data_nef_c18694_2lxs save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 18695 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 586 GLY start . false 2 A 587 VAL middle . . 3 A 588 ARG middle . . 4 A 589 LYS middle . . 5 A 590 GLY middle . false 6 A 591 TRP middle . . 7 A 592 HIS middle . . 8 A 593 GLU middle . . 9 A 594 HIS middle . . 10 A 595 VAL middle . . 11 A 596 THR middle . . 12 A 597 GLN middle . . 13 A 598 ASP middle . . 14 A 599 LEU middle . . 15 A 600 ARG middle . . 16 A 601 SER middle . . 17 A 602 HIS middle . . 18 A 603 LEU middle . . 19 A 604 VAL middle . . 20 A 605 HIS middle . . 21 A 606 LYS middle . . 22 A 607 LEU middle . . 23 A 608 VAL middle . . 24 A 609 GLN middle . . 25 A 610 ALA middle . . 26 A 611 ILE middle . . 27 A 612 PHE middle . . 28 A 613 PRO middle . false 29 A 614 THR middle . . 30 A 615 PRO middle . false 31 A 616 ASP middle . . 32 A 617 PRO middle . false 33 A 618 ALA middle . . 34 A 619 ALA middle . . 35 A 620 LEU middle . . 36 A 621 LYS middle . . 37 A 622 ASP middle . . 38 A 623 ARG middle . . 39 A 624 ARG middle . . 40 A 625 MET middle . . 41 A 626 GLU middle . . 42 A 627 ASN middle . . 43 A 628 LEU middle . . 44 A 629 VAL middle . . 45 A 630 ALA middle . . 46 A 631 TYR middle . . 47 A 632 ALA middle . . 48 A 633 LYS middle . . 49 A 634 LYS middle . . 50 A 635 VAL middle . . 51 A 636 GLU middle . . 52 A 637 GLY middle . false 53 A 638 ASP middle . . 54 A 639 MET middle . . 55 A 640 TYR middle . . 56 A 641 GLU middle . . 57 A 642 SER middle . . 58 A 643 ALA middle . . 59 A 644 ASN middle . . 60 A 645 SER middle . . 61 A 646 ARG middle . . 62 A 647 ASP middle . . 63 A 648 GLU middle . . 64 A 649 TYR middle . . 65 A 650 TYR middle . . 66 A 651 HIS middle . . 67 A 652 LEU middle . . 68 A 653 LEU middle . . 69 A 654 ALA middle . . 70 A 655 GLU middle . . 71 A 656 LYS middle . . 72 A 657 ILE middle . . 73 A 658 TYR middle . . 74 A 659 LYS middle . . 75 A 660 ILE middle . . 76 A 661 GLN middle . . 77 A 662 LYS middle . . 78 A 663 GLU middle . . 79 A 664 LEU middle . . 80 A 665 GLU middle . . 81 A 666 GLU middle . . 82 A 667 LYS middle . . 83 A 668 ARG middle . . 84 A 669 ARG middle . . 85 A 670 SER middle . . 86 A 671 ARG middle . . 87 A 672 LEU end . . 88 B 840 ASP start . . 89 B 841 ALA middle . . 90 B 842 GLY middle . false 91 B 843 ASN middle . . 92 B 844 ILE middle . . 93 B 845 LEU middle . . 94 B 846 PRO middle . false 95 B 847 SER middle . . 96 B 848 ASP middle . . 97 B 849 ILE middle . . 98 B 850 MET middle . . 99 B 851 ASP middle . . 100 B 852 PHE middle . . 101 B 853 VAL middle . . 102 B 854 LEU middle . . 103 B 855 LYS middle . . 104 B 856 ASN middle . . 105 B 857 THR middle . . 106 B 858 PRO end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 586 GLY H1 H 1 8.472 0.007 A 586 GLY HAy H 1 4.000 0.015 A 586 GLY HAx H 1 3.932 0.018 A 586 GLY C C 13 173.963 0.000 A 586 GLY CA C 13 45.214 0.104 A 586 GLY N N 15 110.673 0.074 A 587 VAL H H 1 8.027 0.017 A 587 VAL HA H 1 4.098 0.017 A 587 VAL HB H 1 2.018 0.010 A 587 VAL HGx% H 1 0.891 0.010 A 587 VAL HGy% H 1 0.904 0.017 A 587 VAL C C 13 176.340 0.000 A 587 VAL CA C 13 62.229 0.078 A 587 VAL CB C 13 32.782 0.115 A 587 VAL CGy C 13 21.171 0.075 A 587 VAL CGx C 13 20.880 0.049 A 587 VAL N N 15 119.752 0.067 A 588 ARG H H 1 8.528 0.011 A 588 ARG HA H 1 4.322 0.010 A 588 ARG HB2 H 1 1.811 0.011 A 588 ARG HB3 H 1 1.811 0.011 A 588 ARG HD2 H 1 3.178 0.011 A 588 ARG HD3 H 1 3.178 0.011 A 588 ARG HGx H 1 1.560 0.012 A 588 ARG HGy H 1 1.654 0.025 A 588 ARG C C 13 176.109 0.000 A 588 ARG CA C 13 56.167 0.075 A 588 ARG CB C 13 30.651 0.065 A 588 ARG CD C 13 43.404 0.061 A 588 ARG CG C 13 27.227 0.076 A 588 ARG N N 15 125.669 0.069 A 589 LYS H H 1 8.116 0.014 A 589 LYS HA H 1 4.186 0.021 A 589 LYS HBx H 1 0.819 0.010 A 589 LYS HBy H 1 1.147 0.012 A 589 LYS C C 13 177.598 0.000 A 589 LYS CA C 13 54.923 0.144 A 589 LYS CB C 13 32.589 0.068 A 589 LYS CD C 13 29.281 0.000 A 589 LYS CE C 13 42.559 0.000 A 589 LYS CG C 13 24.725 0.000 A 589 LYS N N 15 121.018 0.102 A 590 GLY H H 1 8.669 0.015 A 590 GLY HAx H 1 3.753 0.010 A 590 GLY HAy H 1 3.967 0.016 A 590 GLY C C 13 176.465 0.000 A 590 GLY CA C 13 47.196 0.090 A 590 GLY N N 15 112.531 0.052 A 591 TRP H H 1 8.026 0.023 A 591 TRP HA H 1 4.505 0.006 A 591 TRP HBx H 1 3.167 0.017 A 591 TRP HBy H 1 3.598 0.008 A 591 TRP HD1 H 1 7.073 0.004 A 591 TRP HE1 H 1 9.228 0.010 A 591 TRP HZ2 H 1 7.509 0.004 A 591 TRP C C 13 178.177 0.000 A 591 TRP CA C 13 58.128 0.056 A 591 TRP CB C 13 27.754 0.093 A 591 TRP CD1 C 13 126.769 0.025 A 591 TRP CZ2 C 13 115.801 0.024 A 591 TRP N N 15 119.435 0.109 A 591 TRP NE1 N 15 129.443 0.029 A 592 HIS H H 1 7.165 0.013 A 592 HIS HA H 1 3.501 0.013 A 592 HIS HBy H 1 2.929 0.018 A 592 HIS HBx H 1 2.921 0.013 A 592 HIS HD1 H 1 7.449 0.000 A 592 HIS HD2 H 1 7.177 0.031 A 592 HIS CA C 13 56.278 0.106 A 592 HIS CB C 13 28.484 0.063 A 592 HIS CD2 C 13 119.991 0.067 A 592 HIS N N 15 119.340 0.068 A 593 GLU H H 1 7.726 0.013 A 593 GLU HA H 1 3.980 0.016 A 593 GLU HBx H 1 1.796 0.015 A 593 GLU HBy H 1 1.798 0.015 A 593 GLU HG2 H 1 2.118 0.012 A 593 GLU HG3 H 1 2.118 0.012 A 593 GLU C C 13 176.675 0.000 A 593 GLU CA C 13 58.108 0.106 A 593 GLU CB C 13 29.180 0.078 A 593 GLU CG C 13 35.666 0.061 A 593 GLU N N 15 116.536 0.073 A 594 HIS H H 1 7.530 0.011 A 594 HIS HA H 1 4.950 0.013 A 594 HIS HBx H 1 3.270 0.018 A 594 HIS HBy H 1 3.716 0.013 A 594 HIS HD2 H 1 7.281 0.009 A 594 HIS CA C 13 54.264 0.059 A 594 HIS CB C 13 29.182 0.080 A 594 HIS CD2 C 13 119.965 0.055 A 594 HIS N N 15 112.885 0.109 A 595 VAL H H 1 7.492 0.017 A 595 VAL HA H 1 4.500 0.007 A 595 VAL HB H 1 2.236 0.012 A 595 VAL HGx% H 1 1.153 0.009 A 595 VAL HGy% H 1 1.241 