15 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.105 0.226 18804 3449 1 15 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.835 -0.615 18804 3450 1 15 . 1 1 666 666 LEU H H 666 8.744 8.744 7.892 0.852 18804 3451 1 15 . 1 1 667 667 PHE N N 667 119.838 119.838 121.310 -1.472 18804 3452 1 15 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.165 -0.074 18804 3453 1 15 . 1 1 667 667 PHE C C 667 176.965 176.965 177.960 -0.995 18804 3454 1 15 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.455 -0.424 18804 3455 1 15 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.549 -0.788 18804 3456 1 15 . 1 1 667 667 PHE H H 667 8.454 8.454 8.460 -0.006 18804 3457 1 15 . 1 1 668 668 MET N N 668 116.868 116.868 118.177 -1.309 18804 3458 1 15 . 1 1 668 668 MET HA H 668 4.035 4.035 3.945 0.090 18804 3459 1 15 . 1 1 668 668 MET C C 668 177.678 177.678 177.760 -0.082 18804 3460 1 15 . 1 1 668 668 MET CA C 668 57.405 57.405 58.813 -1.408 18804 3461 1 15 . 1 1 668 668 MET CB C 668 31.739 31.739 32.471 -0.732 18804 3462 1 15 . 1 1 668 668 MET H H 668 8.701 8.701 8.659 0.042 18804 3463 1 15 . 1 1 669 669 ARG N N 669 118.600 118.600 115.165 3.435 18804 3464 1 15 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.095 0.040 18804 3465 1 15 . 1 1 669 669 ARG C C 669 177.120 177.120 176.841 0.279 18804 3466 1 15 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.665 -0.413 18804 3467 1 15 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.593 -1.089 18804 3468 1 15 . 1 1 669 669 ARG H H 669 8.044 8.044 7.588 0.456 18804 3469 1 15 . 1 1 670 670 ARG N N 670 118.124 118.124 119.583 -1.459 18804 3470 1 15 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.471 -0.346 18804 3471 1 15 . 1 1 670 670 ARG C C 670 176.240 176.240 174.790 1.450 18804 3472 1 15 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.471 2.267 18804 3473 1 15 . 1 1 670 670 ARG CB C 670 29.467 29.467 29.842 -0.375 18804 3474 1 15 . 1 1 670 670 ARG H H 670 7.864 7.864 7.425 0.439 18804 3475 1 15 . 1 1 671 671 ARG N N 671 117.904 117.904 121.628 -3.724 18804 3476 1 15 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.383 -0.297 18804 3477 1 15 . 1 1 671 671 ARG C C 671 175.233 175.233 175.724 -0.491 18804 3478 1 15 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.204 0.527 18804 3479 1 15 . 1 1 671 671 ARG CB C 671 29.494 29.494 32.091 -2.597 18804 3480 1 15 . 1 1 671 671 ARG H H 671 7.677 7.677 8.339 -0.662 18804 3481 1 15 . 1 1 672 672 HIS N N 672 117.048 117.048 123.545 -6.497 18804 3482 1 15 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.672 -0.069 18804 3483 1 15 . 1 1 672 672 HIS C C 672 173.634 173.634 175.056 -1.422 18804 3484 1 15 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.678 -0.837 18804 3485 1 15 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.962 -2.776 18804 3486 1 15 . 1 1 672 672 HIS H H 672 7.920 7.920 8.598 -0.678 18804 3487 1 15 . 1 1 673 673 ILE N N 673 120.795 120.795 123.514 -2.719 18804 3488 1 15 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.296 -0.222 18804 3489 1 15 . 1 1 673 673 ILE C C 673 174.922 174.922 175.864 -0.942 18804 3490 1 15 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.073 0.704 18804 3491 1 15 . 1 1 673 673 ILE CB C 673 37.836 37.836 37.560 0.276 18804 3492 1 15 . 1 1 673 673 ILE H H 673 7.900 7.900 7.618 0.282 18804 3493 1 15 . 1 1 674 674 VAL N N 674 122.867 122.867 124.974 -2.107 18804 3494 1 15 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.237 -0.156 18804 3495 1 15 . 1 1 674 674 VAL C C 674 174.876 174.876 176.102 -1.226 18804 3496 1 15 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.172 -0.802 18804 3497 1 15 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.769 -0.775 18804 3498 1 15 . 1 1 674 674 VAL H H 674 8.003 8.003 8.260 -0.257 18804 3499 1 15 . 1 1 675 675 ARG N N 675 124.866 124.866 122.685 2.181 18804 3500 1 15 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.265 -0.208 18804 3501 1 15 . 1 1 675 675 ARG C C 675 174.922 174.922 177.183 -2.261 18804 3502 1 15 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.834 -1.651 18804 3503 1 15 . 1 1 675 675 ARG CB C 675 30.316 30.316 29.930 0.386 18804 3504 1 15 . 1 1 675 675 ARG H H 675 8.266 8.266 8.624 -0.358 18804 3505 1 15 . 1 1 676 676 LYS N N 676 123.517 123.517 121.072 2.445 18804 3506 1 15 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.256 0.009 18804 3507 1 15 . 1 1 676 676 LYS C C 676 174.625 174.625 176.669 -2.044 18804 3508 1 15 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.581 -0.828 18804 3509 1 15 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.189 -2.908 18804 3510 1 15 . 1 1 676 676 LYS H H 676 8.260 8.260 7.816 0.444 18804 3511 1 16 . 1 1 635 635 GLY N N 635 108.817 108.817 109.841 -1.024 18804 3512 1 16 . 1 1 635 635 GLY C C 635 172.499 172.499 173.702 -1.203 18804 3513 1 16 . 1 1 635 635 GLY CA C 635 44.269 44.269 45.159 -0.890 18804 3514 1 16 . 1 1 635 635 GLY H H 635 8.390 8.390 8.497 -0.107 18804 3515 1 16 . 1 1 636 636 CYS N N 636 120.634 120.634 120.833 -0.199 18804 3516 1 16 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.926 0.096 18804 3517 1 16 . 1 1 636 636 CYS C C 636 172.181 172.181 173.409 -1.228 18804 3518 1 16 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.871 -4.277 18804 3519 1 16 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.911 10.577 18804 3520 1 16 . 1 1 636 636 CYS H H 636 8.327 8.327 8.179 0.148 18804 3521 1 16 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.431 0.069 18804 3522 1 16 . 1 1 637 637 PRO C C 637 176.215 176.215 176.463 -0.248 18804 3523 1 16 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.769 -1.091 18804 3524 1 16 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.709 -0.367 18804 3525 1 16 . 1 1 638 638 THR N N 638 113.690 113.690 111.972 1.718 18804 3526 1 16 . 1 1 638 638 THR HA H 638 4.305 4.305 3.955 0.350 18804 3527 1 16 . 1 1 638 638 THR C C 638 173.495 173.495 173.136 0.359 18804 3528 1 16 . 1 1 638 638 THR CA C 638 60.998 60.998 62.242 -1.244 18804 3529 1 16 . 1 1 638 638 THR CB C 638 68.954 68.954 67.631 1.323 18804 3530 1 16 . 1 1 638 638 THR H H 638 8.114 8.114 7.825 0.289 18804 3531 1 16 . 1 1 639 639 ASN N N 639 120.695 120.695 118.743 1.952 18804 3532 1 16 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.488 0.285 18804 3533 1 16 . 1 1 639 639 ASN C C 639 174.216 174.216 175.497 -1.281 18804 3534 1 16 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.782 -1.425 18804 3535 1 16 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.261 -0.680 18804 3536 1 16 . 1 1 639 639 ASN H H 639 8.301 8.301 8.044 0.257 18804 3537 1 16 . 1 1 640 640 GLY N N 640 108.827 108.827 108.994 -0.167 18804 3538 1 16 . 1 1 640 640 GLY C C 640 170.506 170.506 172.362 -1.856 18804 3539 1 16 . 1 1 640 640 GLY CA C 640 43.855 43.855 43.969 -0.114 18804 3540 1 16 . 1 1 640 640 GLY H H 640 8.111 8.111 8.420 -0.309 18804 3541 1 16 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.428 0.024 18804 3542 1 16 . 1 1 641 641 PRO C C 641 175.669 175.669 176.042 -0.373 18804 3543 1 16 . 1 1 641 641 PRO CA C 641 62.075 62.075 63.085 -1.010 18804 3544 1 16 . 1 1 641 641 PRO CB C 641 31.488 31.488 31.702 -0.214 18804 3545 1 16 . 1 1 642 642 LYS N N 642 121.521 121.521 123.989 -2.468 18804 3546 1 16 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.618 -0.292 18804 3547 1 16 . 1 1 642 642 LYS C C 642 175.106 175.106 175.557 -0.451 18804 3548 1 16 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.178 -1.075 18804 3549 1 16 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.143 -1.773 18804 3550 1 16 . 1 1 642 642 LYS H H 642 8.417 8.417 8.494 -0.077 18804 3551 1 16 . 1 1 643 643 ILE N N 643 121.410 121.410 125.257 -3.847 18804 3552 1 16 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.416 -0.081 18804 3553 1 16 . 1 1 643 643 ILE C C 643 173.587 173.587 174.734 -1.147 18804 3554 1 16 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.357 -1.483 18804 3555 1 16 . 1 1 643 643 ILE CB C 643 37.618 37.618 38.263 -0.645 18804 3556 1 16 . 1 1 643 643 ILE H H 643 8.069 8.069 8.465 -0.396 18804 3557 1 16 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.582 -0.129 18804 3558 1 16 . 1 1 644 644 PRO C C 644 175.623 175.623 177.414 -1.791 18804 3559 1 16 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.310 0.149 18804 3560 1 16 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.456 -0.948 18804 3561 1 16 . 1 1 645 645 SER N N 645 115.445 115.445 114.109 1.336 18804 3562 1 16 . 1 1 645 645 SER HA H 645 4.374 4.374 4.270 0.104 18804 3563 1 16 . 1 1 645 645 SER C C 645 174.611 174.611 176.363 -1.752 18804 3564 1 16 . 1 1 645 645 SER CA C 645 58.566 58.566 59.947 -1.381 18804 3565 1 16 . 1 1 645 645 SER CB C 645 62.842 62.842 62.834 0.008 18804 3566 1 16 . 1 1 645 645 SER H H 645 8.267 8.267 8.379 -0.112 18804 3567 1 16 . 1 1 646 646 ILE N N 646 120.612 120.612 121.702 -1.090 18804 3568 1 16 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.805 0.304 18804 3569 1 16 . 1 1 646 646 ILE C C 646 174.703 174.703 177.002 -2.299 18804 3570 1 16 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.462 -1.240 18804 3571 1 16 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.003 0.657 18804 3572 1 16 . 1 1 646 646 ILE H H 646 8.252 8.252 7.957 0.295 18804 3573 1 16 . 1 1 647 647 ALA N N 647 123.224 123.224 122.943 0.281 18804 3574 1 16 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.948 0.215 18804 3575 1 16 . 1 1 647 647 ALA C C 647 176.526 176.526 179.105 -2.579 18804 3576 1 16 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.286 -2.102 18804 3577 1 16 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.038 0.211 18804 3578 1 16 . 1 1 647 647 ALA H H 647 8.084 8.084 7.697 0.387 18804 3579 1 16 . 1 1 648 648 THR N N 648 111.699 111.699 113.934 -2.235 18804 3580 1 16 . 1 1 648 648 THR HA H 648 4.021 4.021 3.906 0.115 18804 3581 1 16 . 1 1 648 648 THR C C 648 175.018 175.018 177.013 -1.995 18804 3582 1 16 . 1 1 648 648 THR CA C 648 63.554 63.554 66.910 -3.356 18804 3583 1 16 . 1 1 648 648 THR CB C 648 68.098 68.098 68.296 -0.198 18804 3584 1 16 . 1 1 648 648 THR H H 648 7.757 7.757 7.737 0.020 18804 3585 1 16 . 1 1 649 649 GLY N N 649 108.587 108.587 109.913 -1.326 18804 3586 1 16 . 1 1 649 649 GLY C C 649 173.686 173.686 176.242 -2.556 18804 3587 1 16 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.694 -0.750 18804 3588 1 16 . 1 1 649 649 GLY H H 649 8.423 8.423 7.986 0.437 18804 3589 1 16 . 1 1 650 650 MET N N 650 119.486 119.486 121.579 -2.093 18804 3590 1 16 . 1 1 650 650 MET HA H 650 4.135 4.135 4.316 -0.181 18804 3591 1 16 . 1 1 650 650 MET C C 650 176.632 176.632 178.622 -1.990 18804 3592 1 16 . 1 1 650 650 MET CA C 650 57.749 57.749 56.865 0.884 18804 3593 1 16 . 1 1 650 650 MET CB C 650 32.067 32.067 31.661 0.406 18804 3594 1 16 . 1 1 650 650 MET H H 650 8.332 8.332 7.574 0.758 18804 3595 1 16 . 1 1 651 651 VAL N N 651 118.009 118.009 118.820 -0.811 18804 3596 1 16 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.680 -0.140 18804 3597 1 16 . 1 1 651 651 VAL C C 651 176.672 176.672 178.233 -1.561 18804 3598 1 16 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.496 -1.217 18804 3599 1 16 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.813 -0.515 18804 3600 1 16 . 1 1 651 651 VAL H H 651 8.038 8.038 8.792 -0.754 18804 3601 1 16 . 1 1 652 652 GLY N N 652 105.785 105.785 107.163 -1.378 18804 3602 1 16 . 1 1 652 652 GLY C C 652 173.359 173.359 175.436 -2.077 18804 3603 1 16 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.254 -0.266 18804 3604 1 16 . 1 1 652 652 GLY H H 652 8.157 8.157 8.024 0.133 18804 3605 1 16 . 1 1 653 653 ALA N N 653 121.803 121.803 124.988 -3.185 18804 3606 1 16 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.201 -0.274 18804 3607 1 16 . 1 1 653 653 ALA C C 653 177.608 177.608 179.595 -1.987 18804 3608 1 16 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.647 0.000 18804 3609 1 16 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.340 -0.783 18804 3610 1 16 . 1 1 653 653 ALA H H 653 8.050 8.050 7.753 0.297 18804 3611 1 16 . 1 1 654 654 LEU N N 654 116.652 116.652 119.715 -3.063 18804 3612 1 16 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.867 0.085 18804 3613 1 16 . 1 1 654 654 LEU C C 654 177.361 177.361 179.155 -1.794 18804 3614 1 16 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.152 -0.890 18804 3615 1 16 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.755 -0.852 18804 3616 1 16 . 1 1 654 654 LEU H H 654 7.919 7.919 8.335 -0.416 18804 3617 1 16 . 1 1 655 655 LEU N N 655 117.910 117.910 118.620 -0.710 18804 3618 1 16 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.935 0.002 18804 3619 1 16 . 1 1 655 655 LEU C C 655 177.353 177.353 179.158 -1.805 18804 3620 1 16 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.873 -0.358 18804 3621 1 16 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.610 -0.800 18804 3622 1 16 . 1 1 655 655 LEU H H 655 8.189 8.189 7.986 0.203 18804 3623 1 16 . 1 1 656 656 LEU N N 656 118.140 118.140 119.330 -1.190 18804 3624 1 16 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.897 0.012 18804 3625 1 16 . 1 1 656 656 LEU C C 656 177.304 177.304 179.227 -1.923 18804 3626 1 16 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.845 -0.348 18804 3627 1 16 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.623 -0.862 18804 3628 1 16 . 1 1 656 656 LEU H H 656 8.022 8.022 7.674 0.348 18804 3629 1 16 . 1 1 657 657 LEU N N 657 118.079 118.079 119.708 -1.629 18804 3630 1 16 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.859 -0.021 18804 3631 1 16 . 1 1 657 657 LEU C C 657 177.304 177.304 179.024 -1.720 18804 3632 1 16 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.155 -0.579 18804 3633 1 16 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.597 -0.801 18804 3634 1 16 . 1 1 657 657 LEU H H 657 8.073 8.073 8.318 -0.245 18804 3635 1 16 . 1 1 658 658 LEU N N 658 118.238 118.238 119.061 -0.823 18804 3636 1 16 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.900 0.023 18804 3637 1 16 . 1 1 658 658 LEU C C 658 177.353 177.353 179.204 -1.851 18804 3638 1 16 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.125 -0.616 18804 3639 1 16 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.605 -0.716 18804 3640 1 16 . 