0.017 A 595 VAL C C 13 174.593 0.000 A 595 VAL CA C 13 62.043 0.084 A 595 VAL CB C 13 33.362 0.090 A 595 VAL CGy C 13 22.368 0.071 A 595 VAL CGx C 13 21.596 0.030 A 595 VAL N N 15 120.678 0.057 A 596 THR H H 1 7.583 0.010 A 596 THR HA H 1 4.494 0.000 A 596 THR HG2% H 1 1.318 0.019 A 596 THR C C 13 175.419 0.000 A 596 THR CA C 13 60.001 0.089 A 596 THR CB C 13 71.072 0.186 A 596 THR CG2 C 13 22.025 0.051 A 596 THR N N 15 115.525 0.060 A 597 GLN H H 1 8.929 0.013 A 597 GLN HA H 1 3.818 0.008 A 597 GLN HBx H 1 2.056 0.014 A 597 GLN HBy H 1 2.099 0.019 A 597 GLN HE21 H 1 7.395 0.016 A 597 GLN HE22 H 1 6.676 0.014 A 597 GLN HG2 H 1 2.375 0.011 A 597 GLN HG3 H 1 2.375 0.011 A 597 GLN C C 13 178.079 0.000 A 597 GLN CA C 13 58.754 0.073 A 597 GLN CB C 13 28.012 0.079 A 597 GLN CG C 13 33.667 0.047 A 597 GLN N N 15 120.346 0.075 A 597 GLN NE2 N 15 112.572 0.123 A 598 ASP H H 1 8.382 0.018 A 598 ASP HA H 1 4.340 0.000 A 598 ASP HB2 H 1 2.593 0.014 A 598 ASP HB3 H 1 2.593 0.014 A 598 ASP C C 13 178.494 0.000 A 598 ASP CA C 13 56.893 0.084 A 598 ASP CB C 13 40.534 0.075 A 598 ASP N N 15 117.842 0.086 A 599 LEU H H 1 7.671 0.019 A 599 LEU HA H 1 4.243 0.012 A 599 LEU HBy H 1 2.071 0.011 A 599 LEU HBx H 1 1.851 0.017 A 599 LEU HDx% H 1 1.232 0.023 A 599 LEU HDy% H 1 1.321 0.007 A 599 LEU HG H 1 1.882 0.015 A 599 LEU C C 13 179.129 0.000 A 599 LEU CA C 13 58.443 0.105 A 599 LEU CB C 13 41.634 0.096 A 599 LEU CDx C 13 24.054 0.023 A 599 LEU CDy C 13 25.688 0.041 A 599 LEU CG C 13 27.599 0.018 A 599 LEU N N 15 123.174 0.092 A 600 ARG H H 1 7.768 0.015 A 600 ARG HA H 1 4.322 0.009 A 600 ARG HB2 H 1 1.808 0.005 A 600 ARG HB3 H 1 1.808 0.005 A 600 ARG HG2 H 1 1.561 0.000 A 600 ARG HG3 H 1 1.561 0.000 A 600 ARG C C 13 179.103 0.000 A 600 ARG CA C 13 60.396 0.031 A 600 ARG CB C 13 30.520 0.188 A 600 ARG N N 15 118.132 0.093 A 601 SER H H 1 8.501 0.010 A 601 SER HA H 1 4.134 0.019 A 601 SER HBy H 1 3.969 0.009 A 601 SER HBx H 1 3.940 0.018 A 601 SER C C 13 177.665 0.000 A 601 SER CA C 13 61.534 0.100 A 601 SER CB C 13 62.758 0.085 A 601 SER N N 15 112.865 0.073 A 602 HIS H H 1 8.098 0.016 A 602 HIS HA H 1 4.493 0.012 A 602 HIS HBx H 1 3.501 0.016 A 602 HIS HBy H 1 3.538 0.014 A 602 HIS HD2 H 1 7.166 0.022 A 602 HIS CA C 13 58.909 0.059 A 602 HIS CB C 13 28.089 0.072 A 602 HIS CD2 C 13 119.967 0.100 A 602 HIS N N 15 121.543 0.121 A 603 LEU H H 1 8.293 0.012 A 603 LEU HA H 1 4.028 0.014 A 603 LEU HBy H 1 2.192 0.015 A 603 LEU HBx H 1 1.335 0.016 A 603 LEU HDx% H 1 0.959 0.017 A 603 LEU HDy% H 1 0.802 0.014 A 603 LEU HG H 1 1.947 0.017 A 603 LEU C C 13 179.275 0.000 A 603 LEU CA C 13 58.097 0.087 A 603 LEU CB C 13 40.222 0.051 A 603 LEU CDy C 13 25.757 0.083 A 603 LEU CDx C 13 22.640 0.060 A 603 LEU CG C 13 27.460 0.056 A 603 LEU N N 15 122.394 0.043 A 604 VAL H H 1 8.409 0.012 A 604 VAL HA H 1 3.428 0.017 A 604 VAL HB H 1 2.218 0.011 A 604 VAL HGx% H 1 0.829 0.017 A 604 VAL HGy% H 1 1.031 0.015 A 604 VAL C C 13 178.026 0.000 A 604 VAL CA C 13 67.892 0.091 A 604 VAL CB C 13 31.603 0.050 A 604 VAL CGx C 13 21.501 0.025 A 604 VAL CGy C 13 23.929 0.147 A 604 VAL N N 15 120.325 0.070 A 605 HIS H H 1 7.908 0.013 A 605 HIS HA H 1 4.252 0.008 A 605 HIS HBy H 1 3.411 0.006 A 605 HIS HBx H 1 3.350 0.016 A 605 HIS HD2 H 1 7.150 0.012 A 605 HIS CA C 13 59.091 0.109 A 605 HIS CB C 13 27.880 0.061 A 605 HIS CD2 C 13 119.960 0.072 A 605 HIS N N 15 116.275 0.071 A 606 LYS H H 1 8.092 0.016 A 606 LYS HA H 1 4.273 0.010 A 606 LYS C C 13 178.947 0.000 A 606 LYS CA C 13 58.804 0.102 A 606 LYS N N 15 119.506 0.126 A 607 LEU H H 1 7.994 0.019 A 607 LEU HA H 1 3.958 0.019 A 607 LEU HBy H 1 1.996 0.017 A 607 LEU HBx H 1 1.634 0.019 A 607 LEU HDx% H 1 0.884 0.020 A 607 LEU HDy% H 1 0.814 0.012 A 607 LEU C C 13 177.899 0.000 A 607 LEU CA C 13 58.826 0.088 A 607 LEU CB C 13 42.523 0.072 A 607 LEU CDy C 13 25.743 0.038 A 607 LEU CDx C 13 25.098 0.052 A 607 LEU N N 15 121.321 0.070 A 608 VAL H H 1 8.036 0.019 A 608 VAL HA H 1 3.347 0.012 A 608 VAL HB H 1 2.220 0.013 A 608 VAL HGx% H 1 0.935 0.023 A 608 VAL HGy% H 1 1.027 0.017 A 608 VAL C C 13 177.033 0.000 A 608 VAL CA C 13 67.943 0.082 A 608 VAL CB C 13 31.652 0.045 A 608 VAL CGx C 13 20.956 0.046 A 608 VAL CGy C 13 24.207 0.067 A 608 VAL N N 15 118.191 0.056 A 609 GLN H H 1 8.108 0.012 A 609 GLN HA H 1 3.888 0.013 A 609 GLN HB2 H 1 1.982 0.015 A 609 GLN HB3 H 1 1.982 0.015 A 609 GLN HE21 H 1 6.823 0.017 A 609 GLN HE22 H 1 7.426 0.016 A 609 GLN HG2 H 1 2.295 0.010 A 609 GLN HG3 H 1 2.295 0.010 A 609 GLN C C 13 176.992 0.000 A 609 GLN CA C 13 58.108 0.131 A 609 GLN CB C 13 29.153 0.097 A 609 GLN CG C 13 34.367 0.073 A 609 GLN N N 15 116.772 0.093 A 609 GLN NE2 N 15 111.483 0.129 A 610 ALA H H 1 7.756 0.012 A 610 ALA HA H 1 4.033 0.021 A 610 ALA HB% H 1 1.521 0.017 A 610 ALA C C 13 178.498 0.000 A 610 ALA CA C 13 53.778 0.122 A 610 ALA CB C 13 19.392 0.088 A 610 ALA N N 15 119.316 0.065 A 611 ILE H H 1 7.498 0.009 A 611 ILE HA H 1 3.675 0.009 A 611 ILE HB H 1 1.895 0.012 A 611 ILE HD1% H 1 0.936 0.010 A 611 ILE HG1y H 1 2.161 0.017 A 611 ILE HG1x H 1 2.102 0.006 A 611 ILE HG2% H 1 0.896 0.017 A 611 ILE C C 13 174.299 0.000 A 611 ILE CA C 13 63.725 0.066 A 611 ILE CB C 13 39.306 0.079 A 611 ILE CD1 C 13 14.122 0.059 A 611 ILE CG1 C 13 28.492 0.000 A 611 ILE CG2 C 13 18.835 0.063 A 611 ILE N N 15 115.839 0.037 A 612 PHE H H 1 8.235 0.013 A 612 PHE HA H 1 5.096 0.020 A 612 PHE HBx H 1 3.385 0.018 A 612 PHE HBy H 1 3.388 0.017 A 612 PHE HDx H 1 6.831 0.025 A 612 PHE HDy H 1 6.831 0.025 A 612 PHE HEx H 1 6.813 0.025 A 612 PHE HEy H 1 6.813 0.025 A 612 PHE C C 13 171.610 0.000 A 612 PHE CA C 13 51.716 0.044 A 612 PHE CB C 13 39.682 0.035 A 612 PHE CDx C 13 129.396 0.047 A 612 PHE CDy