1 1 658 658 LEU H H 658 8.148 8.148 7.715 0.433 18804 3641 1 16 . 1 1 659 659 VAL N N 659 117.951 117.951 118.342 -0.391 18804 3642 1 16 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.631 -0.127 18804 3643 1 16 . 1 1 659 659 VAL C C 659 176.888 176.888 178.276 -1.388 18804 3644 1 16 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.776 -0.284 18804 3645 1 16 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.029 -0.657 18804 3646 1 16 . 1 1 659 659 VAL H H 659 8.150 8.150 7.770 0.380 18804 3647 1 16 . 1 1 660 660 VAL N N 660 119.240 119.240 120.501 -1.261 18804 3648 1 16 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.544 -0.055 18804 3649 1 16 . 1 1 660 660 VAL C C 660 176.494 176.494 177.566 -1.072 18804 3650 1 16 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.900 -0.550 18804 3651 1 16 . 1 1 660 660 VAL CB C 660 30.390 30.390 31.239 -0.849 18804 3652 1 16 . 1 1 660 660 VAL H H 660 8.220 8.220 8.028 0.192 18804 3653 1 16 . 1 1 661 661 ALA N N 661 121.414 121.414 122.626 -1.212 18804 3654 1 16 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.002 -0.110 18804 3655 1 16 . 1 1 661 661 ALA C C 661 178.419 178.419 179.612 -1.193 18804 3656 1 16 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.377 -0.282 18804 3657 1 16 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.157 -0.858 18804 3658 1 16 . 1 1 661 661 ALA H H 661 8.562 8.562 7.852 0.710 18804 3659 1 16 . 1 1 662 662 LEU N N 662 117.019 117.019 118.842 -1.823 18804 3660 1 16 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.869 0.108 18804 3661 1 16 . 1 1 662 662 LEU C C 662 178.078 178.078 179.250 -1.172 18804 3662 1 16 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.684 -0.368 18804 3663 1 16 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.670 -0.631 18804 3664 1 16 . 1 1 662 662 LEU H H 662 8.460 8.460 7.971 0.489 18804 3665 1 16 . 1 1 663 663 GLY N N 663 106.924 106.924 107.235 -0.311 18804 3666 1 16 . 1 1 663 663 GLY C C 663 174.372 174.372 176.117 -1.745 18804 3667 1 16 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.240 -0.141 18804 3668 1 16 . 1 1 663 663 GLY H H 663 8.683 8.683 7.974 0.709 18804 3669 1 16 . 1 1 664 664 ILE N N 664 121.523 121.523 122.805 -1.282 18804 3670 1 16 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.652 0.047 18804 3671 1 16 . 1 1 664 664 ILE C C 664 177.614 177.614 178.122 -0.508 18804 3672 1 16 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.083 -0.048 18804 3673 1 16 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.671 -0.839 18804 3674 1 16 . 1 1 664 664 ILE H H 664 8.750 8.750 8.186 0.564 18804 3675 1 16 . 1 1 665 665 GLY N N 665 107.803 107.803 108.352 -0.549 18804 3676 1 16 . 1 1 665 665 GLY C C 665 174.402 174.402 176.232 -1.830 18804 3677 1 16 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.331 -0.122 18804 3678 1 16 . 1 1 665 665 GLY H H 665 8.689 8.689 8.231 0.458 18804 3679 1 16 . 1 1 666 666 LEU N N 666 121.365 121.365 122.084 -0.719 18804 3680 1 16 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.070 -0.035 18804 3681 1 16 . 1 1 666 666 LEU C C 666 178.291 178.291 178.944 -0.653 18804 3682 1 16 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.080 0.251 18804 3683 1 16 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.836 -0.616 18804 3684 1 16 . 1 1 666 666 LEU H H 666 8.744 8.744 7.893 0.851 18804 3685 1 16 . 1 1 667 667 PHE N N 667 119.838 119.838 121.341 -1.503 18804 3686 1 16 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.264 -0.173 18804 3687 1 16 . 1 1 667 667 PHE C C 667 176.965 176.965 177.201 -0.236 18804 3688 1 16 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.015 0.016 18804 3689 1 16 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.637 -0.876 18804 3690 1 16 . 1 1 667 667 PHE H H 667 8.454 8.454 8.397 0.057 18804 3691 1 16 . 1 1 668 668 MET N N 668 116.868 116.868 116.965 -0.097 18804 3692 1 16 . 1 1 668 668 MET HA H 668 4.035 4.035 4.042 -0.007 18804 3693 1 16 . 1 1 668 668 MET C C 668 177.678 177.678 177.909 -0.231 18804 3694 1 16 . 1 1 668 668 MET CA C 668 57.405 57.405 58.691 -1.286 18804 3695 1 16 . 1 1 668 668 MET CB C 668 31.739 31.739 32.780 -1.041 18804 3696 1 16 . 1 1 668 668 MET H H 668 8.701 8.701 8.532 0.169 18804 3697 1 16 . 1 1 669 669 ARG N N 669 118.600 118.600 115.390 3.210 18804 3698 1 16 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.154 -0.019 18804 3699 1 16 . 1 1 669 669 ARG C C 669 177.120 177.120 177.139 -0.019 18804 3700 1 16 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.312 -0.060 18804 3701 1 16 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.779 -1.275 18804 3702 1 16 . 1 1 669 669 ARG H H 669 8.044 8.044 7.585 0.459 18804 3703 1 16 . 1 1 670 670 ARG N N 670 118.124 118.124 120.049 -1.925 18804 3704 1 16 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.443 -0.318 18804 3705 1 16 . 1 1 670 670 ARG C C 670 176.240 176.240 174.298 1.942 18804 3706 1 16 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.274 2.464 18804 3707 1 16 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.005 -0.538 18804 3708 1 16 . 1 1 670 670 ARG H H 670 7.864 7.864 7.484 0.380 18804 3709 1 16 . 1 1 671 671 ARG N N 671 117.904 117.904 121.061 -3.157 18804 3710 1 16 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.300 -0.214 18804 3711 1 16 . 1 1 671 671 ARG C C 671 175.233 175.233 174.961 0.272 18804 3712 1 16 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.946 0.785 18804 3713 1 16 . 1 1 671 671 ARG CB C 671 29.494 29.494 32.664 -3.170 18804 3714 1 16 . 1 1 671 671 ARG H H 671 7.677 7.677 8.298 -0.621 18804 3715 1 16 . 1 1 672 672 HIS N N 672 117.048 117.048 122.174 -5.126 18804 3716 1 16 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.381 0.222 18804 3717 1 16 . 1 1 672 672 HIS C C 672 173.634 173.634 175.291 -1.657 18804 3718 1 16 . 1 1 672 672 HIS CA C 672 54.841 54.841 57.088 -2.247 18804 3719 1 16 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.443 -1.257 18804 3720 1 16 . 1 1 672 672 HIS H H 672 7.920 7.920 8.504 -0.584 18804 3721 1 16 . 1 1 673 673 ILE N N 673 120.795 120.795 124.090 -3.295 18804 3722 1 16 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.401 -0.327 18804 3723 1 16 . 1 1 673 673 ILE C C 673 174.922 174.922 175.462 -0.540 18804 3724 1 16 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.251 0.527 18804 3725 1 16 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.601 -0.765 18804 3726 1 16 . 1 1 673 673 ILE H H 673 7.900 7.900 7.986 -0.086 18804 3727 1 16 . 1 1 674 674 VAL N N 674 122.867 122.867 126.821 -3.954 18804 3728 1 16 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.152 -0.071 18804 3729 1 16 . 1 1 674 674 VAL C C 674 174.876 174.876 176.597 -1.721 18804 3730 1 16 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.300 -0.930 18804 3731 1 16 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.745 -0.751 18804 3732 1 16 . 1 1 674 674 VAL H H 674 8.003 8.003 8.377 -0.374 18804 3733 1 16 . 1 1 675 675 ARG N N 675 124.866 124.866 126.688 -1.822 18804 3734 1 16 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.387 -0.330 18804 3735 1 16 . 1 1 675 675 ARG C C 675 174.922 174.922 175.315 -0.393 18804 3736 1 16 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.773 -0.589 18804 3737 1 16 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.891 -0.575 18804 3738 1 16 . 1 1 675 675 ARG H H 675 8.266 8.266 8.442 -0.176 18804 3739 1 16 . 1 1 676 676 LYS N N 676 123.517 123.517 121.165 2.352 18804 3740 1 16 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.498 -0.233 18804 3741 1 16 . 1 1 676 676 LYS C C 676 174.625 174.625 175.790 -1.165 18804 3742 1 16 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.424 0.329 18804 3743 1 16 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.875 -3.594 18804 3744 1 16 . 1 1 676 676 LYS H H 676 8.260 8.260 8.303 -0.043 18804 3745 1 17 . 1 1 635 635 GLY N N 635 108.817 108.817 114.147 -5.330 18804 3746 1 17 . 1 1 635 635 GLY C C 635 172.499 172.499 173.726 -1.227 18804 3747 1 17 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.803 -0.534 18804 3748 1 17 . 1 1 635 635 GLY H H 635 8.390 8.390 8.699 -0.309 18804 3749 1 17 . 1 1 636 636 CYS N N 636 120.634 120.634 121.180 -0.546 18804 3750 1 17 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.691 0.331 18804 3751 1 17 . 1 1 636 636 CYS C C 636 172.181 172.181 173.267 -1.086 18804 3752 1 17 . 1 1 636 636 CYS CA C 636 52.594 52.594 57.666 -5.072 18804 3753 1 17 . 1 1 636 636 CYS CB C 636 39.488 39.488 27.722 11.766 18804 3754 1 17 . 1 1 636 636 CYS H H 636 8.327 8.327 8.368 -0.041 18804 3755 1 17 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.431 0.069 18804 3756 1 17 . 1 1 637 637 PRO C C 637 176.215 176.215 176.394 -0.179 18804 3757 1 17 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.936 -1.258 18804 3758 1 17 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.787 -0.445 18804 3759 1 17 . 1 1 638 638 THR N N 638 113.690 113.690 111.061 2.629 18804 3760 1 17 . 1 1 638 638 THR HA H 638 4.305 4.305 3.988 0.317 18804 3761 1 17 . 1 1 638 638 THR C C 638 173.495 173.495 173.343 0.152 18804 3762 1 17 . 1 1 638 638 THR CA C 638 60.998 60.998 62.497 -1.499 18804 3763 1 17 . 1 1 638 638 THR CB C 638 68.954 68.954 67.050 1.904 18804 3764 1 17 . 1 1 638 638 THR H H 638 8.114 8.114 7.918 0.196 18804 3765 1 17 . 1 1 639 639 ASN N N 639 120.695 120.695 117.954 2.741 18804 3766 1 17 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.517 0.256 18804 3767 1 17 . 1 1 639 639 ASN C C 639 174.216 174.216 175.838 -1.622 18804 3768 1 17 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.513 -1.155 18804 3769 1 17 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.152 -0.571 18804 3770 1 17 . 1 1 639 639 ASN H H 639 8.301 8.301 7.964 0.337 18804 3771 1 17 . 1 1 640 640 GLY N N 640 108.827 108.827 106.239 2.588 18804 3772 1 17 . 1 1 640 640 GLY C C 640 170.506 170.506 172.536 -2.030 18804 3773 1 17 . 1 1 640 640 GLY CA C 640 43.855 43.855 43.741 0.114 18804 3774 1 17 . 1 1 640 640 GLY H H 640 8.111 8.111 8.794 -0.683 18804 3775 1 17 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.568 -0.116 18804 3776 1 17 . 1 1 641 641 PRO C C 641 175.669 175.669 175.494 0.175 18804 3777 1 17 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.833 -0.757 18804 3778 1 17 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.381 -0.893 18804 3779 1 17 . 1 1 642 642 LYS N N 642 121.521 121.521 119.919 1.602 18804 3780 1 17 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.529 -0.203 18804 3781 1 17 . 1 1 642 642 LYS C C 642 175.106 175.106 174.950 0.156 18804 3782 1 17 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.784 -0.681 18804 3783 1 17 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.034 -1.664 18804 3784 1 17 . 1 1 642 642 LYS H H 642 8.417 8.417 8.068 0.349 18804 3785 1 17 . 1 1 643 643 ILE N N 643 121.410 121.410 123.562 -2.152 18804 3786 1 17 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.449 -0.114 18804 3787 1 17 . 1 1 643 643 ILE C C 643 173.587 173.587 174.875 -1.288 18804 3788 1 17 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.770 -1.896 18804 3789 1 17 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.603 0.015 18804 3790 1 17 . 1 1 643 643 ILE H H 643 8.069 8.069 8.522 -0.453 18804 3791 1 17 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.557 -0.104 18804 3792 1 17 . 1 1 644 644 PRO C C 644 175.623 175.623 177.697 -2.074 18804 3793 1 17 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.413 0.046 18804 3794 1 17 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.383 -0.875 18804 3795 1 17 . 1 1 645 645 SER N N 645 115.445 115.445 114.059 1.386 18804 3796 1 17 . 1 1 645 645 SER HA H 645 4.374 4.374 4.292 0.082 18804 3797 1 17 . 1 1 645 645 SER C C 645 174.611 174.611 176.210 -1.599 18804 3798 1 17 . 1 1 645 645 SER CA C 645 58.566 58.566 60.515 -1.949 18804 3799 1 17 . 1 1 645 645 SER CB C 645 62.842 62.842 62.634 0.208 18804 3800 1 17 . 1 1 645 645 SER H H 645 8.267 8.267 8.507 -0.240 18804 3801 1 17 . 1 1 646 646 ILE N N 646 120.612 120.612 121.641 -1.029 18804 3802 1 17 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.824 0.285 18804 3803 1 17 . 1 1 646 646 ILE C C 646 174.703 174.703 176.947 -2.244 18804 3804 1 17 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.607 -1.385 18804 3805 1 17 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.998 0.662 18804 3806 1 17 . 1 1 646 646 ILE H H 646 8.252 8.252 7.941 0.311 18804 3807 1 17 . 1 1 647 647 ALA N N 647 123.224 123.224 123.463 -0.239 18804 3808 1 17 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.895 0.268 18804 3809 1 17 . 1 1 647 647 ALA C C 647 176.526 176.526 179.077 -2.551 18804 3810 1 17 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.064 -1.880 18804 3811 1 17 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.050 0.199 18804 3812 1 17 . 1 1 647 647 ALA H H 647 8.084 8.084 7.664 0.420 18804 3813 1 17 . 1 1 648 648 THR N N 648 111.699 111.699 114.947 -3.248 18804 3814 1 17 . 1 1 648 648 THR HA H 648 4.021 4.021 3.904 0.117 18804 3815 1 17 . 1 1 648 648 THR C C 648 175.018 175.018 177.014 -1.996 18804 3816 1 17 . 1 1 648 648 THR CA C 648 63.554 63.554 67.204 -3.650 18804 3817 1 17 . 1 1 648 648 THR CB C 648 68.098 68.098 68.246 -0.148 18804 3818 1 17 . 1 1 648 648 THR H H 648 7.757 7.757 7.756 0.001 18804 3819 1 17 . 1 1 649 649 GLY N N 649 108.587 108.587 109.164 -0.577 18804 3820 1 17 . 1 1 649 649 GLY C C 649 173.686 173.686 176.107 -2.421 18804 3821 1 17 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.809 -0.864 18804 3822 1 17 . 1 1 649 649 GLY H H 649 8.423 8.423 7.821 0.602 18804 3823 1 17 . 1 1 650 650 MET N N 650 119.486 119.486 121.454 -1.968 18804 3824 1 17 . 1 1 650 650 MET HA H 650 4.135 4.135 4.267 -0.132 18804 3825 1 17 . 1 1 650 650 MET C C 650 176.632 176.632 178.649 -2.017 18804 3826 1 17 . 1 1 650 650 MET CA C 650 57.749 57.749 56.856 0.893 18804 3827 1 17 . 1 1 650 650 MET CB C 650 32.067 32.067 31.549 0.518 18804 3828 1 17 . 1 1 650 650 MET H H 650 8.332 8.332 7.583 0.749 18804 3829 1 17 . 1 1 651 651 VAL N N 651 118.009 118.009 119.160 -1.151 18804 3830 1 17 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.683 -0.143 18804 3831 1 17 . 1 1 651 651 VAL C C 651 176.672 176.672 178.307 -1.635 18804 3832 1 17 . 1 1 651 651 VAL CA C 651 66.279 66.279 66.319 -0.040 18804 3833 1 17 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.473 -0.175 18804 3834 1 17 . 1 1 651 651 VAL H H 651 8.038 8.038 8.765 -0.727 18804 3835 1 17 . 1 1 652 652 GLY N N 652 105.785 105.785 106.787 -1.002 18804 3836 1 17 . 1 1 652 652 GLY C C 652 173.359 173.359 175.420 -2.061 18804 3837 1 17 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.259 -0.271 18804 3838 1 17 . 1 1 652 652 GLY H H 652 8.157 8.157 7.999 0.158 18804 3839 1 17 . 1 1 653 653 ALA N N 653 121.803 121.803 124.990 -3.187 18804 3840 1 17 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.203 -0.276 18804 3841 1 17 . 1 1 653 653 ALA C C 653 177.608 177.608 179.622 -2.014 18804 3842 1 17 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.636 0.010 18804 3843 1 17 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.346 -0.789 18804 3844 1 17 . 1 1 653 653 ALA H H 653 8.050 8.050 7.776 0.274 18804 3845 1 17 . 1 1 654 654 LEU N N 654 116.652 116.652 119.780 -3.128 18804 3846 1 17 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.871 0.081 18804 3847 1 17 . 1 1 654 654 LEU C C 654 177.361 177.361 179.134 -1.773 18804 3848 1 17 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.181 -0.919 18804 3849 1 17 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.781 -0.878 18804 3850 1 17 . 1 1 654 654 LEU H H 654 7.919 7.919 8.407 -0.488 18804 3851 1 17 . 1 1 655 655 LEU N N 655 117.910 117.910 118.670 -0.760 18804 3852 1 17 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.932 0.005 18804 3853 1 17 . 1 1 655 655 LEU C C 655 177.353 177.353 179.188 -1.835 18804 3854 1 17 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.897 -0.382 18804 3855 1 17 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.602 -0.792 18804 3856 1 17 . 1 1 655 655 LEU H H 655 8.189 8.189 8.013 0.176 18804 3857 1 17 . 1 1 656 656 LEU N N 656 118.140 118.140 119.244 -1.104 18804 3858 1 17 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.911 -0.002 18804 3859 1 17 . 1 1 656 656 LEU C C 656 177.304 177.304 179.218 -1.914 18804 3860 1 17 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.811 -0.314 18804 3861 1 17 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.651 -0.890 18804 3862 1 17 . 1 1 656 656 LEU H H 656 8.022 8.022 7.650 0.372 18804 3863 1 17 . 1 1 657 657 LEU N N 657 118.079 118.079 119.823 -1.744 18804 3864 1 17 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.863 -0.025 18804 3865 1 17 . 1 1 657 657 LEU C C 657 177.304 177.304 179.011 -1.707 18804 3866 1 17 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.174 -0.598 18804 3867 1 17 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.614 -0.818 18804 3868 1 17 . 1 1 657 657 LEU H H 657 8.073 8.073 8.196 -0.123 18804 3869 1 17 . 1 1 658 658 LEU N N 658 118.238 118.238 118.987 -0.749 18804 3870 1 17 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.899 0.024 18804 3871 1 17 . 1 1 658 658 LEU C C 658 177.353 177.353 179.106 -1.753 18804 3872 1 17 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.189 -0.680 18804 3873 1 17 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.751 -0.862 18804 3874 1 17 . 1 1 658 658 LEU H H 658 8.148 8.148 7.718 0.430 18804 3875 1 17 . 1 1 659 659 VAL N N 659 117.951 117.951 118.773 -0.822 18804 3876 1 17 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.591 -0.087 18804 3877 1 17 . 1 1 659 659 VAL C C 659 176.888 176.888 178.060 -1.172 18804 3878 1 17 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.585 -0.093 18804 3879 1 17 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.473 -1.101 18804 3880 1 17 . 1 1 659 659 VAL H H 659 8.150 8.150 7.705 0.445 18804 3881 1 17 . 1 1 660 660 VAL N N 660 119.240 119.240 120.399 -1.159 18804 3882 1 17 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.601 -0.112 18804 3883 1 17 . 1 1 660 660 VAL C C 660 176.494 176.494 177.533 -1.039 18804 3884 1 17 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.434 -0.084 18804 3885 1 17 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.898 -0.508 18804 3886 1 17 . 1 1 660 660 VAL H H 660 8.220 8.220 7.862 0.358 18804 3887 1 17 . 1 1 661 661 ALA N N 661 121.414 121.414 122.417 -1.003 18804 3888 1 17 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.019 -0.127 18804 3889 1 17 . 1 1 661 661 ALA C C 661 178.419 178.419 179.782 -1.363 18804 3890 1 17 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.321 -0.225 18804 3891 1 17 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.143 -0.844 18804 3892 1 17 . 1 1 661 661 ALA H H 661 8.562 8.562 7.829 0.733 18804 3893 1 17 . 1 1 662 662 LEU N N 662 117.019 117.019 118.931 -1.912 18804 3894 1 17 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.865 0.112 18804 3895 1 17 . 1 1 662 662 LEU C C 662 178.078 178.078 179.232 -1.154 18804 3896 1 17 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.770 -0.454 18804 3897 1 17 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.661 -0.622 18804 3898 1 17 . 1 1 662 662 LEU H H 662 8.460 8.460 7.958 0.501 18804 3899 1 17 . 1 1 663 663 GLY N N 663 106.924 106.924 107.149 -0.225 18804 3900 1 17 . 1 1 663 663 GLY C C 663 174.372 174.372 176.148 -1.776 18804 3901 1 17 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.243 -0.144 18804 3902 1 17 . 1 1 663 663 GLY H H 663 8.683 8.683 7.884 0.799 18804 3903 1 17 . 1 1 664 664 ILE N N 664 121.523 121.523 122.825 -1.302 18804 3904 1 17 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.655 0.044 18804 3905 1 17 . 1 1 664 664 ILE C C 664 177.614 177.614 178.126 -0.512 18804 3906 1 17 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.024 0.011 18804 3907 1 17 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.668 -0.836 18804 3908 1 17 . 1 1 664 664 ILE H H 664 8.750 8.750 8.127 0.623 18804 3909 1 17 . 1 1 665 665 GLY N N 665 107.803 107.803 108.449 -0.646 18804 3910 1 17 . 1 1 665 665 GLY C C 665 174.402 174.402 176.218 -1.816 18804 3911 1 17 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.368 -0.159 18804 3912 1 17 . 1 1 665 665 GLY H H 665 8.689 8.689 8.350 0.339 18804 3913 1 17 . 1 1 666 666 LEU N N 666 121.365 121.365 122.118 -0.753 18804 3914 1 17 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.093 -0.058 18804 3915 1 17 . 1 1 666 666 LEU C C 666 178.291 178.291 178.950 -0.659 18804 3916 1 17 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.118 0.213 18804 3917 1 17 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.833 -0.613 18804 3918 1 17 . 1 1 666 666 LEU H H 666 8.744 8.744 7.907 0.837 18804 3919 1 17 . 1 1 667 667 PHE N N 667 119.838 119.838 121.586 -1.748 18804 3920 1 17 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.400 -0.309 18804 3921 1 17 . 1 1 667 667 PHE C C 667 176.965 176.965 177.375 -0.410 18804 3922 1 17 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.259 -0.228 18804 3923 1 17 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.573 -0.812 18804 3924 1 17 . 1 1 667 667 PHE H H 667 8.454 8.454 8.532 -0.078 18804 3925 1 17 . 1 1 668 668 MET N N 668 116.868 116.868 117.039 -0.171 18804 3926 1 17 . 1 1 668 668 MET HA H 668 4.035 4.035 3.984 0.051 18804 3927 1 17 . 1 1 668 668 MET C C 668 177.678 177.678 178.371 -0.693 18804 3928 1 17 . 1 1 668 668 MET CA C 668 57.405 57.405 59.048 -1.643 18804 3929 1 17 . 1 1 668 668 MET CB C 668 31.739 31.739 32.792 -1.053 18804 3930 1 17 . 1 1 668 668 MET H H 668 8.701 8.701 8.530 0.171 18804 3931 1 17 . 1 1 669 669 ARG N N 669 118.600 118.600 116.248 2.352 18804 3932 1 17 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.123 0.012 18804 3933 1 17 . 1 1 669 669 ARG C C 669 177.120 177.120 177.142 -0.022 18804 3934 1 17 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.624 -0.372 18804 3935 1 17 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.804 -1.300 18804 3936 1 17 . 1 1 669 669 ARG H H 669 8.044 8.044 7.618 0.426 18804 3937 1 17 . 1 1 670 670 ARG N N 670 118.124 118.124 118.583 -0.459 18804 3938 1 17 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.438 -0.313 18804 3939 1 17 . 1 1 670 670 ARG C C 670 176.240 176.240 174.014 2.226 18804 3940 1 17 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.850 1.887 18804 3941 1 17 . 1 1 670 670 ARG CB C 670 29.467 29.467 31.270 -1.804 18804 3942 1 17 . 1 1 670 670 ARG H H 670 7.864 7.864 7.586 0.278 18804 3943 1 17 . 1 1 671 671 ARG N N 671 117.904 117.904 125.255 -7.351 18804 3944 1 17 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.137 -0.051 18804 3945 1 17 . 1 1 671 671 ARG C C 671 175.233 175.233 175.294 -0.061 18804 3946 1 17 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.278 0.453 18804 3947 1 17 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.592 -1.098 18804 3948 1 17 . 1 1 671 671 ARG H H 671 7.677 7.677 8.325 -0.648 18804 3949 1 17 . 1 1 672 672 HIS N N 672 117.048 117.048 122.720 -5.672 18804 3950 1 17 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.721 -0.118 18804 3951 1 17 . 1 1 672 672 HIS C C 672 173.634 173.634 174.619 -0.985 18804 3952 1 17 . 1 1 672 672 HIS CA C 672 54.841 54.841 54.065 0.776 18804 3953 1 17 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.326 -1.140 18804 3954 1 17 . 1 1 672 672 HIS H H 672 7.920 7.920 8.227 -0.307 18804 3955 1 17 . 1 1 673 673 ILE N N 673 120.795 120.795 126.064 -5.269 18804 3956 1 17 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.224 -0.150 18804 3957 1 17 . 1 1 673 673 ILE C C 673 174.922 174.922 175.339 -0.417 18804 3958 1 17 . 1 1 673 673 ILE CA C 673 60.777 60.777 61.046 -0.269 18804 3959 1 17 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.141 -0.305 18804 3960 1 17 . 1 1 673 673 ILE H H 673 7.900 7.900 8.415 -0.515 18804 3961 1 17 . 1 1 674 674 VAL N N 674 122.867 122.867 123.310 -0.443 18804 3962 1 17 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.504 -0.423 18804 3963 1 17 . 1 1 674 674 VAL C C 674 174.876 174.876 175.542 -0.666 18804 3964 1 17 . 1 1 674 674 VAL CA C 674 61.370 61.370 61.310 0.060 18804 3965 1 17 . 1 1 674 674 VAL CB C 674 31.994 31.994 33.583 -1.589 18804 3966 1 17 . 1 1 674 674 VAL H H 674 8.003 8.003 8.240 -0.237 18804 3967 1 17 . 1 1 675 675 ARG N N 675 124.866 124.866 125.232 -0.366 18804 3968 1 17 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.323 -0.266 18804 3969 1 17 . 1 1 675 675 ARG C C 675 174.922 174.922 176.682 -1.760 18804 3970 1 17 . 1 1 675 675 ARG CA C 675 55.184 55.184 57.066 -1.883 18804 3971 1 17 . 1 1 675 675 ARG CB C 675 30.316 30.316 30.586 -0.270 18804 3972 1 17 . 1 1 675 675 ARG H H 675 8.266 8.266 8.574 -0.308 18804 3973 1 17 . 1 1 676 676 LYS N N 676 123.517 123.517 121.802 1.715 18804 3974 1 17 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.226 0.039 18804 3975 1 17 . 1 1 676 676 LYS C C 676 174.625 174.625 176.930 -2.305 18804 3976 1 17 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.875 -1.122 18804 3977 1 17 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.829 -2.548 18804 3978 1 17 . 1 1 676 676 LYS H H 676 8.260 8.260 8.126 0.134 18804 3979 1 18 . 1 1 635 635 GLY N N 635 108.817 108.817 112.408 -3.591 18804 3980 1 18 . 1 1 635 635 GLY C C 635 172.499 172.499 174.504 -2.005 18804 3981 1 18 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.746 -0.477 18804 3982 1 18 . 1 1 635 635 GLY H H 635 8.390 8.390 8.739 -0.349 18804 3983 1 18 . 1 1 636 636 CYS N N 636 120.634 120.634 120.504 0.130 18804 3984 1 18 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.197 0.825 18804 3985 1 18 . 1 1 636 636 CYS C C 636 172.181 172.181 174.415 -2.234 18804 3986 1 18 . 1 1 636 636 CYS CA C 636 52.594 52.594 58.170 -5.576 18804 3987 1 18 . 1 1 636 636 CYS CB C 636 39.488 39.488 26.717 12.771 18804 3988 1 18 . 1 1 636 636 CYS H H 636 8.327 8.327 8.194 0.133 18804 3989 1 18 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.339 0.161 18804 3990 1 18 . 1 1 637 637 PRO C C 637 176.215 176.215 176.766 -0.551 18804 3991 1 18 . 1 1 637 637 PRO CA C 637 62.678 62.678 64.612 -1.934 18804 3992 1 18 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.699 -0.357 18804 3993 1 18 . 1 1 638 638 THR N N 638 113.690 113.690 113.248 0.442 18804 3994 1 18 . 1 1 638 638 THR HA H 638 4.305 4.305 4.174 0.131 18804 3995 1 18 . 1 1 638 638 THR C C 638 173.495 173.495 174.154 -0.659 18804 3996 1 18 . 1 1 638 638 THR CA C 638 60.998 60.998 64.317 -3.319 18804 3997 1 18 . 1 1 638 638 THR CB C 638 68.954 68.954 68.745 0.209 18804 3998 1 18 . 1 1 638 638 THR H H 638 8.114 8.114 8.030 0.084 18804 3999 1 18 . 1 1 639 639 ASN N N 639 120.695 120.695 120.106 0.589 18804 4000 1 18 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.807 -0.034 18804 4001 1 18 . 1 1 639 639 ASN C C 639 174.216 174.216 174.318 -0.102 18804 4002 1 18 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.806 -0.449 18804 4003 1 18 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.207 -0.626 18804 4004 1 18 . 1 1 639 639 ASN H H 639 8.301 8.301 7.604 0.697 18804 4005 1 18 . 1 1 640 640 GLY N N 640 108.827 108.827 111.539 -2.712 18804 4006 1 18 . 1 1 640 640 GLY C C 640 170.506 170.506 172.476 -1.970 18804 4007 1 18 . 1 1 640 640 GLY CA C 640 43.855 43.855 45.758 -1.903 18804 4008 1 18 . 1 1 640 640 GLY H H 640 8.111 8.111 8.347 -0.236 18804 4009 1 18 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.546 -0.094 18804 4010 1 18 . 1 1 641 641 PRO C C 641 175.669 175.669 175.747 -0.078 18804 4011 1 18 . 1 1 641 641 PRO CA C 641 62.075 62.075 63.039 -0.964 18804 4012 1 18 . 1 1 641 641 PRO CB C 641 31.488 31.488 30.572 0.916 18804 4013 1 18 . 1 1 642 642 LYS N N 642 121.521 121.521 122.612 -1.091 18804 4014 1 18 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.503 -0.177 18804 4015 1 18 . 1 1 642 642 LYS C C 642 175.106 175.106 175.764 -0.658 18804 4016 1 18 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.493 -0.390 18804 4017 1 18 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.684 -2.314 18804 4018 1 18 . 1 1 642 642 LYS H H 642 8.417 8.417 8.052 0.365 18804 4019 1 18 . 1 1 643 643 ILE N N 643 121.410 121.410 122.532 -1.122 18804 4020 1 18 . 1 1 643 643 ILE HA H 643 4.335 4.335 3.891 0.444 18804 4021 1 18 . 1 1 643 643 ILE C C 643 173.587 173.587 174.615 -1.028 18804 4022 1 18 . 1 1 643 643 ILE CA C 643 57.874 57.874 60.786 -2.912 18804 4023 1 18 . 