C 13 129.396 0.047 A 612 PHE CEx C 13 131.289 0.052 A 612 PHE CEy C 13 131.289 0.052 A 612 PHE N N 15 116.531 0.060 A 613 PRO HA H 1 4.573 0.010 A 613 PRO HBx H 1 1.989 0.019 A 613 PRO HBy H 1 2.426 0.018 A 613 PRO HDy H 1 3.732 0.016 A 613 PRO HDx H 1 3.431 0.007 A 613 PRO HGx H 1 2.022 0.025 A 613 PRO HGy H 1 2.049 0.021 A 613 PRO C C 13 178.269 0.000 A 613 PRO CA C 13 64.778 0.094 A 613 PRO CB C 13 32.444 0.058 A 613 PRO CD C 13 50.155 0.041 A 614 THR H H 1 8.025 0.016 A 614 THR HA H 1 4.470 0.021 A 614 THR HB H 1 4.166 0.015 A 614 THR HG2% H 1 1.074 0.005 A 614 THR C C 13 172.048 0.000 A 614 THR CA C 13 58.106 0.000 A 614 THR CB C 13 69.549 0.204 A 614 THR CG2 C 13 21.487 0.015 A 614 THR N N 15 109.561 0.101 A 615 PRO HA H 1 3.990 0.013 A 615 PRO HBx H 1 0.869 0.017 A 615 PRO HBy H 1 1.446 0.023 A 615 PRO HDy H 1 3.274 0.020 A 615 PRO HDx H 1 3.265 0.017 A 615 PRO HGx H 1 1.218 0.004 A 615 PRO HGy H 1 1.654 0.017 A 615 PRO C C 13 176.462 0.000 A 615 PRO CA C 13 62.692 0.111 A 615 PRO CB C 13 31.302 0.034 A 615 PRO CD C 13 49.847 0.041 A 615 PRO CG C 13 26.728 0.089 A 616 ASP H H 1 8.145 0.015 A 616 ASP HA H 1 4.753 0.016 A 616 ASP HBx H 1 2.805 0.014 A 616 ASP HBy H 1 2.990 0.012 A 616 ASP C C 13 174.226 0.000 A 616 ASP CA C 13 51.858 0.058 A 616 ASP CB C 13 39.930 0.084 A 616 ASP N N 15 122.743 0.070 A 617 PRO HA H 1 4.110 0.023 A 617 PRO HBx H 1 2.243 0.007 A 617 PRO HBy H 1 2.353 0.021 A 617 PRO HDx H 1 3.814 0.024 A 617 PRO HDy H 1 3.855 0.015 A 617 PRO HGy H 1 2.129 0.006 A 617 PRO HGx H 1 1.926 0.037 A 617 PRO C C 13 178.885 0.000 A 617 PRO CA C 13 66.015 0.167 A 617 PRO CB C 13 31.934 0.083 A 617 PRO CD C 13 50.613 0.043 A 617 PRO CG C 13 28.001 0.128 A 618 ALA H H 1 8.093 0.011 A 618 ALA HA H 1 4.083 0.016 A 618 ALA HB% H 1 1.455 0.010 A 618 ALA C C 13 180.518 0.000 A 618 ALA CA C 13 54.722 0.103 A 618 ALA CB C 13 18.191 0.073 A 618 ALA N N 15 118.548 0.088 A 619 ALA H H 1 8.039 0.011 A 619 ALA HA H 1 4.325 0.010 A 619 ALA HB% H 1 1.519 0.019 A 619 ALA C C 13 179.318 0.000 A 619 ALA CA C 13 54.685 0.101 A 619 ALA CB C 13 18.655 0.122 A 619 ALA N N 15 122.623 0.098 A 620 LEU H H 1 7.606 0.014 A 620 LEU HA H 1 4.047 0.022 A 620 LEU HBy H 1 1.786 0.012 A 620 LEU HBx H 1 1.517 0.011 A 620 LEU HDx% H 1 0.833 0.014 A 620 LEU HDy% H 1 0.849 0.006 A 620 LEU HG H 1 1.595 0.012 A 620 LEU C C 13 178.288 0.000 A 620 LEU CA C 13 57.139 0.153 A 620 LEU CB C 13 42.147 0.080 A 620 LEU CDy C 13 25.254 0.054 A 620 LEU CDx C 13 23.282 0.068 A 620 LEU CG C 13 27.166 0.081 A 620 LEU N N 15 114.041 0.105 A 621 LYS H H 1 7.272 0.013 A 621 LYS HA H 1 4.337 0.013 A 621 LYS HBx H 1 1.780 0.010 A 621 LYS HBy H 1 1.974 0.006 A 621 LYS HG2 H 1 1.504 0.008 A 621 LYS HG3 H 1 1.504 0.008 A 621 LYS C C 13 175.867 0.000 A 621 LYS CA C 13 55.453 0.110 A 621 LYS CB C 13 32.881 0.094 A 621 LYS CD C 13 29.004 0.000 A 621 LYS CE C 13 42.002 0.000 A 621 LYS CG C 13 24.835 0.061 A 621 LYS N N 15 115.255 0.072 A 622 ASP H H 1 7.454 0.017 A 622 ASP HA H 1 4.493 0.011 A 622 ASP HBy H 1 3.033 0.015 A 622 ASP HBx H 1 2.854 0.016 A 622 ASP C C 13 178.117 0.000 A 622 ASP CA C 13 53.884 0.068 A 622 ASP CB C 13 43.987 0.158 A 622 ASP N N 15 123.382 0.066 A 623 ARG H H 1 9.107 0.011 A 623 ARG HA H 1 4.087 0.007 A 623 ARG HBx H 1 1.851 0.006 A 623 ARG HBy H 1 1.862 0.017 A 623 ARG HGx H 1 1.659 0.004 A 623 ARG HGy H 1 1.722 0.004 A 623 ARG C C 13 178.321 0.000 A 623 ARG CA C 13 58.789 0.063 A 623 ARG CB C 13 29.511 0.119 A 623 ARG CD C 13 42.932 0.000 A 623 ARG CG C 13 26.876 0.072 A 623 ARG N N 15 130.356 0.046 A 624 ARG H H 1 9.582 0.016 A 624 ARG HA H 1 3.834 0.012 A 624 ARG HDx H 1 2.832 0.003 A 624 ARG HDy H 1 3.191 0.014 A 624 ARG C C 13 178.521 0.000 A 624 ARG CA C 13 58.679 0.098 A 624 ARG CB C 13 28.099 0.013 A 624 ARG CD C 13 43.715 0.145 A 624 ARG N N 15 119.125 0.053 A 625 MET H H 1 7.953 0.018 A 625 MET HA H 1 4.527 0.018 A 625 MET HBx H 1 2.382 0.019 A 625 MET HBy H 1 2.390 0.024 A 625 MET HE% H 1 1.917 0.004 A 625 MET HGx H 1 2.686 0.001 A 625 MET HGy H 1 2.687 0.001 A 625 MET C C 13 178.749 0.000 A 625 MET CA C 13 56.796 0.052 A 625 MET CB C 13 30.890 0.050 A 625 MET CE C 13 17.392 0.018 A 625 MET N N 15 120.202 0.067 A 626 GLU H H 1 7.431 0.018 A 626 GLU HA H 1 4.060 0.011 A 626 GLU HBx H 1 2.115 0.010 A 626 GLU HBy H 1 2.180 0.003 A 626 GLU C C 13 179.640 0.000 A 626 GLU CA C 13 58.980 0.128 A 626 GLU CB C 13 28.532 0.068 A 626 GLU N N 15 117.897 0.127 A 627 ASN H H 1 7.442 0.015 A 627 ASN HA H 1 4.489 0.013 A 627 ASN HBx H 1 2.811 0.006 A 627 ASN HBy H 1 2.818 0.011 A 627 ASN HD21 H 1 7.784 0.010 A 627 ASN HD22 H 1 6.839 0.009 A 627 ASN C C 13 177.540 0.000 A 627 ASN CA C 13 55.798 0.048 A 627 ASN CB C 13 37.504 0.056 A 627 ASN N N 15 117.950 0.097 A 627 ASN ND2 N 15 112.042 0.107 A 628 LEU H H 1 7.873 0.015 A 628 LEU HA H 1 4.189 0.015 A 628 LEU HBy H 1 2.473 0.018 A 628 LEU HBx H 1 1.817 0.015 A 628 LEU HDx% H 1 1.201 0.019 A 628 LEU HDy% H 1 1.207 0.013 A 628 LEU HG H 1 1.818 0.018 A 628 LEU C C 13 177.838 0.000 A 628 LEU CA C 13 59.342 0.099 A 628 LEU CB C 13 41.701 0.062 A 628 LEU CDx C 13 26.420 0.157 A 628 LEU CDy C 13 26.555 0.093 A 628 LEU CG C 13 28.772 0.080 A 628 LEU N N 15 124.396 0.048 A 629 VAL H H 1 8.246 0.009 A 629 VAL HA H 1 3.483 0.019 A 629 VAL HB H 1 2.118 0.017 A 629 VAL HGx% H 1 0.918 0.021 A 629 VAL HGy% H 1 1.127 0.008 A 629 VAL C C 13 177.552 0.000 A 629 VAL CA C 13 67.225 0.099 A 629 VAL CB C 13 31.687 0.062 A 629 VAL CGx C 13 21.184 0.079 A 629 VAL CGy C 13 22.716 0.030 A 629 VAL N N 15 120.503 0.056 A 630 ALA H H 1 8.159 0.007 A 630 ALA HA H 1 4.032 0.010 A 630 ALA HB% H 1 1.542 0.017 A 630 ALA C C 13 180.849 0.000 A 630 ALA CA C 13 55.414 0.128 A 630 ALA CB C 13 18.092 0.081 A 630 ALA N N 15 120.687 0.077 A 631 TYR H H 1 8.102 0.013 A 631 TYR HA H 1 4.239 0.019 A 631 TYR HBy H 1 3.362 0.024 A 631 TYR HBx H 1 3.238 0.013 A 631 TYR HDx H 1 6.988 0.017 A 631 TYR HDy H 1 6.988 0.017 A 631 TYR HEx H 1 6.613 0.016 A 631 TYR HEy H 1 6.613 0.016 A 631 TYR C C 13 177.591 0.000 A 631 TYR CA C 13 61.311 0.094 A 631 TYR CB C 13 38.219 0.072 A 631 TYR CDx C 13 132.511 0.050 A 631 TYR CDy C 13 132.511 0.050 A 631 TYR CEx C 13 118.406 0.062 A 631 TYR CEy C 13 118.406 0.062 A 631 TYR N N 15 121.083 0.094 A 632 ALA H H 1 8.292 0.014 A 632 ALA HA H 1 3.682 0.015 A 632 ALA HB% H 1 1.543 0.018 A 632 ALA C C 13 179.014 0.000 A 632 ALA CA C 13 55.342 0.078 A 632 ALA CB C 13 19.824 0.052 A 632 ALA N N 15 122.444 0.048 A 633 LYS H H 1 8.548 0.016 A 633 LYS HA H 1 4.010 0.021 A 633 LYS HBx H 1 1.862 0.013 A 633 LYS HBy H 1 2.009 0.019 A 633 LYS HD2 H 1 1.635 0.028 A 633 LYS HD3 H 1 1.635 0.028 A 633 LYS HEx H 1 2.839 0.021 A 633 LYS HEy H 1 2.907 0.015 A 633 LYS HG2 H 1 1.367 0.003 A 633 LYS HG3 H 1 1.367 0.003 A 633 LYS C C 13 180.004 0.000 A 633 LYS CA C 13 59.704 0.146 A 633 LYS CB C 13 32.667 0.243 A 633 LYS CD C 13 29.828 0.044 A 633 LYS CE C 13 42.006 0.107 A 633 LYS CG C 13 26.855 0.037 A 633 LYS N N 15 115.912 0.053 A 634 LYS H H 1 7.943 0.007 A 634 LYS HA H 1 4.012 0.003 A 634 LYS C C 13 178.603 0.000 A 634 LYS CA C 13 59.102 0.071 A 634 LYS CB C 13 31.789 0.083 A 634 LYS CD C 13 29.019 0.000 A 634 LYS CE C 13 42.314 0.000 A 634 LYS CG C 13 24.702 0.000 A 634 LYS N N 15 123.870 0.082 A 635 VAL H H 1 8.165 0.013 A 635 VAL HA H 1 3.676 0.016 A 635 VAL HB H 1 1.879 0.016 A 635 VAL HGx% H 1 0.798 0.012 A 635 VAL HGy% H 1 0.525 0.012 A 635 VAL C C 13 178.574 0.000 A 635 VAL CA C 13 66.100 0.082 A 635 VAL CB C 13 31.611 0.179 A 635 VAL CGy C 13 22.149 0.109 A 635 VAL CGx C 13 22.063 0.041 A 635 VAL N N 15 119.215 0.053 A 636 GLU H H 1 8.331 0.016 A 636 GLU HA H 1 3.862 0.006 A 636 GLU HBx H 1 1.573 0.000 A 636 GLU HBy H 1 1.576 0.001 A 636 GLU HGx H 1 2.315 0.000 A 636 GLU HGy H 1 2.322 0.011 A 636 GLU C C 13 178.666 0.000 A 636 GLU CA C 13 61.689 0.104 A 636 GLU CB C 13 28.719 0.125 A 636 GLU CG C 13 35.411 0.086 A 636 GLU N N 15 120.094 0.054 A 637 GLY H H 1 8.145 0.015 A 637 GLY HAx H 1 3.597 0.016 A 637 GLY HAy H 1 3.880 0.014 A 637 GLY C C 13 176.614 0.000 A 637 GLY CA C 13 47.337 0.140 A 637 GLY N N 15 106.839 0.080 A 638 ASP H H 1 8.338 0.015 A 638 ASP HA H 1 4.543 0.011 A 638 ASP HBx H 1 2.747 0.015 A 638 ASP HBy H 1 2.954 0.012 A 638 ASP C C 13 180.109 0.005 A 638 ASP CA C 13 56.894 0.069 A 638 ASP CB C 13 40.088 0.124 A 638 ASP N N 15 122.731 0.060 A 639 MET H H 1 8.193 0.006 A 639 MET HA H 1 4.389 0.022 A 639 MET HBy H 1 2.469 0.010 A 639 MET HBx H 1 2.143 0.021 A 639 MET HE% H 1 1.998 0.014 A 639 MET HGx H 1 2.724 0.017 A 639 MET HGy H 1 2.892 0.020 A 639 MET C C 13 177.737 0.000 A 639 MET CA C 13 58.675 0.069 A 639 MET CB C 13 32.530 0.000 A 639 MET CE C 13 19.350 0.020 A 639 MET CG C 13 33.093 0.057 A 639 MET N N 15 121.055 0.035 A 640 TYR H H 1 9.328 0.012 A 640 TYR HA H 1 4.298 0.017 A 640 TYR HBy H 1 3.538 0.012 A 640 TYR HBx H 1 3.087 0.022 A 640 TYR HDx H 1 6.512 0.013 A 640 TYR HDy H 1 6.512 0.013 A 640 TYR HEx H 1 5.957 0.011 A 640 TYR HEy H 1 5.957 0.011 A 640 TYR C C 13 178.311 0.000 A 640 TYR CA C 13 61.907 0.094 A 640 TYR CB C 13 38.950 0.075 A 640 TYR CDx C 13 132.599 0.060 A 640 TYR CDy C 13 132.599 0.060 A 640 TYR CEx C 13 117.039 0.063 A 640 TYR CEy C 13 117.039 0.063 A 640 TYR N N 15 121.235 0.080 A 641 GLU H H 1 8.079 0.011 A 641 GLU HA H 1 4.366 0.016 A 641 GLU HBx H 1 2.150 0.013 A 641 GLU HBy H 1 2.239 0.003 A 641 GLU HGx H 1 2.568 0.012 A 641 GLU HGy H 1 2.636 0.011 A 641 GLU C C 13 178.006 0.000 A 641 GLU CA C 13 57.446 0.026 A 641 GLU CB C 13 29.702 0.027 A 641 GLU CG C 13 35.237 0.058 A 641 GLU N N 15 115.098 0.081 A 642 SER H H 1 7.968 0.005 A 642 SER HA H 1 4.394 0.008 A 642 SER HB2 H 1 3.923 0.011 A 642 SER HB3 H 1 3.923 0.011 A 642 SER C C 13 175.251 0.000 A 642 SER CA C 13 60.175 0.023 A 642 SER CB C 13 64.388 0.182 A 642 SER N N 15 112.869 0.067 A 643 ALA H H 1 8.096 0.017 A 643 ALA HA H 1 4.227 0.023 A 643 ALA HB% H 1 1.584 0.019 A 643 ALA C C 13 177.897 0.000 A 643 ALA CA C 13 52.599 0.082 A 643 ALA CB C 13 19.692 0.061 A 643 ALA N N 15 123.763 0.106 A 644 ASN H H 1 9.102 0.013 A 644 ASN HA H 1 5.110 0.014 A 644 ASN HBx H 1 2.748 0.012 A 644 ASN HBy H 1 2.932 0.023 A 644 ASN HD21 H 1 8.013 0.020 A 644 ASN HD22 H 1 7.003 0.009 A 644 ASN C C 13 173.978 0.000 A 644 ASN CA C 13 53.354 0.082 A 644 ASN CB C 13 40.219 0.084 A 644 ASN N N 15 117.176 0.090 A 644 ASN ND2 N 15 115.923 0.112 A 645 SER H H 1 6.865 0.012 A 645 SER HA H 1 3.632 0.016 A 645 SER HB2 H 1 3.888 0.010 A 645 SER HB3 H 1 3.888 0.010 A 645 SER C C 13 171.965 0.000 A 645 SER CA C 13 56.522 0.076 A 645 SER CB C 13 64.968 0.172 A 645 SER N N 15 111.225 0.082 A 646 ARG H H 1 8.685 0.012 A 646 ARG HA H 1 3.186 0.013 A 646 ARG HBy H 1 1.901 0.016 A 646 ARG HBx H 1 1.864 0.012 A 646 ARG HDy H 1 3.364 0.020 A 646 ARG HDx H 1 3.230 0.024 A 646 ARG HGy H 1 1.665 0.011 A 646 ARG HGx H 1 1.560 0.015 A 646 ARG C C 13 177.709 0.000 A 646 ARG CA C 13 59.031 0.087 A 646 ARG CB C 13 30.253 0.122 A 646 ARG CD C 13 43.838 0.041 A 646 ARG CG C 13 27.214 0.082 A 646 ARG N N 15 121.944 0.074 A 647 ASP H H 1 8.119 0.008 A 647 ASP HA H 1 4.295 0.015 A 647 ASP HB2 H 1 2.479 0.012 A 647 ASP HB3 H 1 2.479 0.012 A 647 ASP C C 13 178.860 0.000 A 647 ASP CA C 13 57.125 0.060 A 647 ASP CB C 13 40.289 0.082 A 647 ASP N N 15 116.817 0.048 A 648 GLU H H 1 7.799 0.011 A 648 GLU HA H 1 3.990 0.022 A 648 GLU HB2 H 1 1.891 0.023 A 648 GLU HB3 H 1 1.891 0.023 A 648 GLU HGy H 1 2.353 0.006 A 