1 1 643 643 ILE CB C 643 37.618 37.618 36.876 0.742 18804 4024 1 18 . 1 1 643 643 ILE H H 643 8.069 8.069 8.577 -0.508 18804 4025 1 18 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.607 -0.154 18804 4026 1 18 . 1 1 644 644 PRO C C 644 175.623 175.623 177.805 -2.182 18804 4027 1 18 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.448 0.011 18804 4028 1 18 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.400 -0.892 18804 4029 1 18 . 1 1 645 645 SER N N 645 115.445 115.445 113.978 1.467 18804 4030 1 18 . 1 1 645 645 SER HA H 645 4.374 4.374 4.288 0.086 18804 4031 1 18 . 1 1 645 645 SER C C 645 174.611 174.611 176.329 -1.718 18804 4032 1 18 . 1 1 645 645 SER CA C 645 58.566 58.566 60.686 -2.120 18804 4033 1 18 . 1 1 645 645 SER CB C 645 62.842 62.842 62.468 0.374 18804 4034 1 18 . 1 1 645 645 SER H H 645 8.267 8.267 8.556 -0.289 18804 4035 1 18 . 1 1 646 646 ILE N N 646 120.612 120.612 122.272 -1.660 18804 4036 1 18 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.818 0.291 18804 4037 1 18 . 1 1 646 646 ILE C C 646 174.703 174.703 176.911 -2.208 18804 4038 1 18 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.682 -1.460 18804 4039 1 18 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.169 0.492 18804 4040 1 18 . 1 1 646 646 ILE H H 646 8.252 8.252 7.923 0.329 18804 4041 1 18 . 1 1 647 647 ALA N N 647 123.224 123.224 122.773 0.451 18804 4042 1 18 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.926 0.237 18804 4043 1 18 . 1 1 647 647 ALA C C 647 176.526 176.526 179.161 -2.635 18804 4044 1 18 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.320 -2.136 18804 4045 1 18 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.905 0.344 18804 4046 1 18 . 1 1 647 647 ALA H H 647 8.084 8.084 7.621 0.463 18804 4047 1 18 . 1 1 648 648 THR N N 648 111.699 111.699 114.669 -2.970 18804 4048 1 18 . 1 1 648 648 THR HA H 648 4.021 4.021 3.920 0.101 18804 4049 1 18 . 1 1 648 648 THR C C 648 175.018 175.018 177.053 -2.035 18804 4050 1 18 . 1 1 648 648 THR CA C 648 63.554 63.554 66.734 -3.180 18804 4051 1 18 . 1 1 648 648 THR CB C 648 68.098 68.098 68.196 -0.098 18804 4052 1 18 . 1 1 648 648 THR H H 648 7.757 7.757 7.717 0.040 18804 4053 1 18 . 1 1 649 649 GLY N N 649 108.587 108.587 109.182 -0.595 18804 4054 1 18 . 1 1 649 649 GLY C C 649 173.686 173.686 176.104 -2.418 18804 4055 1 18 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.803 -0.859 18804 4056 1 18 . 1 1 649 649 GLY H H 649 8.423 8.423 7.938 0.485 18804 4057 1 18 . 1 1 650 650 MET N N 650 119.486 119.486 121.770 -2.284 18804 4058 1 18 . 1 1 650 650 MET HA H 650 4.135 4.135 4.261 -0.126 18804 4059 1 18 . 1 1 650 650 MET C C 650 176.632 176.632 178.645 -2.013 18804 4060 1 18 . 1 1 650 650 MET CA C 650 57.749 57.749 56.681 1.068 18804 4061 1 18 . 1 1 650 650 MET CB C 650 32.067 32.067 31.330 0.737 18804 4062 1 18 . 1 1 650 650 MET H H 650 8.332 8.332 7.537 0.795 18804 4063 1 18 . 1 1 651 651 VAL N N 651 118.009 118.009 118.584 -0.575 18804 4064 1 18 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.664 -0.124 18804 4065 1 18 . 1 1 651 651 VAL C C 651 176.672 176.672 178.432 -1.760 18804 4066 1 18 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.343 -1.064 18804 4067 1 18 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.731 -0.433 18804 4068 1 18 . 1 1 651 651 VAL H H 651 8.038 8.038 8.640 -0.602 18804 4069 1 18 . 1 1 652 652 GLY N N 652 105.785 105.785 106.844 -1.059 18804 4070 1 18 . 1 1 652 652 GLY C C 652 173.359 173.359 175.386 -2.027 18804 4071 1 18 . 1 1 652 652 GLY CA C 652 46.988 46.988 46.973 0.015 18804 4072 1 18 . 1 1 652 652 GLY H H 652 8.157 8.157 8.048 0.109 18804 4073 1 18 . 1 1 653 653 ALA N N 653 121.803 121.803 125.217 -3.414 18804 4074 1 18 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.214 -0.287 18804 4075 1 18 . 1 1 653 653 ALA C C 653 177.608 177.608 179.676 -2.068 18804 4076 1 18 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.657 -0.010 18804 4077 1 18 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.339 -0.782 18804 4078 1 18 . 1 1 653 653 ALA H H 653 8.050 8.050 7.929 0.121 18804 4079 1 18 . 1 1 654 654 LEU N N 654 116.652 116.652 119.528 -2.876 18804 4080 1 18 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.901 0.051 18804 4081 1 18 . 1 1 654 654 LEU C C 654 177.361 177.361 179.124 -1.763 18804 4082 1 18 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.159 -0.897 18804 4083 1 18 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.791 -0.888 18804 4084 1 18 . 1 1 654 654 LEU H H 654 7.919 7.919 8.404 -0.485 18804 4085 1 18 . 1 1 655 655 LEU N N 655 117.910 117.910 118.634 -0.724 18804 4086 1 18 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.949 -0.012 18804 4087 1 18 . 1 1 655 655 LEU C C 655 177.353 177.353 179.162 -1.809 18804 4088 1 18 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.872 -0.357 18804 4089 1 18 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.528 -0.718 18804 4090 1 18 . 1 1 655 655 LEU H H 655 8.189 8.189 7.694 0.495 18804 4091 1 18 . 1 1 656 656 LEU N N 656 118.140 118.140 119.263 -1.123 18804 4092 1 18 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.895 0.014 18804 4093 1 18 . 1 1 656 656 LEU C C 656 177.304 177.304 179.155 -1.851 18804 4094 1 18 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.856 -0.359 18804 4095 1 18 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.617 -0.856 18804 4096 1 18 . 1 1 656 656 LEU H H 656 8.022 8.022 7.821 0.201 18804 4097 1 18 . 1 1 657 657 LEU N N 657 118.079 118.079 119.596 -1.517 18804 4098 1 18 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.839 -0.001 18804 4099 1 18 . 1 1 657 657 LEU C C 657 177.304 177.304 178.998 -1.694 18804 4100 1 18 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.215 -0.639 18804 4101 1 18 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.593 -0.797 18804 4102 1 18 . 1 1 657 657 LEU H H 657 8.073 8.073 8.260 -0.187 18804 4103 1 18 . 1 1 658 658 LEU N N 658 118.238 118.238 118.901 -0.663 18804 4104 1 18 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.898 0.025 18804 4105 1 18 . 1 1 658 658 LEU C C 658 177.353 177.353 179.187 -1.834 18804 4106 1 18 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.123 -0.614 18804 4107 1 18 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.584 -0.695 18804 4108 1 18 . 1 1 658 658 LEU H H 658 8.148 8.148 7.691 0.457 18804 4109 1 18 . 1 1 659 659 VAL N N 659 117.951 117.951 118.495 -0.544 18804 4110 1 18 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.644 -0.140 18804 4111 1 18 . 1 1 659 659 VAL C C 659 176.888 176.888 178.367 -1.479 18804 4112 1 18 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.582 -0.090 18804 4113 1 18 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.031 -0.659 18804 4114 1 18 . 1 1 659 659 VAL H H 659 8.150 8.150 7.716 0.434 18804 4115 1 18 . 1 1 660 660 VAL N N 660 119.240 119.240 121.100 -1.860 18804 4116 1 18 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.624 -0.135 18804 4117 1 18 . 1 1 660 660 VAL C C 660 176.494 176.494 177.695 -1.201 18804 4118 1 18 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.587 -0.237 18804 4119 1 18 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.659 -0.269 18804 4120 1 18 . 1 1 660 660 VAL H H 660 8.220 8.220 8.284 -0.064 18804 4121 1 18 . 1 1 661 661 ALA N N 661 121.414 121.414 122.453 -1.039 18804 4122 1 18 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.019 -0.127 18804 4123 1 18 . 1 1 661 661 ALA C C 661 178.419 178.419 179.838 -1.419 18804 4124 1 18 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.373 -0.278 18804 4125 1 18 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.156 -0.857 18804 4126 1 18 . 1 1 661 661 ALA H H 661 8.562 8.562 8.085 0.477 18804 4127 1 18 . 1 1 662 662 LEU N N 662 117.019 117.019 118.821 -1.802 18804 4128 1 18 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.875 0.102 18804 4129 1 18 . 1 1 662 662 LEU C C 662 178.078 178.078 179.270 -1.192 18804 4130 1 18 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.655 -0.339 18804 4131 1 18 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.678 -0.639 18804 4132 1 18 . 1 1 662 662 LEU H H 662 8.460 8.460 7.947 0.513 18804 4133 1 18 . 1 1 663 663 GLY N N 663 106.924 106.924 107.266 -0.342 18804 4134 1 18 . 1 1 663 663 GLY C C 663 174.372 174.372 176.153 -1.781 18804 4135 1 18 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.239 -0.140 18804 4136 1 18 . 1 1 663 663 GLY H H 663 8.683 8.683 8.038 0.645 18804 4137 1 18 . 1 1 664 664 ILE N N 664 121.523 121.523 122.753 -1.230 18804 4138 1 18 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.686 0.013 18804 4139 1 18 . 1 1 664 664 ILE C C 664 177.614 177.614 178.156 -0.542 18804 4140 1 18 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.951 0.084 18804 4141 1 18 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.687 -0.855 18804 4142 1 18 . 1 1 664 664 ILE H H 664 8.750 8.750 8.353 0.397 18804 4143 1 18 . 1 1 665 665 GLY N N 665 107.803 107.803 108.546 -0.743 18804 4144 1 18 . 1 1 665 665 GLY C C 665 174.402 174.402 176.166 -1.764 18804 4145 1 18 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.354 -0.145 18804 4146 1 18 . 1 1 665 665 GLY H H 665 8.689 8.689 8.336 0.353 18804 4147 1 18 . 1 1 666 666 LEU N N 666 121.365 121.365 122.122 -0.757 18804 4148 1 18 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.144 -0.109 18804 4149 1 18 . 1 1 666 666 LEU C C 666 178.291 178.291 178.904 -0.613 18804 4150 1 18 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.133 0.198 18804 4151 1 18 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.837 -0.617 18804 4152 1 18 . 1 1 666 666 LEU H H 666 8.744 8.744 7.933 0.811 18804 4153 1 18 . 1 1 667 667 PHE N N 667 119.838 119.838 120.621 -0.783 18804 4154 1 18 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.361 -0.270 18804 4155 1 18 . 1 1 667 667 PHE C C 667 176.965 176.965 176.392 0.573 18804 4156 1 18 . 1 1 667 667 PHE CA C 667 61.031 61.031 60.804 0.227 18804 4157 1 18 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.651 -0.890 18804 4158 1 18 . 1 1 667 667 PHE H H 667 8.454 8.454 8.319 0.135 18804 4159 1 18 . 1 1 668 668 MET N N 668 116.868 116.868 116.858 0.010 18804 4160 1 18 . 1 1 668 668 MET HA H 668 4.035 4.035 4.082 -0.047 18804 4161 1 18 . 1 1 668 668 MET C C 668 177.678 177.678 178.352 -0.674 18804 4162 1 18 . 1 1 668 668 MET CA C 668 57.405 57.405 58.235 -0.830 18804 4163 1 18 . 1 1 668 668 MET CB C 668 31.739 31.739 32.882 -1.143 18804 4164 1 18 . 1 1 668 668 MET H H 668 8.701 8.701 8.416 0.285 18804 4165 1 18 . 1 1 669 669 ARG N N 669 118.600 118.600 116.795 1.805 18804 4166 1 18 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.135 0.000 18804 4167 1 18 . 1 1 669 669 ARG C C 669 177.120 177.120 177.367 -0.247 18804 4168 1 18 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.657 -0.405 18804 4169 1 18 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.919 -1.415 18804 4170 1 18 . 1 1 669 669 ARG H H 669 8.044 8.044 7.835 0.209 18804 4171 1 18 . 1 1 670 670 ARG N N 670 118.124 118.124 117.834 0.290 18804 4172 1 18 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.490 -0.365 18804 4173 1 18 . 1 1 670 670 ARG C C 670 176.240 176.240 174.250 1.990 18804 4174 1 18 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.873 1.865 18804 4175 1 18 . 1 1 670 670 ARG CB C 670 29.467 29.467 31.204 -1.737 18804 4176 1 18 . 1 1 670 670 ARG H H 670 7.864 7.864 8.065 -0.201 18804 4177 1 18 . 1 1 671 671 ARG N N 671 117.904 117.904 125.897 -7.993 18804 4178 1 18 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.355 -0.269 18804 4179 1 18 . 1 1 671 671 ARG C C 671 175.233 175.233 174.757 0.476 18804 4180 1 18 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.668 0.063 18804 4181 1 18 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.517 -1.023 18804 4182 1 18 . 1 1 671 671 ARG H H 671 7.677 7.677 8.469 -0.792 18804 4183 1 18 . 1 1 672 672 HIS N N 672 117.048 117.048 127.777 -10.729 18804 4184 1 18 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.723 -0.120 18804 4185 1 18 . 1 1 672 672 HIS C C 672 173.634 173.634 173.879 -0.245 18804 4186 1 18 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.539 -0.698 18804 4187 1 18 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.209 -2.023 18804 4188 1 18 . 1 1 672 672 HIS H H 672 7.920 7.920 8.647 -0.727 18804 4189 1 18 . 1 1 673 673 ILE N N 673 120.795 120.795 127.825 -7.030 18804 4190 1 18 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.409 -0.335 18804 4191 1 18 . 1 1 673 673 ILE C C 673 174.922 174.922 175.781 -0.859 18804 4192 1 18 . 1 1 673 673 ILE CA C 673 60.777 60.777 59.853 0.924 18804 4193 1 18 . 1 1 673 673 ILE CB C 673 37.836 37.836 40.337 -2.502 18804 4194 1 18 . 1 1 673 673 ILE H H 673 7.900 7.900 8.583 -0.683 18804 4195 1 18 . 1 1 674 674 VAL N N 674 122.867 122.867 124.995 -2.128 18804 4196 1 18 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.186 -0.105 18804 4197 1 18 . 1 1 674 674 VAL C C 674 174.876 174.876 175.522 -0.646 18804 4198 1 18 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.411 -1.041 18804 4199 1 18 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.664 -0.670 18804 4200 1 18 . 1 1 674 674 VAL H H 674 8.003 8.003 8.164 -0.161 18804 4201 1 18 . 1 1 675 675 ARG N N 675 124.866 124.866 124.311 0.555 18804 4202 1 18 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.729 -0.672 18804 4203 1 18 . 1 1 675 675 ARG C C 675 174.922 174.922 175.267 -0.345 18804 4204 1 18 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.348 -0.164 18804 4205 1 18 . 1 1 675 675 ARG CB C 675 30.316 30.316 31.574 -1.258 18804 4206 1 18 . 1 1 675 675 ARG H H 675 8.266 8.266 8.372 -0.106 18804 4207 1 18 . 1 1 676 676 LYS N N 676 123.517 123.517 122.023 1.494 18804 4208 1 18 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.723 -0.458 18804 4209 1 18 . 1 1 676 676 LYS C C 676 174.625 174.625 176.767 -2.142 18804 4210 1 18 . 1 1 676 676 LYS CA C 676 55.753 55.753 55.591 0.162 18804 4211 1 18 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.584 -3.303 18804 4212 1 18 . 1 1 676 676 LYS H H 676 8.260 8.260 8.480 -0.220 18804 4213 1 19 . 1 1 635 635 GLY N N 635 108.817 108.817 110.623 -1.806 18804 4214 1 19 . 