648 GLU HGx H 1 2.214 0.021 A 648 GLU C C 13 177.064 0.000 A 648 GLU CA C 13 59.262 0.067 A 648 GLU CB C 13 30.138 0.180 A 648 GLU CG C 13 36.447 0.078 A 648 GLU N N 15 121.231 0.083 A 649 TYR H H 1 7.338 0.012 A 649 TYR HA H 1 3.999 0.009 A 649 TYR HBy H 1 2.894 0.015 A 649 TYR HBx H 1 2.645 0.011 A 649 TYR HDx H 1 6.821 0.015 A 649 TYR HDy H 1 6.821 0.015 A 649 TYR HEx H 1 6.832 0.020 A 649 TYR HEy H 1 6.832 0.020 A 649 TYR C C 13 176.140 0.000 A 649 TYR CA C 13 60.669 0.161 A 649 TYR CB C 13 38.957 0.129 A 649 TYR CDx C 13 133.188 0.063 A 649 TYR CDy C 13 133.188 0.063 A 649 TYR CEx C 13 118.222 0.080 A 649 TYR CEy C 13 118.222 0.080 A 649 TYR N N 15 122.045 0.033 A 650 TYR H H 1 8.072 0.013 A 650 TYR HA H 1 3.999 0.009 A 650 TYR HBy H 1 3.072 0.024 A 650 TYR HBx H 1 3.005 0.016 A 650 TYR HDx H 1 7.092 0.011 A 650 TYR HDy H 1 7.092 0.011 A 650 TYR HEx H 1 6.829 0.011 A 650 TYR HEy H 1 6.829 0.011 A 650 TYR C C 13 179.058 0.000 A 650 TYR CA C 13 60.493 0.092 A 650 TYR CB C 13 37.642 0.102 A 650 TYR CDx C 13 132.118 0.036 A 650 TYR CDy C 13 132.118 0.036 A 650 TYR CEx C 13 118.105 0.071 A 650 TYR CEy C 13 118.105 0.071 A 650 TYR N N 15 115.581 0.110 A 651 HIS H H 1 8.311 0.013 A 651 HIS HA H 1 4.313 0.018 A 651 HIS HBx H 1 3.341 0.000 A 651 HIS HBy H 1 3.364 0.012 A 651 HIS HD2 H 1 7.220 0.001 A 651 HIS CA C 13 59.303 0.068 A 651 HIS CB C 13 28.256 0.118 A 651 HIS CD2 C 13 120.040 0.052 A 651 HIS N N 15 118.435 0.105 A 652 LEU H H 1 9.141 0.014 A 652 LEU HA H 1 3.993 0.011 A 652 LEU HBy H 1 2.072 0.020 A 652 LEU HBx H 1 2.043 0.000 A 652 LEU HDx% H 1 1.000 0.021 A 652 LEU HDy% H 1 0.956 0.012 A 652 LEU HG H 1 1.646 0.017 A 652 LEU C C 13 180.822 0.001 A 652 LEU CA C 13 57.893 0.127 A 652 LEU CB C 13 42.037 0.070 A 652 LEU CDy C 13 26.027 0.044 A 652 LEU CDx C 13 22.199 0.047 A 652 LEU N N 15 121.135 0.071 A 653 LEU H H 1 7.769 0.015 A 653 LEU HA H 1 3.833 0.010 A 653 LEU HBx H 1 1.336 0.013 A 653 LEU HBy H 1 1.720 0.018 A 653 LEU HDx% H 1 0.540 0.012 A 653 LEU HDy% H 1 0.753 0.011 A 653 LEU HG H 1 1.593 0.028 A 653 LEU C C 13 178.085 0.001 A 653 LEU CA C 13 58.338 0.236 A 653 LEU CB C 13 41.886 0.068 A 653 LEU CDy C 13 25.809 0.042 A 653 LEU CDx C 13 24.926 0.048 A 653 LEU CG C 13 27.210 0.040 A 653 LEU N N 15 120.947 0.030 A 654 ALA H H 1 8.111 0.014 A 654 ALA HA H 1 3.884 0.024 A 654 ALA HB% H 1 1.450 0.023 A 654 ALA C C 13 180.274 0.000 A 654 ALA CA C 13 55.356 0.086 A 654 ALA CB C 13 18.190 0.080 A 654 ALA N N 15 120.863 0.065 A 655 GLU H H 1 8.363 0.010 A 655 GLU HA H 1 4.018 0.024 A 655 GLU HBy H 1 2.064 0.003 A 655 GLU HBx H 1 2.007 0.017 A 655 GLU HGy H 1 2.303 0.010 A 655 GLU HGx H 1 2.186 0.009 A 655 GLU C C 13 178.311 0.000 A 655 GLU CA C 13 59.079 0.123 A 655 GLU CB C 13 29.414 0.123 A 655 GLU CG C 13 35.832 0.103 A 655 GLU N N 15 118.047 0.101 A 656 LYS H H 1 7.852 0.010 A 656 LYS HA H 1 4.050 0.017 A 656 LYS C C 13 178.388 0.000 A 656 LYS CA C 13 58.129 0.116 A 656 LYS CB C 13 31.410 0.050 A 656 LYS N N 15 120.122 0.073 A 657 ILE H H 1 8.199 0.008 A 657 ILE HA H 1 3.391 0.013 A 657 ILE HB H 1 1.894 0.020 A 657 ILE HD1% H 1 0.722 0.005 A 657 ILE HG2% H 1 0.808 0.012 A 657 ILE C C 13 177.061 0.000 A 657 ILE CA C 13 66.526 0.068 A 657 ILE CB C 13 37.900 0.054 A 657 ILE CD1 C 13 13.396 0.028 A 657 ILE CG1 C 13 31.101 0.000 A 657 ILE CG2 C 13 17.139 0.053 A 657 ILE N N 15 118.294 0.041 A 658 TYR H H 1 8.066 0.013 A 658 TYR HA H 1 4.303 0.012 A 658 TYR HBx H 1 3.145 0.005 A 658 TYR HBy H 1 3.154 0.024 A 658 TYR HDx H 1 7.103 0.007 A 658 TYR HDy H 1 7.103 0.007 A 658 TYR HEx H 1 6.798 0.015 A 658 TYR HEy H 1 6.798 0.015 A 658 TYR C C 13 177.869 0.000 A 658 TYR CA C 13 60.869 0.153 A 658 TYR CB C 13 38.205 0.022 A 658 TYR CDx C 13 133.322 0.059 A 658 TYR CDy C 13 133.322 0.059 A 658 TYR CEx C 13 118.083 0.051 A 658 TYR CEy C 13 118.083 0.051 A 658 TYR N N 15 119.430 0.132 A 659 LYS H H 1 8.309 0.009 A 659 LYS HA H 1 3.814 0.009 A 659 LYS HDx H 1 1.731 0.018 A 659 LYS HDy H 1 1.930 0.023 A 659 LYS HEx H 1 2.902 0.000 A 659 LYS HEy H 1 2.982 0.050 A 659 LYS C C 13 180.019 0.000 A 659 LYS CA C 13 59.860 0.093 A 659 LYS CB C 13 32.691 0.000 A 659 LYS CD C 13 29.480 0.100 A 659 LYS N N 15 118.321 0.059 A 660 ILE H H 1 8.546 0.018 A 660 ILE HA H 1 3.586 0.017 A 660 ILE HB H 1 1.954 0.016 A 660 ILE HD1% H 1 0.917 0.017 A 660 ILE HG12 H 1 1.486 0.000 A 660 ILE HG13 H 1 1.486 0.000 A 660 ILE HG2% H 1 0.891 0.023 A 660 ILE C C 13 177.404 0.000 A 660 ILE CA C 13 66.076 0.052 A 660 ILE CB C 13 38.384 0.021 A 660 ILE CD1 C 13 14.240 0.053 A 660 ILE CG2 C 13 18.011 0.062 A 660 ILE N N 15 121.103 0.101 A 661 GLN H H 1 8.554 0.014 A 661 GLN HA H 1 3.931 0.014 A 661 GLN HBy H 1 2.315 0.014 A 661 GLN HBx H 1 1.960 0.013 A 661 GLN HE21 H 1 7.333 0.020 A 661 GLN HE22 H 1 6.689 0.017 A 661 GLN HGy H 1 2.691 0.014 A 661 GLN HGx H 1 2.310 0.016 A 661 GLN C C 13 179.682 0.000 A 661 GLN CA C 13 59.868 0.085 A 661 GLN CB C 13 28.061 0.074 A 661 GLN CG C 13 34.776 0.048 A 661 GLN N N 15 118.093 0.076 A 661 GLN NE2 N 15 110.241 0.156 A 662 LYS H H 1 8.110 0.009 A 662 LYS HA H 1 3.961 0.024 A 662 LYS C C 13 178.745 0.000 A 662 LYS CA C 13 58.521 0.071 A 662 LYS CB C 13 31.622 0.076 A 662 LYS CD C 13 28.411 0.000 A 662 LYS CE C 13 41.831 0.000 A 662 LYS CG C 13 24.010 0.000 A 662 LYS N N 15 119.532 0.034 A 663 GLU H H 1 8.011 0.022 A 663 GLU HA H 1 4.021 0.020 A 663 GLU HBx H 1 2.141 0.019 A 663 GLU HBy H 1 2.389 0.011 A 663 GLU C C 13 179.429 0.000 A 663 GLU CA C 13 59.493 0.142 A 663 GLU CB C 13 29.164 0.066 A 663 GLU CG C 13 35.709 0.096 A 663 GLU N N 15 121.313 0.069 A 664 LEU H H 1 8.342 0.008 A 664 LEU HA H 1 3.918 0.013 A 664 LEU HBx H 1 1.417 0.009 A 664 LEU HBy H 1 1.942 0.009 A 664 LEU HDx% H 