1 1 635 635 GLY C C 635 172.499 172.499 173.569 -1.070 18804 4215 1 19 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.799 -0.530 18804 4216 1 19 . 1 1 635 635 GLY H H 635 8.390 8.390 8.548 -0.158 18804 4217 1 19 . 1 1 636 636 CYS N N 636 120.634 120.634 119.452 1.182 18804 4218 1 19 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.775 0.247 18804 4219 1 19 . 1 1 636 636 CYS C C 636 172.181 172.181 172.785 -0.604 18804 4220 1 19 . 1 1 636 636 CYS CA C 636 52.594 52.594 57.402 -4.808 18804 4221 1 19 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.989 10.499 18804 4222 1 19 . 1 1 636 636 CYS H H 636 8.327 8.327 8.369 -0.042 18804 4223 1 19 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.407 0.093 18804 4224 1 19 . 1 1 637 637 PRO C C 637 176.215 176.215 176.561 -0.346 18804 4225 1 19 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.177 -0.499 18804 4226 1 19 . 1 1 637 637 PRO CB C 637 31.342 31.342 30.121 1.221 18804 4227 1 19 . 1 1 638 638 THR N N 638 113.690 113.690 116.565 -2.875 18804 4228 1 19 . 1 1 638 638 THR HA H 638 4.305 4.305 3.913 0.392 18804 4229 1 19 . 1 1 638 638 THR C C 638 173.495 173.495 173.789 -0.294 18804 4230 1 19 . 1 1 638 638 THR CA C 638 60.998 60.998 63.258 -2.260 18804 4231 1 19 . 1 1 638 638 THR CB C 638 68.954 68.954 68.123 0.831 18804 4232 1 19 . 1 1 638 638 THR H H 638 8.114 8.114 8.336 -0.222 18804 4233 1 19 . 1 1 639 639 ASN N N 639 120.695 120.695 118.538 2.157 18804 4234 1 19 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.897 -0.124 18804 4235 1 19 . 1 1 639 639 ASN C C 639 174.216 174.216 174.225 -0.009 18804 4236 1 19 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.225 0.132 18804 4237 1 19 . 1 1 639 639 ASN CB C 639 38.581 38.581 40.584 -2.003 18804 4238 1 19 . 1 1 639 639 ASN H H 639 8.301 8.301 7.875 0.426 18804 4239 1 19 . 1 1 640 640 GLY N N 640 108.827 108.827 107.376 1.451 18804 4240 1 19 . 1 1 640 640 GLY C C 640 170.506 170.506 172.007 -1.501 18804 4241 1 19 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.948 -1.093 18804 4242 1 19 . 1 1 640 640 GLY H H 640 8.111 8.111 8.224 -0.113 18804 4243 1 19 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.568 -0.116 18804 4244 1 19 . 1 1 641 641 PRO C C 641 175.669 175.669 176.172 -0.503 18804 4245 1 19 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.823 -0.748 18804 4246 1 19 . 1 1 641 641 PRO CB C 641 31.488 31.488 31.896 -0.408 18804 4247 1 19 . 1 1 642 642 LYS N N 642 121.521 121.521 124.005 -2.484 18804 4248 1 19 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.427 -0.101 18804 4249 1 19 . 1 1 642 642 LYS C C 642 175.106 175.106 175.629 -0.523 18804 4250 1 19 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.864 -0.761 18804 4251 1 19 . 1 1 642 642 LYS CB C 642 32.370 32.370 32.994 -0.624 18804 4252 1 19 . 1 1 642 642 LYS H H 642 8.417 8.417 8.372 0.045 18804 4253 1 19 . 1 1 643 643 ILE N N 643 121.410 121.410 120.293 1.117 18804 4254 1 19 . 1 1 643 643 ILE HA H 643 4.335 4.335 3.851 0.484 18804 4255 1 19 . 1 1 643 643 ILE C C 643 173.587 173.587 174.082 -0.495 18804 4256 1 19 . 1 1 643 643 ILE CA C 643 57.874 57.874 60.787 -2.913 18804 4257 1 19 . 1 1 643 643 ILE CB C 643 37.618 37.618 36.672 0.946 18804 4258 1 19 . 1 1 643 643 ILE H H 643 8.069 8.069 7.744 0.325 18804 4259 1 19 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.599 -0.146 18804 4260 1 19 . 1 1 644 644 PRO C C 644 175.623 175.623 177.836 -2.213 18804 4261 1 19 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.493 -0.035 18804 4262 1 19 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.363 -0.855 18804 4263 1 19 . 1 1 645 645 SER N N 645 115.445 115.445 113.943 1.502 18804 4264 1 19 . 1 1 645 645 SER HA H 645 4.374 4.374 4.288 0.086 18804 4265 1 19 . 1 1 645 645 SER C C 645 174.611 174.611 176.305 -1.694 18804 4266 1 19 . 1 1 645 645 SER CA C 645 58.566 58.566 60.718 -2.152 18804 4267 1 19 . 1 1 645 645 SER CB C 645 62.842 62.842 62.660 0.182 18804 4268 1 19 . 1 1 645 645 SER H H 645 8.267 8.267 8.501 -0.234 18804 4269 1 19 . 1 1 646 646 ILE N N 646 120.612 120.612 121.698 -1.086 18804 4270 1 19 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.841 0.268 18804 4271 1 19 . 1 1 646 646 ILE C C 646 174.703 174.703 176.913 -2.210 18804 4272 1 19 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.550 -1.328 18804 4273 1 19 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.981 0.679 18804 4274 1 19 . 1 1 646 646 ILE H H 646 8.252 8.252 7.962 0.290 18804 4275 1 19 . 1 1 647 647 ALA N N 647 123.224 123.224 123.016 0.208 18804 4276 1 19 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.962 0.201 18804 4277 1 19 . 1 1 647 647 ALA C C 647 176.526 176.526 178.956 -2.430 18804 4278 1 19 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.282 -2.098 18804 4279 1 19 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.996 0.253 18804 4280 1 19 . 1 1 647 647 ALA H H 647 8.084 8.084 7.670 0.414 18804 4281 1 19 . 1 1 648 648 THR N N 648 111.699 111.699 115.060 -3.361 18804 4282 1 19 . 1 1 648 648 THR HA H 648 4.021 4.021 3.858 0.163 18804 4283 1 19 . 1 1 648 648 THR C C 648 175.018 175.018 176.975 -1.957 18804 4284 1 19 . 1 1 648 648 THR CA C 648 63.554 63.554 68.111 -4.557 18804 4285 1 19 . 1 1 648 648 THR CB C 648 68.098 68.098 68.495 -0.397 18804 4286 1 19 . 1 1 648 648 THR H H 648 7.757 7.757 7.758 -0.001 18804 4287 1 19 . 1 1 649 649 GLY N N 649 108.587 108.587 109.167 -0.580 18804 4288 1 19 . 1 1 649 649 GLY C C 649 173.686 173.686 176.074 -2.388 18804 4289 1 19 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.726 -0.782 18804 4290 1 19 . 1 1 649 649 GLY H H 649 8.423 8.423 7.769 0.654 18804 4291 1 19 . 1 1 650 650 MET N N 650 119.486 119.486 121.401 -1.915 18804 4292 1 19 . 1 1 650 650 MET HA H 650 4.135 4.135 4.265 -0.130 18804 4293 1 19 . 1 1 650 650 MET C C 650 176.632 176.632 178.692 -2.060 18804 4294 1 19 . 1 1 650 650 MET CA C 650 57.749 57.749 56.916 0.833 18804 4295 1 19 . 1 1 650 650 MET CB C 650 32.067 32.067 31.604 0.463 18804 4296 1 19 . 1 1 650 650 MET H H 650 8.332 8.332 7.601 0.731 18804 4297 1 19 . 1 1 651 651 VAL N N 651 118.009 118.009 119.023 -1.014 18804 4298 1 19 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.707 -0.167 18804 4299 1 19 . 1 1 651 651 VAL C C 651 176.672 176.672 178.207 -1.535 18804 4300 1 19 . 1 1 651 651 VAL CA C 651 66.279 66.279 66.166 0.113 18804 4301 1 19 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.502 -0.204 18804 4302 1 19 . 1 1 651 651 VAL H H 651 8.038 8.038 8.722 -0.684 18804 4303 1 19 . 1 1 652 652 GLY N N 652 105.785 105.785 107.209 -1.424 18804 4304 1 19 . 1 1 652 652 GLY C C 652 173.359 173.359 175.459 -2.100 18804 4305 1 19 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.377 -0.389 18804 4306 1 19 . 1 1 652 652 GLY H H 652 8.157 8.157 8.009 0.148 18804 4307 1 19 . 1 1 653 653 ALA N N 653 121.803 121.803 124.808 -3.005 18804 4308 1 19 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.197 -0.270 18804 4309 1 19 . 1 1 653 653 ALA C C 653 177.608 177.608 179.672 -2.064 18804 4310 1 19 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.644 0.003 18804 4311 1 19 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.360 -0.803 18804 4312 1 19 . 1 1 653 653 ALA H H 653 8.050 8.050 7.747 0.303 18804 4313 1 19 . 1 1 654 654 LEU N N 654 116.652 116.652 119.786 -3.134 18804 4314 1 19 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.884 0.068 18804 4315 1 19 . 1 1 654 654 LEU C C 654 177.361 177.361 179.136 -1.775 18804 4316 1 19 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.128 -0.866 18804 4317 1 19 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.795 -0.892 18804 4318 1 19 . 1 1 654 654 LEU H H 654 7.919 7.919 8.241 -0.322 18804 4319 1 19 . 1 1 655 655 LEU N N 655 117.910 117.910 118.758 -0.848 18804 4320 1 19 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.937 0.000 18804 4321 1 19 . 1 1 655 655 LEU C C 655 177.353 177.353 179.223 -1.870 18804 4322 1 19 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.923 -0.408 18804 4323 1 19 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.615 -0.805 18804 4324 1 19 . 1 1 655 655 LEU H H 655 8.189 8.189 8.296 -0.107 18804 4325 1 19 . 1 1 656 656 LEU N N 656 118.140 118.140 119.185 -1.045 18804 4326 1 19 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.911 -0.002 18804 4327 1 19 . 1 1 656 656 LEU C C 656 177.304 177.304 179.171 -1.867 18804 4328 1 19 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.805 -0.308 18804 4329 1 19 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.658 -0.897 18804 4330 1 19 . 1 1 656 656 LEU H H 656 8.022 8.022 7.747 0.275 18804 4331 1 19 . 1 1 657 657 LEU N N 657 118.079 118.079 119.870 -1.791 18804 4332 1 19 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.858 -0.020 18804 4333 1 19 . 1 1 657 657 LEU C C 657 177.304 177.304 178.988 -1.684 18804 4334 1 19 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.242 -0.666 18804 4335 1 19 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.625 -0.829 18804 4336 1 19 . 1 1 657 657 LEU H H 657 8.073 8.073 8.251 -0.178 18804 4337 1 19 . 1 1 658 658 LEU N N 658 118.238 118.238 118.906 -0.668 18804 4338 1 19 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.923 0.000 18804 4339 1 19 . 1 1 658 658 LEU C C 658 177.353 177.353 179.206 -1.853 18804 4340 1 19 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.025 -0.516 18804 4341 1 19 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.599 -0.710 18804 4342 1 19 . 1 1 658 658 LEU H H 658 8.148 8.148 7.707 0.441 18804 4343 1 19 . 1 1 659 659 VAL N N 659 117.951 117.951 118.800 -0.849 18804 4344 1 19 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.685 -0.181 18804 4345 1 19 . 1 1 659 659 VAL C C 659 176.888 176.888 178.340 -1.452 18804 4346 1 19 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.396 0.096 18804 4347 1 19 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.721 -0.349 18804 4348 1 19 . 1 1 659 659 VAL H H 659 8.150 8.150 7.740 0.410 18804 4349 1 19 . 1 1 660 660 VAL N N 660 119.240 119.240 120.849 -1.609 18804 4350 1 19 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.624 -0.135 18804 4351 1 19 . 1 1 660 660 VAL C C 660 176.494 176.494 177.939 -1.445 18804 4352 1 19 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.546 -0.196 18804 4353 1 19 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.504 -0.114 18804 4354 1 19 . 1 1 660 660 VAL H H 660 8.220 8.220 8.165 0.055 18804 4355 1 19 . 1 1 661 661 ALA N N 661 121.414 121.414 122.745 -1.331 18804 4356 1 19 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.008 -0.116 18804 4357 1 19 . 1 1 661 661 ALA C C 661 178.419 178.419 179.878 -1.459 18804 4358 1 19 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.405 -0.310 18804 4359 1 19 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.214 -0.915 18804 4360 1 19 . 1 1 661 661 ALA H H 661 8.562 8.562 7.834 0.728 18804 4361 1 19 . 1 1 662 662 LEU N N 662 117.019 117.019 118.806 -1.787 18804 4362 1 19 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.882 0.095 18804 4363 1 19 . 1 1 662 662 LEU C C 662 178.078 178.078 179.223 -1.145 18804 4364 1 19 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.561 -0.245 18804 4365 1 19 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.668 -0.629 18804 4366 1 19 . 1 1 662 662 LEU H H 662 8.460 8.460 7.936 0.524 18804 4367 1 19 . 1 1 663 663 GLY N N 663 106.924 106.924 107.273 -0.349 18804 4368 1 19 . 1 1 663 663 GLY C C 663 174.372 174.372 176.118 -1.746 18804 4369 1 19 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.310 -0.211 18804 4370 1 19 . 1 1 663 663 GLY H H 663 8.683 8.683 8.088 0.595 18804 4371 1 19 . 1 1 664 664 ILE N N 664 121.523 121.523 122.792 -1.269 18804 4372 1 19 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.658 0.041 18804 4373 1 19 . 1 1 664 664 ILE C C 664 177.614 177.614 178.079 -0.465 18804 4374 1 19 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.164 -0.129 18804 4375 1 19 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.676 -0.844 18804 4376 1 19 . 1 1 664 664 ILE H H 664 8.750 8.750 8.061 0.689 18804 4377 1 19 . 1 1 665 665 GLY N N 665 107.803 107.803 108.329 -0.526 18804 4378 1 19 . 1 1 665 665 GLY C C 665 174.402 174.402 176.310 -1.908 18804 4379 1 19 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.361 -0.152 18804 4380 1 19 . 1 1 665 665 GLY H H 665 8.689 8.689 8.121 0.568 18804 4381 1 19 . 1 1 666 666 LEU N N 666 121.365 121.365 122.038 -0.673 18804 4382 1 19 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.083 -0.048 18804 4383 1 19 . 1 1 666 666 LEU C C 666 178.291 178.291 178.854 -0.563 18804 4384 1 19 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.074 0.257 18804 4385 1 19 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.817 -0.597 18804 4386 1 19 . 1 1 666 666 LEU H H 666 8.744 8.744 7.928 0.816 18804 4387 1 19 . 1 1 667 667 PHE N N 667 119.838 119.838 121.021 -1.183 18804 4388 1 19 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.142 -0.051 18804 4389 1 19 . 1 1 667 667 PHE C C 667 176.965 176.965 176.724 0.241 18804 4390 1 19 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.131 -0.100 18804 4391 1 19 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.544 -0.783 18804 4392 1 19 . 1 1 667 667 PHE H H 667 8.454 8.454 8.264 0.190 18804 4393 1 19 . 1 1 668 668 MET N N 668 116.868 116.868 116.459 0.409 18804 4394 1 19 . 1 1 668 668 MET HA H 668 4.035 4.035 4.014 0.021 18804 4395 1 19 . 1 1 668 668 MET C C 668 177.678 177.678 177.879 -0.201 18804 4396 1 19 . 1 1 668 668 MET CA C 668 57.405 57.405 58.482 -1.077 18804 4397 1 19 . 1 1 668 668 MET CB C 668 31.739 31.739 32.904 -1.165 18804 4398 1 19 . 1 1 668 668 MET H H 668 8.701 8.701 8.373 0.328 18804 4399 1 19 . 1 1 669 669 ARG N N 669 118.600 118.600 115.668 2.932 18804 4400 1 19 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.168 -0.033 18804 4401 1 19 . 1 1 669 669 ARG C C 669 177.120 177.120 177.099 0.021 18804 4402 1 19 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.362 -0.110 18804 4403 1 19 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.826 -1.323 18804 4404 1 19 . 1 1 669 669 ARG H H 669 8.044 8.044 7.583 0.461 18804 4405 1 19 . 1 1 670 670 ARG N N 670 118.124 118.124 120.455 -2.331 18804 4406 1 19 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.349 -0.224 18804 4407 1 19 . 1 1 670 670 ARG C C 670 176.240 176.240 174.372 1.868 18804 4408 1 19 . 1 1 670 670 ARG CA C 670 56.738 56.738 55.605 1.133 18804 4409 1 19 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.333 -0.866 18804 4410 1 19 . 1 1 670 670 ARG H H 670 7.864 7.864 7.563 0.301 18804 4411 1 19 . 1 1 671 671 ARG N N 671 117.904 117.904 123.098 -5.194 18804 4412 1 19 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.314 -0.228 18804 4413 1 19 . 1 1 671 671 ARG C C 671 175.233 175.233 175.474 -0.241 18804 4414 1 19 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.863 0.868 18804 4415 1 19 . 1 1 671 671 ARG CB C 671 29.494 29.494 32.604 -3.110 18804 4416 1 19 . 1 1 671 671 ARG H H 671 7.677 7.677 8.416 -0.739 18804 4417 1 19 . 1 1 672 672 HIS N N 672 117.048 117.048 121.876 -4.828 18804 4418 1 19 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.458 0.145 18804 4419 1 19 . 1 1 672 672 HIS C C 672 173.634 173.634 175.334 -1.700 18804 4420 1 19 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.244 -1.403 18804 4421 1 19 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.496 -2.310 18804 4422 1 19 . 1 1 672 672 HIS H H 672 7.920 7.920 8.283 -0.363 18804 4423 1 19 . 1 1 673 673 ILE N N 673 120.795 120.795 121.561 -0.766 18804 4424 1 19 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.398 -0.324 18804 4425 1 19 . 1 1 673 673 ILE C C 673 174.922 174.922 175.285 -0.363 18804 4426 1 19 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.727 0.050 18804 4427 1 19 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.248 -0.412 18804 4428 1 19 . 1 1 673 673 ILE H H 673 7.900 7.900 8.461 -0.561 18804 4429 1 19 . 1 1 674 674 VAL N N 674 122.867 122.867 127.799 -4.932 18804 4430 1 19 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.077 0.004 18804 4431 1 19 . 1 1 674 674 VAL C C 674 174.876 174.876 175.606 -0.730 18804 4432 1 19 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.482 -1.112 18804 4433 1 19 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.664 -0.670 18804 4434 1 19 . 1 1 674 674 VAL H H 674 8.003 8.003 8.511 -0.508 18804 4435 1 19 . 1 1 675 675 ARG N N 675 124.866 124.866 127.260 -2.394 18804 4436 1 19 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.485 -0.428 18804 4437 1 19 . 1 1 675 675 ARG C C 675 174.922 174.922 175.832 -0.910 18804 4438 1 19 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.612 -0.429 18804 4439 1 19 . 1 1 675 675 ARG CB C 675 30.316 30.316 31.635 -1.319 18804 4440 1 19 . 1 1 675 675 ARG H H 675 8.266 8.266 8.654 -0.388 18804 4441 1 19 . 1 1 676 676 LYS N N 676 123.517 123.517 121.083 2.434 18804 4442 1 19 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.361 -0.096 18804 4443 1 19 . 1 1 676 676 LYS C C 676 174.625 174.625 176.794 -2.169 18804 4444 1 19 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.782 -1.029 18804 4445 1 19 . 1 1 676 676 LYS CB C 676 30.281 30.281 33.549 -3.268 18804 4446 1 19 . 1 1 676 676 LYS H H 676 8.260 8.260 8.383 -0.123 18804 4447 1 20 . 1 1 635 635 GLY N N 635 108.817 108.817 113.173 -4.356 18804 4448 1 20 . 1 1 635 635 GLY C C 635 172.499 172.499 174.693 -2.194 18804 4449 1 20 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.730 -0.461 18804 4450 1 20 . 1 1 635 635 GLY H H 635 8.390 8.390 8.684 -0.294 18804 4451 1 20 . 1 1 636 636 CYS N N 636 120.634 120.634 121.225 -0.591 18804 4452 1 20 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.637 0.385 18804 4453 1 20 . 1 1 636 636 CYS C C 636 172.181 172.181 174.604 -2.423 18804 4454 1 20 . 1 1 636 636 CYS CA C 636 52.594 52.594 56.381 -3.787 18804 4455 1 20 . 1 1 636 636 CYS CB C 636 39.488 39.488 27.910 11.578 18804 4456 1 20 . 1 1 636 636 CYS H H 636 8.327 8.327 8.203 0.124 18804 4457 1 20 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.339 0.161 18804 4458 1 20 . 1 1 637 637 PRO C C 637 176.215 176.215 176.085 0.130 18804 4459 1 20 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.282 -0.604 18804 4460 1 20 . 1 1 637 637 PRO CB C 637 31.342 31.342 29.895 1.447 18804 4461 1 20 . 1 1 638 638 THR N N 638 113.690 113.690 113.897 -0.207 18804 4462 1 20 . 1 1 638 638 THR HA H 638 4.305 4.305 3.967 0.338 18804 4463 1 20 . 1 1 638 638 THR C C 638 173.495 173.495 173.607 -0.112 18804 4464 1 20 . 1 1 638 638 THR CA C 638 60.998 60.998 63.459 -2.461 18804 4465 1 20 . 1 1 638 638 THR CB C 638 68.954 68.954 67.471 1.483 18804 4466 1 20 . 1 1 638 638 THR H H 638 8.114 8.114 8.271 -0.157 18804 4467 1 20 . 1 1 639 639 ASN N N 639 120.695 120.695 117.888 2.807 18804 4468 1 20 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.791 -0.018 18804 4469 1 20 . 1 1 639 639 ASN C C 639 174.216 174.216 173.227 0.989 18804 4470 1 20 . 1 1 639 639 ASN CA C 639 52.357 52.357 52.233 0.124 18804 4471 1 20 . 1 1 639 639 ASN CB C 639 38.581 38.581 40.919 -2.338 18804 4472 1 20 . 1 1 639 639 ASN H H 639 8.301 8.301 7.622 0.679 18804 4473 1 20 . 1 1 640 640 GLY N N 640 108.827 108.827 106.997 1.830 18804 4474 1 20 . 1 1 640 640 GLY C C 640 170.506 170.506 172.660 -2.154 18804 4475 1 20 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.807 -0.952 18804 4476 1 20 . 1 1 640 640 GLY H H 640 8.111 8.111 8.419 -0.308 18804 4477 1 20 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.619 -0.167 18804 4478 1 20 . 1 1 641 641 PRO C C 641 175.669 175.669 176.327 -0.658 18804 4479 1 20 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.717 -0.641 18804 4480 1 20 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.078 -0.590 18804 4481 1 20 . 1 1 642 642 LYS N N 642 121.521 121.521 124.165 -2.644 18804 4482 1 20 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.413 -0.087 18804 4483 1 20 . 1 1 642 642 LYS C C 642 175.106 175.106 175.928 -0.822 18804 4484 1 20 . 1 1 642 642 LYS CA C 642 55.103 55.103 55.930 -0.827 18804 4485 1 20 . 1 1 642 642 LYS CB C 642 32.370 32.370 33.334 -0.964 18804 4486 1 20 . 1 1 642 642 LYS H H 642 8.417 8.417 8.512 -0.095 18804 4487 1 20 . 1 1 643 643 ILE N N 643 121.410 121.410 120.655 0.755 18804 4488 1 20 . 1 1 643 643 ILE HA H 643 4.335 4.335 3.884 0.451 18804 4489 1 20 . 1 1 643 643 ILE C C 643 173.587 173.587 174.201 -0.614 18804 4490 1 20 . 1 1 643 643 ILE CA C 643 57.874 57.874 60.610 -2.736 18804 4491 1 20 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.028 0.590 18804 4492 1 20 . 1 1 643 643 ILE H H 643 8.069 8.069 8.115 -0.046 18804 4493 1 20 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.612 -0.159 18804 4494 1 20 . 1 1 644 644 PRO C C 644 175.623 175.623 177.821 -2.198 18804 4495 1 20 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.459 -0.000 18804 4496 1 20 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.382 -0.874 18804 4497 1 20 . 1 1 645 645 SER N N 645 115.445 115.445 114.311 1.134 18804 4498 1 20 . 1 1 645 645 SER HA H 645 4.374 4.374 4.281 0.093 18804 4499 1 20 . 1 1 645 645 SER C C 645 174.611 174.611 176.783 -2.172 18804 4500 1 20 . 1 1 645 645 SER CA C 645 58.566 58.566 60.555 -1.989 18804 4501 1 20 . 1 1 645 645 SER CB C 645 62.842 62.842 62.471 0.371 18804 4502 1 20 . 1 1 645 645 SER H H 645 8.267 8.267 8.531 -0.264 18804 4503 1 20 . 1 1 646 646 ILE N N 646 120.612 120.612 123.235 -2.623 18804 4504 1 20 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.782 0.327 18804 4505 1 20 . 1 1 646 646 ILE C C 646 174.703 174.703 176.227 -1.524 18804 4506 1 20 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.304 -1.082 18804 4507 1 20 . 1 1 646 646 ILE CB C 646 37.660 37.660 37.661 -0.001 18804 4508 1 20 . 1 1 646 646 ILE H H 646 8.252 8.252 7.975 0.277 18804 4509 1 20 . 1 1 647 647 ALA N N 647 123.224 123.224 122.366 0.858 18804 4510 1 20 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.885 0.278 18804 4511 1 20 . 1 1 647 647 ALA C C 647 176.526 176.526 179.141 -2.615 18804 4512 1 20 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.385 -2.201 18804 4513 1 20 . 1 1 647 647 ALA CB C 647 18.249 18.249 17.873 0.376 18804 4514 1 20 . 1 1 647 647 ALA H H 647 8.084 8.084 7.636 0.448 18804 4515 1 20 . 1 1 648 648 THR N N 648 111.699 111.699 114.210 -2.511 18804 4516 1 20 . 1 1 648 648 THR HA H 648 4.021 4.021 3.874 0.147 18804 4517 1 20 . 1 1 648 648 THR C C 648 175.018 175.018 177.026 -2.008 18804 4518 1 20 . 1 1 648 648 THR CA C 648 63.554 63.554 67.188 -3.634 18804 4519 1 20 . 1 1 648 648 THR CB C 648 68.098 68.098 68.364 -0.266 18804 4520 1 20 . 1 1 648 648 THR H H 648 7.757 7.757 7.884 -0.127 18804 4521 1 20 . 1 1 649 649 GLY N N 649 108.587 108.587 109.284 -0.697 18804 4522 1 20 . 1 1 649 649 GLY C C 649 173.686 173.686 176.221 -2.535 18804 4523 1 20 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.755 -0.811 18804 4524 1 20 . 1 1 649 649 GLY H H 649 8.423 8.423 7.951 0.472 18804 4525 1 20 . 1 1 650 650 MET N N 650 119.486 119.486 121.830 -2.344 18804 4526 1 20 . 1 1 650 650 MET HA H 650 4.135 4.135 4.246 -0.111 18804 4527 1 20 . 1 1 650 650 MET C C 650 176.632 176.632 178.678 -2.046 18804 4528 1 20 . 1 1 650 650 MET CA C 650 57.749 57.749 56.910 0.839 18804 4529 1 20 . 1 1 650 650 MET CB C 650 32.067 32.067 31.343 0.724 18804 4530 1 20 . 1 1 650 650 MET H H 650 8.332 8.332 7.548 0.784 18804 4531 1 20 . 1 1 651 651 VAL N N 651 118.009 118.009 118.526 -0.517 18804 4532 1 20 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.670 -0.130 18804 4533 1 20 . 1 1 651 651 VAL C C 651 176.672 176.672 178.416 -1.744 18804 4534 1 20 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.343 -1.064 18804 4535 1 20 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.691 -0.393 18804 4536 1 20 . 1 1 651 651 VAL H H 651 8.038 8.038 8.690 -0.652 18804 4537 1 20 . 1 1 652 652 GLY N N 652 105.785 105.785 106.854 -1.069 18804 4538 1 20 . 1 1 652 652 GLY C C 652 173.359 173.359 175.405 -2.046 18804 4539 1 20 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.005 -0.017 18804 4540 1 20 . 1 1 652 652 GLY H H 652 8.157 8.157 8.026 0.131 18804 4541 1 20 . 1 1 653 653 ALA N N 653 121.803 121.803 125.157 -3.354 18804 4542 1 20 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.217 -0.290 18804 4543 1 20 . 1 1 653 653 ALA C C 653 177.608 177.608 179.673 -2.065 18804 4544 1 20 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.639 0.008 18804 4545 1 20 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.335 -0.778 18804 4546 1 20 . 1 1 653 653 ALA H H 653 8.050 8.050 8.013 0.037 18804 4547 1 20 . 1 1 654 654 LEU N N 654 116.652 116.652 119.690 -3.038 18804 4548 1 20 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.905 0.047 18804 4549 1 20 . 1 1 654 654 LEU C C 654 177.361 177.361 179.104 -1.743 18804 4550 1 20 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.162 -0.900 18804 4551 1 20 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.795 -0.892 18804 4552 1 20 . 1 1 654 654 LEU H H 654 7.919 7.919 8.370 -0.451 18804 4553 1 20 . 1 1 655 655 LEU N N 655 117.910 117.910 118.660 -0.750 18804 4554 1 20 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.951 -0.014 18804 4555 1 20 . 1 1 655 655 LEU C C 655 177.353 177.353 179.198 -1.845 18804 4556 1 20 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.832 -0.317 18804 4557 1 20 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.548 -0.738 18804 4558 1 20 . 1 1 655 655 LEU H H 655 8.189 8.189 7.696 0.493 18804 4559 1 20 . 1 1 656 656 LEU N N 656 118.140 118.140 119.260 -1.120 18804 4560 1 20 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.907 0.002 18804 4561 1 20 . 1 1 656 656 LEU C C 656 177.304 177.304 179.164 -1.860 18804 4562 1 20 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.831 -0.334 18804 4563 1 20 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.618 -0.857 18804 4564 1 20 . 1 1 656 656 LEU H H 656 8.022 8.022 7.802 0.220 18804 4565 1 20 . 1 1 657 657 LEU N N 657 118.079 118.079 119.692 -1.613 18804 4566 1 20 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.843 -0.005 18804 4567 1 20 . 1 1 657 657 LEU C C 657 177.304 177.304 178.999 -1.695 18804 4568 1 20 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.237 -0.661 18804 4569 1 20 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.597 -0.801 18804 4570 1 20 . 1 1 657 657 LEU H H 657 8.073 8.073 8.277 -0.204 18804 4571 1 20 . 1 1 658 658 LEU N N 658 118.238 118.238 118.981 -0.743 18804 4572 1 20 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.889 0.034 18804 4573 1 20 . 1 1 658 658 LEU C C 658 177.353 177.353 179.152 -1.799 18804 4574 1 20 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.035 -0.526 18804 4575 1 20 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.596 -0.707 18804 4576 1 20 . 1 1 658 658 LEU H H 658 8.148 8.148 7.685 0.463 18804 4577 1 20 . 1 1 659 659 VAL N N 659 117.951 117.951 118.628 -0.677 18804 4578 1 20 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.700 -0.196 18804 4579 1 20 . 1 1 659 659 VAL C C 659 176.888 176.888 178.230 -1.342 18804 4580 1 20 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.019 0.473 18804 4581 1 20 . 1 1 659 659 VAL CB C 659 30.372 30.372 30.716 -0.344 18804 4582 1 20 . 1 1 659 659 VAL H H 659 8.150 8.150 7.709 0.441 18804 4583 1 20 . 1 1 660 660 VAL N N 660 119.240 119.240 120.568 -1.328 18804 4584 1 20 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.585 -0.096 18804 4585 1 20 . 1 1 660 660 VAL C C 660 176.494 176.494 177.845 -1.351 18804 4586 1 20 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.607 -0.257 18804 4587 1 20 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.600 -0.210 18804 4588 1 20 . 1 1 660 660 VAL H H 660 8.220 8.220 8.259 -0.039 18804 4589 1 20 . 1 1 661 661 ALA N N 661 121.414 121.414 122.893 -1.479 18804 4590 1 20 . 1 1 661 661 ALA HA H 661 3.892 3.892 3.993 -0.101 18804 4591 1 20 . 1 1 661 661 ALA C C 661 178.419 178.419 179.831 -1.412 18804 4592 1 20 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.472 -0.377 18804 4593 1 20 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.189 -0.890 18804 4594 1 20 . 1 1 661 661 ALA H H 661 8.562 8.562 8.132 0.430 18804 4595 1 20 . 1 1 662 662 LEU N N 662 117.019 117.019 118.822 -1.803 18804 4596 1 20 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.849 0.128 18804 4597 1 20 . 1 1 662 662 LEU C C 662 178.078 178.078 179.262 -1.184 18804 4598 1 20 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.751 -0.435 18804 4599 1 20 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.643 -0.604 18804 4600 1 20 . 