1 0.966 0.009 A 664 LEU HDy% H 1 0.782 0.010 A 664 LEU HG H 1 1.751 0.020 A 664 LEU C C 13 178.785 0.000 A 664 LEU CA C 13 58.174 0.079 A 664 LEU CB C 13 41.905 0.069 A 664 LEU CDy C 13 26.821 0.057 A 664 LEU CDx C 13 23.801 0.044 A 664 LEU CG C 13 26.767 0.000 A 664 LEU N N 15 119.460 0.108 A 665 GLU H H 1 8.018 0.019 A 665 GLU HA H 1 3.973 0.004 A 665 GLU C C 13 179.161 0.000 A 665 GLU CA C 13 58.815 0.000 A 665 GLU CB C 13 29.133 0.038 A 665 GLU CG C 13 35.296 0.000 A 665 GLU N N 15 118.822 0.097 A 666 GLU H H 1 8.014 0.017 A 666 GLU HA H 1 3.972 0.008 A 666 GLU C C 13 179.536 0.000 A 666 GLU CA C 13 58.910 0.115 A 666 GLU CB C 13 28.881 0.000 A 666 GLU N N 15 118.722 0.110 A 667 LYS H H 1 8.056 0.005 A 667 LYS HA H 1 4.141 0.010 A 667 LYS HE2 H 1 2.931 0.002 A 667 LYS HE3 H 1 2.931 0.002 A 667 LYS HG2 H 1 1.631 0.017 A 667 LYS HG3 H 1 1.631 0.017 A 667 LYS C C 13 179.425 0.000 A 667 LYS CA C 13 57.383 0.098 A 667 LYS CB C 13 32.005 0.000 A 667 LYS CD C 13 28.121 0.000 A 667 LYS CE C 13 42.129 0.000 A 667 LYS CG C 13 25.043 0.061 A 667 LYS N N 15 119.177 0.040 A 668 ARG H H 1 8.218 0.008 A 668 ARG HA H 1 3.959 0.002 A 668 ARG C C 13 178.260 0.000 A 668 ARG CA C 13 58.964 0.060 A 668 ARG CB C 13 30.211 0.064 A 668 ARG N N 15 119.491 0.081 A 669 ARG H H 1 7.793 0.012 A 669 ARG HA H 1 4.170 0.019 A 669 ARG HB2 H 1 1.888 0.017 A 669 ARG HB3 H 1 1.888 0.017 A 669 ARG C C 13 177.325 0.000 A 669 ARG CA C 13 57.551 0.062 A 669 ARG CB C 13 30.109 0.021 A 669 ARG CD C 13 43.377 0.000 A 669 ARG CG C 13 27.317 0.000 A 669 ARG N N 15 117.972 0.107 A 670 SER H H 1 7.794 0.008 A 670 SER HA H 1 4.410 0.013 A 670 SER HB2 H 1 3.942 0.004 A 670 SER HB3 H 1 3.942 0.004 A 670 SER C C 13 174.266 0.000 A 670 SER CA C 13 58.946 0.079 A 670 SER CB C 13 63.814 0.249 A 670 SER N N 15 114.336 0.076 A 671 ARG H H 1 7.740 0.008 A 671 ARG HA H 1 4.347 0.013 A 671 ARG HB2 H 1 1.742 0.007 A 671 ARG HB3 H 1 1.742 0.007 A 671 ARG HD2 H 1 3.170 0.013 A 671 ARG HD3 H 1 3.170 0.013 A 671 ARG C C 13 175.272 0.000 A 671 ARG CA C 13 56.121 0.063 A 671 ARG CB C 13 30.507 0.065 A 671 ARG CD C 13 43.442 0.058 A 671 ARG CG C 13 26.772 0.000 A 671 ARG N N 15 122.062 0.077 A 672 LEU H H 1 7.699 0.012 A 672 LEU HA H 1 4.179 0.018 A 672 LEU HBy H 1 1.601 0.020 A 672 LEU HBx H 1 1.593 0.015 A 672 LEU HDx% H 1 0.891 0.017 A 672 LEU HDy% H 1 0.852 0.004 A 672 LEU C C 13 182.273 0.000 A 672 LEU CA C 13 56.357 0.094 A 672 LEU CB C 13 43.244 0.058 A 672 LEU CDy C 13 25.309 0.035 A 672 LEU CDx C 13 23.357 0.074 A 672 LEU N N 15 127.973 0.091 B 840 ASP H1 H 1 8.150 0.005 B 840 ASP HA H 1 4.545 0.023 B 840 ASP HBy H 1 2.693 0.004 B 840 ASP HBx H 1 2.676 0.020 B 840 ASP C C 13 175.967 0.004 B 840 ASP CA C 13 52.225 0.003 B 840 ASP CB C 13 41.236 0.019 B 840 ASP N N 15 121.043 0.029 B 841 ALA H H 1 8.242 0.009 B 841 ALA HA H 1 4.588 0.000 B 841 ALA HB% H 1 1.408 0.005 B 841 ALA C C 13 178.153 0.004 B 841 ALA CA C 13 50.805 0.010 B 841 ALA CB C 13 19.284 0.009 B 841 ALA N N 15 124.425 0.027 B 842 GLY H H 1 8.379 0.002 B 842 GLY HA2 H 1 3.923 0.001 B 842 GLY HA3 H 1 3.923 0.001 B 842 GLY C C 13 173.892 0.000 B 842 GLY CA C 13 43.189 0.001 B 842 GLY N N 15 107.424 0.019 B 843 ASN H H 1 8.152 0.006 B 843 ASN HA H 1 4.754 0.008 B 843 ASN HBx H 1 2.665 0.011 B 843 ASN HBy H 1 2.848 0.002 B 843 ASN HD21 H 1 6.938 0.009 B 843 ASN HD22 H 1 7.596 0.006 B 843 ASN C C 13 175.362 0.005 B 843 ASN CA C 13 51.024 0.003 B 843 ASN CB C 13 39.275 0.005 B 843 ASN N N 15 118.674 0.010 B 843 ASN ND2 N 15 112.944 0.029 B 844 ILE H H 1 9.623 0.007 B 844 ILE HA H 1 4.050 0.007 B 844 ILE HB H 1 1.928 0.017 B 844 ILE HD1% H 1 0.835 0.010 B 844 ILE HG1x H 1 1.175 0.003 B 844 ILE HG1y H 1 1.474 0.010 B 844 ILE HG2% H 1 0.855 0.009 B 844 ILE C C 13 176.869 0.000 B 844 ILE CA C 13 60.498 0.043 B 844 ILE CB C 13 38.494 0.006 B 844 ILE CD1 C 13 13.548 0.042 B 844 ILE CG1 C 13 27.672 0.028 B 844 ILE CG2 C 13 18.049 0.041 B 844 ILE N N 15 123.402 0.063 B 845 LEU H H 1 8.858 0.005 B 845 LEU HA H 1 4.411 0.002 B 845 LEU HB2 H 1 1.554 0.012 B 845 LEU HB3 H 1 1.554 0.012 B 845 LEU HD1% H 1 0.772 0.011 B 845 LEU HD2% H 1 0.772 0.011 B 845 LEU HG H 1 1.254 0.023 B 845 LEU C C 13 174.427 0.000 B 845 LEU CA C 13 50.279 0.000 B 845 LEU CB C 13 43.207 0.035 B 845 LEU CD1 C 13 24.802 0.010 B 845 LEU CD2 C 13 24.802 0.010 B 845 LEU N N 15 123.673 0.034 B 846 PRO C C 13 178.181 0.000 B 846 PRO CA C 13 60.601 0.026 B 847 SER H H 1 8.916 0.002 B 847 SER HA H 1 4.402 0.011 B 847 SER HB2 H 1 3.927 0.009 B 847 SER HB3 H 1 3.927 0.009 B 847 SER C C 13 175.627 0.000 B 847 SER CA C 13 60.038 0.007 B 847 SER N N 15 120.069 0.040 B 848 ASP H H 1 8.911 0.007 B 848 ASP HA H 1 4.388 0.007 B 848 ASP HBx H 1 2.564 0.014 B 848 ASP HBy H 1 2.682 0.004 B 848 ASP C C 13 178.955 0.003 B 848 ASP CA C 13 54.393 0.013 B 848 ASP CB C 13 39.371 0.007 B 848 ASP N N 15 119.269 0.028 B 849 ILE H H 1 7.175 0.007 B 849 ILE HA H 1 3.874 0.020 B 849 ILE HB H 1 1.716 0.009 B 849 ILE HD1% H 1 0.645 0.007 B 849 ILE HG1x H 1 1.058 0.028 B 849 ILE HG1y H 1 1.490 0.016 B 849 ILE HG2% H 1 0.851 0.023 B 849 ILE C C 13 177.044 0.052 B 849 ILE CA C 13 61.864 0.021 B 849 ILE CB C 13 37.528 0.009 B 849 ILE CD1 C 13 12.791 0.020 B 849 ILE CG2 C 13 18.335 0.059 B 849 ILE N N 15 121.423 0.024 B 850 MET H H 1 8.089 0.011 B 850 MET HA H 1 3.909 0.012 B 850 MET HBy H 1 2.088 0.008 B 850 MET HBx H 1 1.912 0.002 B 850 MET HE% H 1 1.988 0.001 B 850 MET HG2 H 1 2.415 0.023 B 850 MET HG3 H 1 2.415 0.023 B 850 MET C C 13 176.975 0.000 B 850 MET CA C 13 57.090 0.018 B 850 MET CB C 13 32.221 0.052 B 850 MET CE C 13 17.624 0.014 B 850 MET N N 15 119.407 0.037 B 851 ASP H H 1 8.229 0.007 B 851 ASP HA H 1 4.289 0.005 B 851 ASP HBx H 1 