1 1 662 662 LEU H H 662 8.460 8.460 7.944 0.516 18804 4601 1 20 . 1 1 663 663 GLY N N 663 106.924 106.924 107.153 -0.229 18804 4602 1 20 . 1 1 663 663 GLY C C 663 174.372 174.372 176.116 -1.744 18804 4603 1 20 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.164 -0.065 18804 4604 1 20 . 1 1 663 663 GLY H H 663 8.683 8.683 7.850 0.833 18804 4605 1 20 . 1 1 664 664 ILE N N 664 121.523 121.523 122.854 -1.331 18804 4606 1 20 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.635 0.064 18804 4607 1 20 . 1 1 664 664 ILE C C 664 177.614 177.614 178.149 -0.535 18804 4608 1 20 . 1 1 664 664 ILE CA C 664 65.035 65.035 64.956 0.080 18804 4609 1 20 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.660 -0.828 18804 4610 1 20 . 1 1 664 664 ILE H H 664 8.750 8.750 8.331 0.419 18804 4611 1 20 . 1 1 665 665 GLY N N 665 107.803 107.803 108.462 -0.659 18804 4612 1 20 . 1 1 665 665 GLY C C 665 174.402 174.402 176.199 -1.797 18804 4613 1 20 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.301 -0.092 18804 4614 1 20 . 1 1 665 665 GLY H H 665 8.689 8.689 8.431 0.258 18804 4615 1 20 . 1 1 666 666 LEU N N 666 121.365 121.365 122.233 -0.868 18804 4616 1 20 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.026 0.009 18804 4617 1 20 . 1 1 666 666 LEU C C 666 178.291 178.291 178.821 -0.530 18804 4618 1 20 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.197 0.135 18804 4619 1 20 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.781 -0.561 18804 4620 1 20 . 1 1 666 666 LEU H H 666 8.744 8.744 7.816 0.928 18804 4621 1 20 . 1 1 667 667 PHE N N 667 119.838 119.838 121.236 -1.398 18804 4622 1 20 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.151 -0.060 18804 4623 1 20 . 1 1 667 667 PHE C C 667 176.965 176.965 177.604 -0.639 18804 4624 1 20 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.249 -0.218 18804 4625 1 20 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.576 -0.815 18804 4626 1 20 . 1 1 667 667 PHE H H 667 8.454 8.454 8.331 0.123 18804 4627 1 20 . 1 1 668 668 MET N N 668 116.868 116.868 117.667 -0.799 18804 4628 1 20 . 1 1 668 668 MET HA H 668 4.035 4.035 3.937 0.098 18804 4629 1 20 . 1 1 668 668 MET C C 668 177.678 177.678 178.530 -0.852 18804 4630 1 20 . 1 1 668 668 MET CA C 668 57.405 57.405 58.720 -1.315 18804 4631 1 20 . 1 1 668 668 MET CB C 668 31.739 31.739 32.363 -0.624 18804 4632 1 20 . 1 1 668 668 MET H H 668 8.701 8.701 8.650 0.051 18804 4633 1 20 . 1 1 669 669 ARG N N 669 118.600 118.600 117.730 0.870 18804 4634 1 20 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.054 0.081 18804 4635 1 20 . 1 1 669 669 ARG C C 669 177.120 177.120 176.848 0.272 18804 4636 1 20 . 1 1 669 669 ARG CA C 669 57.252 57.252 58.233 -0.981 18804 4637 1 20 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.439 -0.935 18804 4638 1 20 . 1 1 669 669 ARG H H 669 8.044 8.044 7.729 0.315 18804 4639 1 20 . 1 1 670 670 ARG N N 670 118.124 118.124 117.282 0.842 18804 4640 1 20 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.398 -0.273 18804 4641 1 20 . 1 1 670 670 ARG C C 670 176.240 176.240 174.521 1.719 18804 4642 1 20 . 1 1 670 670 ARG CA C 670 56.738 56.738 54.778 1.960 18804 4643 1 20 . 1 1 670 670 ARG CB C 670 29.467 29.467 29.032 0.434 18804 4644 1 20 . 1 1 670 670 ARG H H 670 7.864 7.864 7.445 0.419 18804 4645 1 20 . 1 1 671 671 ARG N N 671 117.904 117.904 123.149 -5.245 18804 4646 1 20 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.024 0.062 18804 4647 1 20 . 1 1 671 671 ARG C C 671 175.233 175.233 175.179 0.054 18804 4648 1 20 . 1 1 671 671 ARG CA C 671 55.731 55.731 54.814 0.917 18804 4649 1 20 . 1 1 671 671 ARG CB C 671 29.494 29.494 30.710 -1.216 18804 4650 1 20 . 1 1 671 671 ARG H H 671 7.677 7.677 8.219 -0.542 18804 4651 1 20 . 1 1 672 672 HIS N N 672 117.048 117.048 125.951 -8.903 18804 4652 1 20 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.386 0.217 18804 4653 1 20 . 1 1 672 672 HIS C C 672 173.634 173.634 176.132 -2.498 18804 4654 1 20 . 1 1 672 672 HIS CA C 672 54.841 54.841 56.809 -1.968 18804 4655 1 20 . 1 1 672 672 HIS CB C 672 28.186 28.186 29.183 -0.997 18804 4656 1 20 . 1 1 672 672 HIS H H 672 7.920 7.920 8.548 -0.628 18804 4657 1 20 . 1 1 673 673 ILE N N 673 120.795 120.795 119.688 1.107 18804 4658 1 20 . 1 1 673 673 ILE HA H 673 4.074 4.074 3.918 0.156 18804 4659 1 20 . 1 1 673 673 ILE C C 673 174.922 174.922 175.903 -0.981 18804 4660 1 20 . 1 1 673 673 ILE CA C 673 60.777 60.777 62.346 -1.569 18804 4661 1 20 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.058 -0.222 18804 4662 1 20 . 1 1 673 673 ILE H H 673 7.900 7.900 8.207 -0.307 18804 4663 1 20 . 1 1 674 674 VAL N N 674 122.867 122.867 120.537 2.330 18804 4664 1 20 . 1 1 674 674 VAL HA H 674 4.081 4.081 3.959 0.122 18804 4665 1 20 . 1 1 674 674 VAL C C 674 174.876 174.876 175.518 -0.642 18804 4666 1 20 . 1 1 674 674 VAL CA C 674 61.370 61.370 63.277 -1.907 18804 4667 1 20 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.634 -0.640 18804 4668 1 20 . 1 1 674 674 VAL H H 674 8.003 8.003 7.596 0.407 18804 4669 1 20 . 1 1 675 675 ARG N N 675 124.866 124.866 126.187 -1.321 18804 4670 1 20 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.424 -0.367 18804 4671 1 20 . 1 1 675 675 ARG C C 675 174.922 174.922 174.515 0.407 18804 4672 1 20 . 1 1 675 675 ARG CA C 675 55.184 55.184 55.151 0.033 18804 4673 1 20 . 1 1 675 675 ARG CB C 675 30.316 30.316 32.214 -1.898 18804 4674 1 20 . 1 1 675 675 ARG H H 675 8.266 8.266 8.207 0.059 18804 4675 1 20 . 1 1 676 676 LYS N N 676 123.517 123.517 123.223 0.294 18804 4676 1 20 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.293 -0.028 18804 4677 1 20 . 1 1 676 676 LYS C C 676 174.625 174.625 177.440 -2.815 18804 4678 1 20 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.447 -0.694 18804 4679 1 20 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.913 -2.632 18804 4680 1 20 . 1 1 676 676 LYS H H 676 8.260 8.260 8.132 0.128 18804 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 39 2.415 0.875 2.280 18804 2 1 1 "Average Difference" HA 48 0.179 -0.032 0.178 18804 3 1 1 "Average Difference" C 42 1.508 1.265 0.830 18804 4 1 1 "Average Difference" CA 42 1.298 0.764 1.062 18804 5 1 1 "Average Difference" CB 36 1.983 0.172 2.004 18804 6 1 1 "Average Difference" HN 39 0.418 -0.150 0.395 18804 7 1 2 "Average Difference" N 39 1.860 0.869 1.666 18804 8 1 2 "Average Difference" HA 48 0.178 -0.037 0.176 18804 9 1 2 "Average Difference" C 42 1.569 1.364 0.785 18804 10 1 2 "Average Difference" CA 42 1.415 0.881 1.121 18804 11 1 2 "Average Difference" CB 36 2.024 0.317 2.028 18804 12 1 2 "Average Difference" HN 39 0.445 -0.160 0.421 18804 13 1 3 "Average Difference" N 39 1.964 0.786 1.824 18804 14 1 3 "Average Difference" HA 48 0.178 -0.018 0.178 18804 15 1 3 "Average Difference" C 42 1.481 1.313 0.695 18804 16 1 3 "Average Difference" CA 42 1.297 0.889 0.955 18804 17 1 3 "Average Difference" CB 36 1.955 0.395 1.942 18804 18 1 3 "Average Difference" HN 39 0.438 -0.185 0.402 18804 19 1 4 "Average Difference" N 39 1.723 0.619 1.629 18804 20 1 4 "Average Difference" HA 48 0.148 -0.040 0.144 18804 21 1 4 "Average Difference" C 42 1.604 1.473 0.643 18804 22 1 4 "Average Difference" CA 42 1.493 1.053 1.071 18804 23 1 4 "Average Difference" CB 36 2.213 0.172 2.237 18804 24 1 4 "Average Difference" HN 39 0.403 -0.193 0.359 18804 25 1 5 "Average Difference" N 39 2.188 1.217 1.842 18804 26 1 5 "Average Difference" HA 48 0.190 -0.027 0.190 18804 27 1 5 "Average Difference" C 42 1.410 1.157 0.816 18804 28 1 5 "Average Difference" CA 42 1.284 0.739 1.063 18804 29 1 5 "Average Difference" CB 36 2.092 0.317 2.097 18804 30 1 5 "Average Difference" HN 39 0.435 -0.142 0.416 18804 31 1 6 "Average Difference" N 39 1.941 0.363 1.932 18804 32 1 6 "Average Difference" HA 48 0.169 -0.044 0.165 18804 33 1 6 "Average Difference" C 42 1.562 1.374 0.751 18804 34 1 6 "Average Difference" CA 42 1.370 1.015 0.932 18804 35 1 6 "Average Difference" CB 36 2.036 0.325 2.039 18804 36 1 6 "Average Difference" HN 39 0.432 -0.232 0.368 18804 37 1 7 "Average Difference" N 39 2.698 0.563 2.673 18804 38 1 7 "Average Difference" HA 48 0.194 -0.008 0.196 18804 39 1 7 "Average Difference" C 42 1.576 1.262 0.956 18804 40 1 7 "Average Difference" CA 42 1.395 0.777 1.173 18804 41 1 7 "Average Difference" CB 36 2.163 0.423 2.151 18804 42 1 7 "Average Difference" HN 39 0.437 -0.188 0.400 18804 43 1 8 "Average Difference" N 39 2.068 1.142 1.747 18804 44 1 8 "Average Difference" HA 48 0.220 0.011 0.222 18804 45 1 8 "Average Difference" C 42 1.487 1.196 0.895 18804 46 1 8 "Average Difference" CA 42 1.220 0.653 1.043 18804 47 1 8 "Average Difference" CB 36 2.092 0.463 2.069 18804 48 1 8 "Average Difference" HN 39 0.438 -0.137 0.421 18804 49 1 9 "Average Difference" N 39 1.865 0.749 1.731 18804 50 1 9 "Average Difference" HA 48 0.165 -0.007 0.166 18804 51 1 9 "Average Difference" C 42 1.540 1.348 0.753 18804 52 1 9 "Average Difference" CA 42 1.401 0.860 1.119 18804 53 1 9 "Average Difference" CB 36 2.062 0.291 2.071 18804 54 1 9 "Average Difference" HN 39 0.424 -0.129 0.409 18804 55 1 10 "Average Difference" N 39 2.260 1.257 1.903 18804 56 1 10 "Average Difference" HA 48 0.172 0.030 0.171 18804 57 1 10 "Average Difference" C 42 1.509 1.215 0.906 18804 58 1 10 "Average Difference" CA 42 1.280 0.668 1.105 18804 59 1 10 "Average Difference" CB 36 2.095 0.449 2.076 18804 60 1 10 "Average Difference" HN 39 0.434 -0.146 0.414 18804 61 1 11 "Average Difference" N 39 2.082 1.113 1.783 18804 62 1 11 "Average Difference" HA 48 0.187 -0.010 0.189 18804 63 1 11 "Average Difference" C 42 1.484 1.195 0.891 18804 64 1 11 "Average Difference" CA 42 1.340 0.791 1.096 18804 65 1 11 "Average Difference" CB 36 2.305 0.370 2.307 18804 66 1 11 "Average Difference" HN 39 0.440 -0.146 0.420 18804 67 1 12 "Average Difference" N 39 1.924 1.246 1.486 18804 68 1 12 "Average Difference" HA 48 0.199 -0.008 0.201 18804 69 1 12 "Average Difference" C 42 1.541 1.228 0.942 18804 70 1 12 "Average Difference" CA 42 1.344 0.726 1.144 18804 71 1 12 "Average Difference" CB 36 2.136 0.458 2.116 18804 72 1 12 "Average Difference" HN 39 0.439 -0.110 0.430 18804 73 1 13 "Average Difference" N 39 2.157 0.883 1.993 18804 74 1 13 "Average Difference" HA 48 0.204 -0.016 0.205 18804 75 1 13 "Average Difference" C 42 1.551 1.297 0.860 18804 76 1 13 "Average Difference" CA 42 1.366 0.708 1.182 18804 77 1 13 "Average Difference" CB 36 2.308 0.391 2.307 18804 78 1 13 "Average Difference" HN 39 0.441 -0.130 0.426 18804 79 1 14 "Average Difference" N 39 2.465 0.553 2.434 18804 80 1 14 "Average Difference" HA 48 0.159 -0.009 0.160 18804 81 1 14 "Average Difference" C 42 1.601 1.350 0.872 18804 82 1 14 "Average Difference" CA 42 1.232 0.746 0.993 18804 83 1 14 "Average Difference" CB 36 2.117 0.522 2.081 18804 84 1 14 "Average Difference" HN 39 0.427 -0.189 0.388 18804 85 1 15 "Average Difference" N 39 2.288 1.300 1.907 18804 86 1 15 "Average Difference" HA 48 0.183 -0.008 0.185 18804 87 1 15 "Average Difference" C 42 1.543 1.277 0.877 18804 88 1 15 "Average Difference" CA 42 1.374 0.688 1.204 18804 89 1 15 "Average Difference" CB 36 2.155 0.445 2.138 18804 90 1 15 "Average Difference" HN 39 0.443 -0.114 0.434 18804 91 1 16 "Average Difference" N 39 2.071 1.149 1.745 18804 92 1 16 "Average Difference" HA 48 0.169 0.033 0.167 18804 93 1 16 "Average Difference" C 42 1.498 1.200 0.907 18804 94 1 16 "Average Difference" CA 42 1.270 0.648 1.105 18804 95 1 16 "Average Difference" CB 36 2.086 0.424 2.072 18804 96 1 16 "Average Difference" HN 39 0.414 -0.131 0.398 18804 97 1 17 "Average Difference" N 39 2.470 1.082 2.250 18804 98 1 17 "Average Difference" HA 48 0.191 0.018 0.192 18804 99 1 17 "Average Difference" C 42 1.536 1.217 0.948 18804 100 1 17 "Average Difference" CA 42 1.331 0.667 1.166 18804 101 1 17 "Average Difference" CB 36 2.199 0.305 2.208 18804 102 1 17 "Average Difference" HN 39 0.445 -0.125 0.433 18804 103 1 18 "Average Difference" N 39 2.860 1.480 2.479 18804 104 1 18 "Average Difference" HA 48 0.230 0.022 0.231 18804 105 1 18 "Average Difference" C 42 1.552 1.224 0.966 18804 106 1 18 "Average Difference" CA 42 1.487 0.747 1.301 18804 107 1 18 "Average Difference" CB 36 2.418 0.354 2.426 18804 108 1 18 "Average Difference" HN 39 0.437 -0.088 0.433 18804 109 1 19 "Average Difference" N 39 2.186 1.120 1.903 18804 110 1 19 "Average Difference" HA 48 0.183 -0.011 0.185 18804 111 1 19 "Average Difference" C 42 1.481 1.176 0.910 18804 112 1 19 "Average Difference" CA 42 1.400 0.732 1.208 18804 113 1 19 "Average Difference" CB 36 2.099 0.362 2.097 18804 114 1 19 "Average Difference" HN 39 0.433 -0.128 0.419 18804 115 1 20 "Average Difference" N 39 2.354 1.061 2.129 18804 116 1 20 "Average Difference" HA 48 0.190 -0.049 0.186 18804 117 1 20 "Average Difference" C 42 1.636 1.277 1.035 18804 118 1 20 "Average Difference" CA 42 1.349 0.746 1.138 18804 119 1 20 "Average Difference" CB 36 2.166 0.184 2.189 18804 120 1 20 "Average Difference" HN 39 0.417 -0.137 0.399 18804 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 18804 _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 1 635 635 GLY N N 635 108.817 108.817 111.056 -2.239 18804 2 1 . 1 1 635 635 GLY C C 635 172.499 172.499 173.859 -1.360 18804 3 1 . 1 1 635 635 GLY CA C 635 44.269 44.269 44.937 -0.668 18804 4 1 . 1 1 635 635 GLY H H 635 8.390 8.390 8.583 -0.193 18804 5 1 . 1 1 636 636 CYS N N 636 120.634 120.634 121.246 -0.612 18804 6 1 . 1 1 636 636 CYS HA H 636 5.022 5.022 4.634 0.388 18804 7 1 . 1 1 636 636 CYS C C 636 172.181 172.181 173.783 -1.602 18804 8 1 . 1 1 636 636 CYS CA C 636 52.594 52.594 57.193 -4.599 18804 9 1 . 1 1 636 636 CYS CB C 636 39.488 39.488 28.514 10.974 18804 10 1 . 1 1 636 636 CYS H H 636 8.327 8.327 8.191 0.136 18804 11 1 . 1 1 637 637 PRO HA H 637 4.500 4.500 4.444 0.056 18804 12 1 . 1 1 637 637 PRO C C 637 176.215 176.215 176.551 -0.336 18804 13 1 . 1 1 637 637 PRO CA C 637 62.678 62.678 63.914 -1.236 18804 14 1 . 1 1 637 637 PRO CB C 637 31.342 31.342 31.509 -0.167 18804 15 1 . 1 1 638 638 THR N N 638 113.690 113.690 111.328 2.362 18804 16 1 . 1 1 638 638 THR HA H 638 4.305 4.305 4.051 0.254 18804 17 1 . 1 1 638 638 THR C C 638 173.495 173.495 173.536 -0.041 18804 18 1 . 1 1 638 638 THR CA C 638 60.998 60.998 62.869 -1.871 18804 19 1 . 1 1 638 638 THR CB C 638 68.954 68.954 67.910 1.044 18804 20 1 . 1 1 638 638 THR H H 638 8.114 8.114 7.985 0.129 18804 21 1 . 1 1 639 639 ASN N N 639 120.695 120.695 119.382 1.313 18804 22 1 . 1 1 639 639 ASN HA H 639 4.773 4.773 4.739 0.034 18804 23 1 . 1 1 639 639 ASN C C 639 174.216 174.216 174.932 -0.716 18804 24 1 . 1 1 639 639 ASN CA C 639 52.357 52.357 53.339 -0.982 18804 25 1 . 1 1 639 639 ASN CB C 639 38.581 38.581 39.371 -0.790 18804 26 1 . 1 1 639 639 ASN H H 639 8.301 8.301 8.018 0.283 18804 27 1 . 1 1 640 640 GLY N N 640 108.827 108.827 109.062 -0.235 18804 28 1 . 1 1 640 640 GLY C C 640 170.506 170.506 172.405 -1.899 18804 29 1 . 1 1 640 640 GLY CA C 640 43.855 43.855 44.551 -0.696 18804 30 1 . 1 1 640 640 GLY H H 640 8.111 8.111 8.347 -0.236 18804 31 1 . 1 1 641 641 PRO HA H 641 4.452 4.452 4.599 -0.147 18804 32 1 . 1 1 641 641 PRO C C 641 175.669 175.669 175.987 -0.318 18804 33 1 . 1 1 641 641 PRO CA C 641 62.075 62.075 62.823 -0.748 18804 34 1 . 1 1 641 641 PRO CB C 641 31.488 31.488 32.165 -0.677 18804 35 1 . 1 1 642 642 LYS N N 642 121.521 121.521 122.409 -0.888 18804 36 1 . 1 1 642 642 LYS HA H 642 4.326 4.326 4.544 -0.218 18804 37 1 . 1 1 642 642 LYS C C 642 175.106 175.106 175.373 -0.267 18804 38 1 . 1 1 642 642 LYS CA C 642 55.103 55.103 56.000 -0.897 18804 39 1 . 1 1 642 642 LYS CB C 642 32.370 32.370 34.270 -1.900 18804 40 1 . 1 1 642 642 LYS H H 642 8.417 8.417 8.295 0.122 18804 41 1 . 1 1 643 643 ILE N N 643 121.410 121.410 124.037 -2.627 18804 42 1 . 1 1 643 643 ILE HA H 643 4.335 4.335 4.301 0.034 18804 43 1 . 1 1 643 643 ILE C C 643 173.587 173.587 174.589 -1.002 18804 44 1 . 1 1 643 643 ILE CA C 643 57.874 57.874 59.864 -1.990 18804 45 1 . 1 1 643 643 ILE CB C 643 37.618 37.618 37.641 -0.023 18804 46 1 . 1 1 643 643 ILE H H 643 8.069 8.069 8.411 -0.342 18804 47 1 . 1 1 644 644 PRO HA H 644 4.453 4.453 4.579 -0.126 18804 48 1 . 1 1 644 644 PRO C C 644 175.623 175.623 177.630 -2.007 18804 49 1 . 1 1 644 644 PRO CA C 644 62.459 62.459 62.397 0.062 18804 50 1 . 1 1 644 644 PRO CB C 644 31.508 31.508 32.402 -0.895 18804 51 1 . 1 1 645 645 SER N N 645 115.445 115.445 114.005 1.440 18804 52 1 . 1 1 645 645 SER HA H 645 4.374 4.374 4.271 0.103 18804 53 1 . 1 1 645 645 SER C C 645 174.611 174.611 176.140 -1.529 18804 54 1 . 1 1 645 645 SER CA C 645 58.566 58.566 60.383 -1.817 18804 55 1 . 1 1 645 645 SER CB C 645 62.842 62.842 62.692 0.150 18804 56 1 . 1 1 645 645 SER H H 645 8.267 8.267 8.475 -0.208 18804 57 1 . 1 1 646 646 ILE N N 646 120.612 120.612 121.972 -1.360 18804 58 1 . 1 1 646 646 ILE HA H 646 4.109 4.109 3.836 0.273 18804 59 1 . 1 1 646 646 ILE C C 646 174.703 174.703 176.937 -2.234 18804 60 1 . 1 1 646 646 ILE CA C 646 61.222 61.222 62.282 -1.060 18804 61 1 . 1 1 646 646 ILE CB C 646 37.660 37.660 36.938 0.722 18804 62 1 . 1 1 646 646 ILE H H 646 8.252 8.252 7.948 0.304 18804 63 1 . 1 1 647 647 ALA N N 647 123.224 123.224 123.118 0.106 18804 64 1 . 1 1 647 647 ALA HA H 647 4.163 4.163 3.903 0.260 18804 65 1 . 1 1 647 647 ALA C C 647 176.526 176.526 179.108 -2.582 18804 66 1 . 1 1 647 647 ALA CA C 647 53.184 53.184 55.248 -2.064 18804 67 1 . 1 1 647 647 ALA CB C 647 18.249 18.249 18.020 0.229 18804 68 1 . 1 1 647 647 ALA H H 647 8.084 8.084 7.650 0.434 18804 69 1 . 1 1 648 648 THR N N 648 111.699 111.699 114.541 -2.842 18804 70 1 . 1 1 648 648 THR HA H 648 4.021 4.021 3.872 0.149 18804 71 1 . 1 1 648 648 THR C C 648 175.018 175.018 176.981 -1.963 18804 72 1 . 1 1 648 648 THR CA C 648 63.554 63.554 67.210 -3.656 18804 73 1 . 1 1 648 648 THR CB C 648 68.098 68.098 68.355 -0.257 18804 74 1 . 1 1 648 648 THR H H 648 7.757 7.757 7.759 -0.002 18804 75 1 . 1 1 649 649 GLY N N 649 108.587 108.587 109.441 -0.854 18804 76 1 . 1 1 649 649 GLY C C 649 173.686 173.686 176.197 -2.511 18804 77 1 . 1 1 649 649 GLY CA C 649 45.944 45.944 46.771 -0.827 18804 78 1 . 1 1 649 649 GLY H H 649 8.423 8.423 7.885 0.538 18804 79 1 . 1 1 650 650 MET N N 650 119.486 119.486 121.652 -2.166 18804 80 1 . 1 1 650 650 MET HA H 650 4.135 4.135 4.257 -0.122 18804 81 1 . 1 1 650 650 MET C C 650 176.632 176.632 178.642 -2.010 18804 82 1 . 1 1 650 650 MET CA C 650 57.749 57.749 57.012 0.737 18804 83 1 . 1 1 650 650 MET CB C 650 32.067 32.067 31.602 0.465 18804 84 1 . 1 1 650 650 MET H H 650 8.332 8.332 7.566 0.766 18804 85 1 . 1 1 651 651 VAL N N 651 118.009 118.009 118.871 -0.861 18804 86 1 . 1 1 651 651 VAL HA H 651 3.540 3.540 3.654 -0.114 18804 87 1 . 1 1 651 651 VAL C C 651 176.672 176.672 178.233 -1.561 18804 88 1 . 1 1 651 651 VAL CA C 651 66.279 66.279 67.168 -0.889 18804 89 1 . 1 1 651 651 VAL CB C 651 30.298 30.298 30.777 -0.479 18804 90 1 . 1 1 651 651 VAL H H 651 8.038 8.038 8.773 -0.735 18804 91 1 . 1 1 652 652 GLY N N 652 105.785 105.785 106.912 -1.127 18804 92 1 . 1 1 652 652 GLY C C 652 173.359 173.359 175.431 -2.072 18804 93 1 . 1 1 652 652 GLY CA C 652 46.988 46.988 47.207 -0.219 18804 94 1 . 1 1 652 652 GLY H H 652 8.157 8.157 8.018 0.139 18804 95 1 . 1 1 653 653 ALA N N 653 121.803 121.803 125.014 -3.211 18804 96 1 . 1 1 653 653 ALA HA H 653 3.927 3.927 4.204 -0.277 18804 97 1 . 1 1 653 653 ALA C C 653 177.608 177.608 179.646 -2.038 18804 98 1 . 1 1 653 653 ALA CA C 653 54.647 54.647 54.645 0.002 18804 99 1 . 1 1 653 653 ALA CB C 653 17.557 17.557 18.347 -0.790 18804 100 1 . 1 1 653 653 ALA H H 653 8.050 8.050 7.825 0.225 18804 101 1 . 1 1 654 654 LEU N N 654 116.652 116.652 119.716 -3.064 18804 102 1 . 1 1 654 654 LEU HA H 654 3.952 3.952 3.881 0.070 18804 103 1 . 1 1 654 654 LEU C C 654 177.361 177.361 179.133 -1.772 18804 104 1 . 1 1 654 654 LEU CA C 654 57.262 57.262 58.161 -0.899 18804 105 1 . 1 1 654 654 LEU CB C 654 40.903 40.903 41.786 -0.883 18804 106 1 . 1 1 654 654 LEU H H 654 7.919 7.919 8.389 -0.470 18804 107 1 . 1 1 655 655 LEU N N 655 117.910 117.910 118.691 -0.781 18804 108 1 . 1 1 655 655 LEU HA H 655 3.937 3.937 3.938 -0.001 18804 109 1 . 1 1 655 655 LEU C C 655 177.353 177.353 179.190 -1.837 18804 110 1 . 1 1 655 655 LEU CA C 655 57.515 57.515 57.898 -0.383 18804 111 1 . 1 1 655 655 LEU CB C 655 40.810 40.810 41.593 -0.783 18804 112 1 . 1 1 655 655 LEU H H 655 8.189 8.189 8.009 0.180 18804 113 1 . 1 1 656 656 LEU N N 656 118.140 118.140 119.226 -1.086 18804 114 1 . 1 1 656 656 LEU HA H 656 3.909 3.909 3.908 0.001 18804 115 1 . 1 1 656 656 LEU C C 656 177.304 177.304 179.201 -1.897 18804 116 1 . 1 1 656 656 LEU CA C 656 57.497 57.497 57.805 -0.308 18804 117 1 . 1 1 656 656 LEU CB C 656 40.761 40.761 41.631 -0.870 18804 118 1 . 1 1 656 656 LEU H H 656 8.022 8.022 7.716 0.306 18804 119 1 . 1 1 657 657 LEU N N 657 118.079 118.079 119.798 -1.719 18804 120 1 . 1 1 657 657 LEU HA H 657 3.838 3.838 3.861 -0.023 18804 121 1 . 1 1 657 657 LEU C C 657 177.304 177.304 179.007 -1.703 18804 122 1 . 1 1 657 657 LEU CA C 657 57.576 57.576 58.203 -0.627 18804 123 1 . 1 1 657 657 LEU CB C 657 40.796 40.796 41.618 -0.822 18804 124 1 . 1 1 657 657 LEU H H 657 8.073 8.073 8.230 -0.157 18804 125 1 . 1 1 658 658 LEU N N 658 118.238 118.238 118.969 -0.731 18804 126 1 . 1 1 658 658 LEU HA H 658 3.923 3.923 3.903 0.020 18804 127 1 . 1 1 658 658 LEU C C 658 177.353 177.353 179.151 -1.798 18804 128 1 . 1 1 658 658 LEU CA C 658 57.509 57.509 58.106 -0.597 18804 129 1 . 1 1 658 658 LEU CB C 658 40.889 40.889 41.672 -0.783 18804 130 1 . 1 1 658 658 LEU H H 658 8.148 8.148 7.709 0.439 18804 131 1 . 1 1 659 659 VAL N N 659 117.951 117.951 118.705 -0.754 18804 132 1 . 1 1 659 659 VAL HA H 659 3.504 3.504 3.635 -0.131 18804 133 1 . 1 1 659 659 VAL C C 659 176.888 176.888 178.147 -1.259 18804 134 1 . 1 1 659 659 VAL CA C 659 66.492 66.492 66.527 -0.035 18804 135 1 . 1 1 659 659 VAL CB C 659 30.372 30.372 31.148 -0.776 18804 136 1 . 1 1 659 659 VAL H H 659 8.150 8.150 7.711 0.439 18804 137 1 . 1 1 660 660 VAL N N 660 119.240 119.240 120.559 -1.319 18804 138 1 . 1 1 660 660 VAL HA H 660 3.489 3.489 3.583 -0.094 18804 139 1 . 1 1 660 660 VAL C C 660 176.494 176.494 177.632 -1.138 18804 140 1 . 1 1 660 660 VAL CA C 660 66.350 66.350 66.651 -0.301 18804 141 1 . 1 1 660 660 VAL CB C 660 30.390 30.390 30.908 -0.518 18804 142 1 . 1 1 660 660 VAL H H 660 8.220 8.220 8.014 0.206 18804 143 1 . 1 1 661 661 ALA N N 661 121.414 121.414 122.578 -1.164 18804 144 1 . 1 1 661 661 ALA HA H 661 3.892 3.892 4.008 -0.116 18804 145 1 . 1 1 661 661 ALA C C 661 178.419 178.419 179.744 -1.325 18804 146 1 . 1 1 661 661 ALA CA C 661 55.095 55.095 55.365 -0.270 18804 147 1 . 1 1 661 661 ALA CB C 661 17.299 17.299 18.179 -0.880 18804 148 1 . 1 1 661 661 ALA H H 661 8.562 8.562 7.894 0.668 18804 149 1 . 1 1 662 662 LEU N N 662 117.019 117.019 118.839 -1.820 18804 150 1 . 1 1 662 662 LEU HA H 662 3.977 3.977 3.872 0.105 18804 151 1 . 1 1 662 662 LEU C C 662 178.078 178.078 179.236 -1.158 18804 152 1 . 1 1 662 662 LEU CA C 662 57.316 57.316 57.661 -0.345 18804 153 1 . 1 1 662 662 LEU CB C 662 41.039 41.039 41.664 -0.625 18804 154 1 . 1 1 662 662 LEU H H 662 8.460 8.460 7.953 0.507 18804 155 1 . 1 1 663 663 GLY N N 663 106.924 106.924 107.220 -0.296 18804 156 1 . 1 1 663 663 GLY C C 663 174.372 174.372 176.143 -1.771 18804 157 1 . 1 1 663 663 GLY CA C 663 47.099 47.099 47.245 -0.146 18804 158 1 . 1 1 663 663 GLY H H 663 8.683 8.683 7.968 0.715 18804 159 1 . 1 1 664 664 ILE N N 664 121.523 121.523 122.722 -1.199 18804 160 1 . 1 1 664 664 ILE HA H 664 3.699 3.699 3.668 0.031 18804 161 1 . 1 1 664 664 ILE C C 664 177.614 177.614 178.107 -0.493 18804 162 1 . 1 1 664 664 ILE CA C 664 65.035 65.035 65.017 0.018 18804 163 1 . 1 1 664 664 ILE CB C 664 36.832 36.832 37.677 -0.845 18804 164 1 . 1 1 664 664 ILE H H 664 8.750 8.750 8.155 0.595 18804 165 1 . 1 1 665 665 GLY N N 665 107.803 107.803 108.480 -0.677 18804 166 1 . 1 1 665 665 GLY C C 665 174.402 174.402 176.208 -1.806 18804 167 1 . 1 1 665 665 GLY CA C 665 47.209 47.209 47.341 -0.132 18804 168 1 . 1 1 665 665 GLY H H 665 8.689 8.689 8.260 0.429 18804 169 1 . 1 1 666 666 LEU N N 666 121.365 121.365 122.073 -0.708 18804 170 1 . 1 1 666 666 LEU HA H 666 4.035 4.035 4.058 -0.023 18804 171 1 . 1 1 666 666 LEU C C 666 178.291 178.291 178.890 -0.599 18804 172 1 . 1 1 666 666 LEU CA C 666 57.331 57.331 57.135 0.196 18804 173 1 . 1 1 666 666 LEU CB C 666 41.220 41.220 41.814 -0.594 18804 174 1 . 1 1 666 666 LEU H H 666 8.744 8.744 7.892 0.852 18804 175 1 . 1 1 667 667 PHE N N 667 119.838 119.838 121.060 -1.222 18804 176 1 . 1 1 667 667 PHE HA H 667 4.091 4.091 4.182 -0.091 18804 177 1 . 1 1 667 667 PHE C C 667 176.965 176.965 177.364 -0.399 18804 178 1 . 1 1 667 667 PHE CA C 667 61.031 61.031 61.331 -0.300 18804 179 1 . 1 1 667 667 PHE CB C 667 38.761 38.761 39.568 -0.807 18804 180 1 . 1 1 667 667 PHE H H 667 8.454 8.454 8.262 0.192 18804 181 1 . 1 1 668 668 MET N N 668 116.868 116.868 117.564 -0.696 18804 182 1 . 1 1 668 668 MET HA H 668 4.035 4.035 3.952 0.083 18804 183 1 . 1 1 668 668 MET C C 668 177.678 177.678 178.272 -0.594 18804 184 1 . 1 1 668 668 MET CA C 668 57.405 57.405 58.902 -1.497 18804 185 1 . 1 1 668 668 MET CB C 668 31.739 31.739 32.532 -0.793 18804 186 1 . 1 1 668 668 MET H H 668 8.701 8.701 8.602 0.099 18804 187 1 . 1 1 669 669 ARG N N 669 118.600 118.600 116.463 2.137 18804 188 1 . 1 1 669 669 ARG HA H 669 4.135 4.135 4.077 0.058 18804 189 1 . 1 1 669 669 ARG C C 669 177.120 177.120 177.376 -0.256 18804 190 1 . 1 1 669 669 ARG CA C 669 57.252 57.252 57.932 -0.680 18804 191 1 . 1 1 669 669 ARG CB C 669 29.504 29.504 30.456 -0.952 18804 192 1 . 1 1 669 669 ARG H H 669 8.044 8.044 7.668 0.376 18804 193 1 . 1 1 670 670 ARG N N 670 118.124 118.124 118.362 -0.238 18804 194 1 . 1 1 670 670 ARG HA H 670 4.125 4.125 4.261 -0.136 18804 195 1 . 1 1 670 670 ARG C C 670 176.240 176.240 175.313 0.927 18804 196 1 . 1 1 670 670 ARG CA C 670 56.738 56.738 56.005 0.733 18804 197 1 . 1 1 670 670 ARG CB C 670 29.467 29.467 30.038 -0.572 18804 198 1 . 1 1 670 670 ARG H H 670 7.864 7.864 7.597 0.267 18804 199 1 . 1 1 671 671 ARG N N 671 117.904 117.904 121.117 -3.213 18804 200 1 . 1 1 671 671 ARG HA H 671 4.086 4.086 4.227 -0.141 18804 201 1 . 1 1 671 671 ARG C C 671 175.233 175.233 175.577 -0.344 18804 202 1 . 1 1 671 671 ARG CA C 671 55.731 55.731 55.753 -0.022 18804 203 1 . 1 1 671 671 ARG CB C 671 29.494 29.494 31.336 -1.842 18804 204 1 . 1 1 671 671 ARG H H 671 7.677 7.677 7.966 -0.289 18804 205 1 . 1 1 672 672 HIS N N 672 117.048 117.048 121.489 -4.441 18804 206 1 . 1 1 672 672 HIS HA H 672 4.603 4.603 4.588 0.015 18804 207 1 . 1 1 672 672 HIS C C 672 173.634 173.634 175.188 -1.554 18804 208 1 . 1 1 672 672 HIS CA C 672 54.841 54.841 55.721 -0.880 18804 209 1 . 1 1 672 672 HIS CB C 672 28.186 28.186 30.488 -2.302 18804 210 1 . 1 1 672 672 HIS H H 672 7.920 7.920 8.273 -0.353 18804 211 1 . 1 1 673 673 ILE N N 673 120.795 120.795 123.100 -2.305 18804 212 1 . 1 1 673 673 ILE HA H 673 4.074 4.074 4.202 -0.128 18804 213 1 . 1 1 673 673 ILE C C 673 174.922 174.922 175.596 -0.674 18804 214 1 . 1 1 673 673 ILE CA C 673 60.777 60.777 60.993 -0.216 18804 215 1 . 1 1 673 673 ILE CB C 673 37.836 37.836 38.467 -0.631 18804 216 1 . 1 1 673 673 ILE H H 673 7.900 7.900 8.196 -0.296 18804 217 1 . 1 1 674 674 VAL N N 674 122.867 122.867 123.878 -1.011 18804 218 1 . 1 1 674 674 VAL HA H 674 4.081 4.081 4.162 -0.081 18804 219 1 . 1 1 674 674 VAL C C 674 174.876 174.876 175.716 -0.840 18804 220 1 . 1 1 674 674 VAL CA C 674 61.370 61.370 62.237 -0.867 18804 221 1 . 1 1 674 674 VAL CB C 674 31.994 31.994 32.804 -0.810 18804 222 1 . 1 1 674 674 VAL H H 674 8.003 8.003 8.138 -0.135 18804 223 1 . 1 1 675 675 ARG N N 675 124.866 124.866 124.259 0.607 18804 224 1 . 1 1 675 675 ARG HA H 675 4.057 4.057 4.410 -0.353 18804 225 1 . 1 1 675 675 ARG C C 675 174.922 174.922 175.992 -1.070 18804 226 1 . 1 1 675 675 ARG CA C 675 55.184 55.184 56.111 -0.927 18804 227 1 . 1 1 675 675 ARG CB C 675 30.316 30.316 31.023 -0.707 18804 228 1 . 1 1 675 675 ARG H H 675 8.266 8.266 8.397 -0.131 18804 229 1 . 1 1 676 676 LYS N N 676 123.517 123.517 121.899 1.618 18804 230 1 . 1 1 676 676 LYS HA H 676 4.265 4.265 4.344 -0.079 18804 231 1 . 1 1 676 676 LYS C C 676 174.625 174.625 176.571 -1.946 18804 232 1 . 1 1 676 676 LYS CA C 676 55.753 55.753 56.396 -0.643 18804 233 1 . 1 1 676 676 LYS CB C 676 30.281 30.281 32.946 -2.665 18804 234 1 . 1 1 676 676 LYS H H 676 8.260 8.260 8.285 -0.025 18804 stop_ save_