2.599 0.014 B 851 ASP HBy H 1 2.712 0.021 B 851 ASP C C 13 177.653 0.000 B 851 ASP CA C 13 55.440 0.005 B 851 ASP CB C 13 41.255 0.016 B 851 ASP N N 15 116.671 0.033 B 852 PHE H H 1 7.290 0.011 B 852 PHE HA H 1 4.320 0.021 B 852 PHE HB2 H 1 3.243 0.017 B 852 PHE HB3 H 1 3.243 0.017 B 852 PHE HDx H 1 7.072 0.022 B 852 PHE HDy H 1 7.072 0.022 B 852 PHE HEx H 1 7.532 0.024 B 852 PHE HEy H 1 7.532 0.024 B 852 PHE C C 13 176.838 0.000 B 852 PHE CA C 13 57.243 0.031 B 852 PHE CB C 13 39.544 0.018 B 852 PHE N N 15 118.549 0.053 B 853 VAL H H 1 8.106 0.009 B 853 VAL HA H 1 3.922 0.026 B 853 VAL HB H 1 1.843 0.012 B 853 VAL HGx% H 1 0.650 0.018 B 853 VAL HGy% H 1 0.818 0.011 B 853 VAL C C 13 179.082 0.013 B 853 VAL CA C 13 63.476 0.003 B 853 VAL CGy C 13 21.891 0.019 B 853 VAL CGx C 13 21.616 0.109 B 853 VAL N N 15 117.171 0.079 B 854 LEU H H 1 8.361 0.014 B 854 LEU HA H 1 3.954 0.010 B 854 LEU HB2 H 1 1.771 0.022 B 854 LEU HB3 H 1 1.771 0.022 B 854 LEU HDx% H 1 0.800 0.005 B 854 LEU HDy% H 1 0.758 0.018 B 854 LEU HG H 1 1.430 0.007 B 854 LEU C C 13 179.214 0.017 B 854 LEU CA C 13 55.035 0.025 B 854 LEU CDy C 13 25.823 0.072 B 854 LEU CDx C 13 22.973 0.007 B 854 LEU N N 15 119.806 0.026 B 855 LYS H H 1 7.739 0.009 B 855 LYS HA H 1 4.141 0.010 B 855 LYS HBy H 1 1.874 0.004 B 855 LYS HBx H 1 1.871 0.002 B 855 LYS HD2 H 1 1.683 0.000 B 855 LYS HD3 H 1 1.683 0.000 B 855 LYS HE2 H 1 2.979 0.000 B 855 LYS HE3 H 1 2.979 0.000 B 855 LYS HGy H 1 1.463 0.003 B 855 LYS HGx H 1 1.457 0.008 B 855 LYS C C 13 176.957 0.000 B 855 LYS CA C 13 55.662 0.034 B 855 LYS CG C 13 25.318 0.012 B 855 LYS N N 15 117.264 0.032 B 856 ASN H H 1 7.396 0.006 B 856 ASN HA H 1 4.805 0.000 B 856 ASN HB2 H 1 2.917 0.008 B 856 ASN HB3 H 1 2.917 0.008 B 856 ASN C C 13 173.621 0.000 B 856 ASN CA C 13 51.600 0.001 B 856 ASN N N 15 115.917 0.051 B 857 THR H H 1 7.473 0.010 B 857 THR HA H 1 4.775 0.000 B 857 THR HB H 1 4.146 0.000 B 857 THR HG2% H 1 1.179 0.004 B 857 THR C C 13 171.722 0.000 B 857 THR CA C 13 57.466 0.000 B 857 THR CG2 C 13 21.588 0.005 B 857 THR N N 15 115.043 0.050 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 586 GLY HAx A 586 GLY H1 1.0 1.773 2.917 2 2 A 586 GLY H1 A 586 GLY HAy 1.0 2.165 3.373 3 3 A 586 GLY HAx A 587 VAL H 1.0 1.583 2.627 4 4 A 587 VAL HA A 587 VAL HB 1.0 1.901 3.191 5 5 A 587 VAL HA A 588 ARG H 1.0 2.205 3.445 6 6 A 587 VAL HB A 588 ARG H 1.0 1.789 2.991 7 7 A 588 ARG H A 588 ARG HB2 1.0 1.919 3.199 8 7 A 588 ARG H A 588 ARG HB3 1.0 1.919 3.199 9 8 A 588 ARG HGx A 588 ARG HA 1.0 2.914 4.204 10 9 A 588 ARG HA A 588 ARG HGy 1.0 4.106 5.372 11 10 A 588 ARG H A 588 ARG HA 1.0 2.145 3.425 12 11 A 588 ARG H A 588 ARG HGy 1.0 3.247 4.483 13 12 A 588 ARG H A 588 ARG HGx 1.0 1.884 3.132 14 13 A 588 ARG HGx A 589 LYS H 1.0 2.180 3.488 15 14 A 588 ARG HGy A 589 LYS H 1.0 3.971 5.291 16 15 A 587 VAL HB A 589 LYS H 1.0 2.110 3.502 17 16 A 589 LYS HBy A 589 LYS HBx 1.0 1.073 2.249 18 17 A 589 LYS HBy A 589 LYS HA 1.0 2.105 3.413 19 18 A 589 LYS HBx A 589 LYS HA 1.0 2.641 3.993 20 19 A 589 LYS H A 589 LYS HBy 1.0 3.147 4.655 21 20 A 589 LYS H A 589 LYS HBx 1.0 1.477 2.685 22 21 A 589 LYS HBy A 591 TRP HE1 1.0 3.375 4.741 23 22 A 589 LYS HA A 590 GLY H 1.0 1.615 2.801 24 23 A 589 LYS HBy A 590 GLY H 1.0 3.241 4.547 25 24 A 589 LYS HBx A 590 GLY H 1.0 4.266 5.838 26 25 A 590 GLY HAx A 590 GLY HAy 1.0 1.472 2.690 27 26 A 590 GLY H A 590 GLY HAy 1.0 1.779 2.989 28 27 A 590 GLY H A 590 GLY HAx 1.0 2.219 3.467 29 28 A 590 GLY HAx A 591 TRP H 1.0 2.974 4.442 30 29 A 590 GLY H A 591 TRP H 1.0 1.842 3.116 31 30 A 590 GLY HAx A 592 HIS H 1.0 4.448 6.124 32 31 A 591 TRP H A 591 TRP HD1 1.0 2.994 4.310 33 32 A 591 TRP HE1 A 591 TRP HZ2 1.0 2.683 3.893 34 33 A 591 TRP HE1 A 591 TRP HD1 1.0 2.081 3.347 35 34 A 591 TRP H A 591 TRP HA 1.0 2.146 3.478 36 35 A 591 TRP H A 591 TRP HBy 1.0 2.165 3.467 37 36 A 591 TRP HE1 A 591 TRP H 1.0 3.481 4.737 38 37 A 591 TRP HE1 A 591 TRP HBx 1.0 4.323 5.895 39 38 A 591 TRP HE1 A 591 TRP HBy 1.0 4.367 5.991 40 39 A 591 TRP H A 592 HIS H 1.0 1.649 2.875 41 40 A 592 HIS H A 591 TRP HBy 1.0 1.960 3.200 42 41 A 590 GLY H A 592 HIS H 1.0 4.450 5.952 43 42 A 592 HIS H A 591 TRP HA 1.0 3.404 4.834 44 43 A 592 HIS HA A 592 HIS HBy 1.0 2.126 3.436 45 44 A 592 HIS H A 592 HIS HBy 1.0 3.396 4.808 46 45 A 592 HIS H A 592 HIS HA 1.0 2.019 3.337 47 46 A 592 HIS H A 592 HIS HBx 1.0 1.548 2.702 48 47 A 592 HIS H A 592 HIS HD1 1.0 3.264 4.718 49 48 A 592 HIS HBx A 593 GLU H 1.0 3.320 5.038 50 49 A 592 HIS HBy A 593 GLU H 1.0 3.560 5.296 51 50 A 592 HIS H A 593 GLU H 1.0 1.688 2.954 52 51 A 592 HIS HA A 593 GLU H 1.0 2.629 3.937 53 52 A 592 HIS H A 593 GLU HBx 1.0 3.688 5.216 54 52 A 592 HIS H A 593 GLU HBy 1.0 3.688 5.216 55 53 A 592 HIS H A 593 GLU HG2 1.0 4.037 5.817 56 53 A 592 HIS H A 593 GLU HG3 1.0 4.037 5.817 57 54 A 592 HIS HA A 595 VAL HB 1.0 3.092 4.746 58 55 A 592 HIS HA A 595 VAL H 1.0 3.283 4.747 59 56 A 591 TRP HA A 593 GLU H 1.0 3.096 4.544 60 57 A 593 GLU HA A 593 GLU HG2 1.0 3.039 4.309 61 57 A 593 GLU HG3 A 593 GLU HA 1.0 3.039 4.309 62 58 A 593 GLU HBy A 593 GLU HG2 1.0 1.843 3.031 63 58 A 593 GLU HBx A 593 GLU HG2 1.0 1.843 3.031 64 58 A 593 GLU HG3 A 593 GLU HBx 1.0 1.843 3.031 65 58 A 593 GLU HBy A 593 GLU HG3 1.0 1.843 3.031 66 59 A 593 GLU HA A 593 GLU HBx 1.0 2.069 3.275 67 59 A 593 GLU HBy A 593 GLU HA 1.0 2.069 3.275 68 60 A 593 GLU H A 593 GLU HA 1.0 2.206 3.442 69 61 A 593 GLU H A 593 GLU HG2 1.0 1.823 3.051 70 61 A 593 GLU H A 593 GLU HG3 1.0 1.823 3.051 71 62 A 593 GLU H A 593 GLU HBx 1.0 1.645 2.751 72 62 A 593 GLU H A 593 GLU HBy 1.0 1.645 2.751 73 63 A 593 GLU HA A 594 HIS H 1.0 3.076 4.340 74 64 A 593 GLU H A 594 HIS H 1.0 2.210 3.466 75 65 A 594 HIS HBx A 594 HIS HBy 1.0 1.520 2.714 76 66 A 594 HIS H A 594 HIS HA 1.0 2.328 3.710 77 67 A 594 HIS H A 594 HIS HBx 1.0 2.437 3.667 78 68 A 594 HIS H A 594 HIS HBy 1.0 2.901 4.251 79 69 A 595 VAL H A 594 HIS HBy 1.0 3.703 5.147 80 70 A 594 HIS H A 595 VAL HGy% 1.0 3.530 4.946 81 71 A 595 VAL HGx% A 592 HIS HD2 1.0 3.214 4.736 82 72 A 595 VAL H A 593 GLU HA 1.0 2.862 4.324 83 73 A 594 HIS HBx A 595 VAL HGy% 1.0 3.812 5.260 84 74 A 595 VAL H A 594 HIS HA 1.0 2.538 3.924 85 75 A 595 VAL HGy% A 595 VAL HA 1.0 1.672 2.948 86 76 A 595 VAL HGx% A 595 VAL HA 1.0 1.720 2.990 87 77 A 595 VAL HB A 595 VAL HGy% 1.0 1.364 2.570 88 78 A 595 VAL HB A 595 VAL HA 1.0 2.445 3.837 89 79 A 595 VAL H A 595 VAL HA 1.0 2.154 3.496 90 80 A 595 VAL HB A 595 VAL H 1.0 1.958 3.198 91 81 A 595 VAL H A 595 VAL HGy% 1.0 2.175 3.401 92 82 A 595 VAL HGx% A 596 THR H 1.0 1.669 2.935 93 83 A 595 VAL HGx% A 599 LEU HBy 1.0 1.318 2.526 94 84 A 595 VAL HGx% A 599 LEU HDy% 1.0 1.300 4.000 95 85 A 595 VAL HGy% A 599 LEU HDy% 1.0 1.800 4.500 96 86 A 595 VAL HGy% A 640 TYR HE% 1.0 3.003 4.377 97 87 A 595 VAL HB A 640 TYR HE% 1.0 3.928 5.516 98 88 A 595 VAL HA A 596 THR H 1.0 1.608 2.736 99 89 A 596 THR H A 596 THR HG2% 1.0 1.371 2.523 100 90 A 596 THR HG2% A 597 GLN H 1.0 2.850 4.248 101 91 A 596 THR H A 597 GLN H 1.0 3.595 5.093 102 92 A 596 THR HG2% A 598 ASP HB2 1.0 2.492 3.900 103 92 A 596 THR HG2% A 598 ASP HB3 1.0 2.492 3.900 104 93 A 596 THR HG2% A 598 ASP H 1.0 2.533 3.887 105 94 A 596 THR H A 599 LEU HBx 1.0 1.941 3.155 106 95 A 596 THR H A 599 LEU HBy 1.0 2.328 3.540 107 96 A 597 GLN H A 597 GLN HG2 1.0 3.446 4.828 108 96 A 597 GLN H A 597 GLN HG3 1.0 3.446 4.828 109 97 A 597 GLN H A 597 GLN HBx 1.0 1.912 3.310 110 98 A 597 GLN HA A 597 GLN HG2 1.0 2.413 3.741 111 98 A 597 GLN HG3 A 597 GLN HA 1.0 2.413 3.741 112 99 A 597 GLN HA A 597 GLN HBy 1.0 1.768 2.960 113 100 A 597 GLN HE22 A 597 GLN HG2 1.0 3.108 4.454 114 100 A 597 GLN HG3 A 597 GLN HE22 1.0 3.108 4.454 115 101 A 597 GLN H A 597 GLN HA 1.0 2.154 3.540 116 102 A 597 GLN H A 597 GLN HBy 1.0 1.841 3.001 117 103 A 597 GLN HE22 A 597 GLN HE21 1.0 1.292 1.630 118 104 A 598 ASP H A 597 GLN HG2 1.0 2.777 4.151 119 104 A 598 ASP H A 597 GLN HG3 1.0 2.777 4.151 120 105 A 598 ASP H A 597 GLN HA 1.0 2.818 4.274 121 106 A 598 ASP H A 597 GLN HBx 1.0 2.249 3.655 122 107 A 598 ASP H A 597 GLN HBy 1.0 3.536 4.972 123 108 A 597 GLN H A 599 LEU H 1.0 3.257 4.759 124 109 A 597 GLN H A 598 ASP HB2 1.0 4.579 6.201 125 109 A 597 GLN H A 598 ASP HB3 1.0 4.579 6.201 126 110 A 597 GLN H A 598 ASP H 1.0 1.868 3.126 127 111 A 598 ASP HA A 598 ASP HB2 1.0 2.207 3.367 128 111 A 598 ASP HB3 A 598 ASP HA 1.0 2.207 3.367 129 112 A 598 ASP H A 598 ASP HB2 1.0 1.840 2.976 130 112 A 598 ASP HB3 A 598 ASP H 1.0 1.840 2.976 131 113 A 598 ASP H A 599 LEU H 1.0 1.790 3.070 132 114 A 599 LEU H A 598 ASP HB2 1.0 1.801 3.143 133 114 A 598 ASP HB3 A 599 LEU H 1.0 1.801 3.143 134 115 A 595 VAL HA A 599 LEU HDy% 1.0 2.050 3.440 135 116 A 595 VAL HGx% A 599 LEU H 1.0 3.182 4.562 136 117 A 599 LEU HBy A 599 LEU HA 1.0 2.382 3.612 137 118 A 599 LEU HBx A 599 LEU HA 1.0 2.211 3.539 138 119 A 599 LEU HBy A 599 LEU HBx 1.0 1.107 2.341 139 120 A 599 LEU HBy A 599 LEU HDx% 1.0 2.131 3.449 140 121 A 599 LEU HA A 599 LEU HDx% 1.0 1.595 2.787 141 122 A 599 LEU HDx% A 599 LEU HG 1.0 1.301 2.403 142 123 A 599 LEU H A 599 LEU HDx% 1.0 2.626 3.858 143 124 A 599 LEU HDy% A 599 LEU HBx 1.0 1.454 2.704 144 125 A 599 LEU HDy% A 599 LEU HA 1.0 2.912 4.146 145 126 A 599 LEU HA A 599 LEU HG 1.0 2.369 3.729 146 127 A 599 LEU H A 599 LEU HG 1.0 3.687 5.123 147 128 A 599 LEU H A 599 LEU HA 1.0 2.032 3.368 148 129 A 599 LEU HBx A 599 LEU H 1.0 1.361 2.637 149 130 A 599 LEU HBy A 599 LEU H 1.0 2.162 3.394 150 131 A 599 LEU HDx% A 603 LEU HDy% 1.0 1.800 4.500 151 132 A 599 LEU HDy% A 646 ARG HDx 1.0 2.897 4.273 152 133 A 599 LEU HDy% A 649 TYR HE% 1.0 2.579 3.797 153 134 A 595 VAL HGx% A 600 ARG H 1.0 2.762 4.216 154 135 A 599 LEU HDx% A 600 ARG H 1.0 3.744 5.312 155 136 A 600 ARG H A 600 ARG HB2 1.0 1.983 3.381 156 136 A 600 ARG H A 600 ARG HB3 1.0 1.983 3.381 157 137 A 600 ARG H A 600 ARG HG2 1.0 1.812 3.162 158 137 A 600 ARG H A 600 ARG HG3 1.0 1.812 3.162 159 138 A 601 SER H A 600 ARG HA 1.0 2.783 4.067 160 139 A 601 SER H A 600 ARG HB2 1.0 2.051 3.277 161 139 A 600 ARG HB3 A 601 SER H 1.0 2.051 3.277 162 140 A 601 SER H A 600 ARG HG2 1.0 3.511 4.771 163 140 A 600 ARG HG3 A 601 SER H 1.0 3.511 4.771 164 141 A 600 ARG H A 601 SER H 1.0 2.018 3.348 165 142 A 601 SER H A 601 SER HBy 1.0 2.077 3.225 166 143 A 601 SER HBy A 602 HIS H 1.0 3.514 4.788 167 144 A 602 HIS H A 601 SER HBx 1.0 3.447 4.839 168 145 A 601 SER H A 602 HIS H 1.0 2.035 3.281 169 146 A 602 HIS H A 602 HIS HBx 1.0 2.679 3.881 170 147 A 602 HIS HBx A 602 HIS HA 1.0 2.453 3.847 171 148 A 602 HIS HA A 602 HIS HBy 1.0 2.223 3.465 172 149 A 602 HIS H A 602 HIS HA 1.0 2.036 3.326 173 150 A 602 HIS H A 602 HIS HBy 1.0 1.712 2.854 174 151 A 602 HIS H A 603 LEU H 1.0 1.958 3.178 175 152 A 602 HIS H A 603 LEU HBx 1.0 3.864 5.394 176 153 A 602 HIS HA A 603 LEU H 1.0 2.797 4.165 177 154 A 602 HIS HBy A 603 LEU H 1.0 3.002 4.294 178 155 A 603 LEU HDy% A 603 LEU HA 1.0 1.455 2.613 179 156 A 603 LEU HBx A 603 LEU HA 1.0 2.764 4.136 180 157 A 603 LEU HA A 603 LEU HBy 1.0 2.144 3.452 181 158 A 603 LEU HBx A 603 LEU HG 1.0 2.198 3.620 182 159 A 603 LEU HBy A 603 LEU HDx% 1.0 2.095 3.405 183 160 A 603 LEU HBx A 603 LEU HBy 1.0 1.382 2.758 184 161 A 603 LEU HBy A 603 LEU HG 1.0 2.734 4.156 185 162 A 603 LEU HG A 603 LEU HDx% 1.0 1.259 2.459 186 163 A 603 LEU HBx A 603 LEU HDx% 1.0 1.692 2.978 187 164 A 603 LEU HDy% A 603 LEU HBy 1.0 1.561 2.753 188 165 A 603 LEU HDy% A 603 LEU HBx 1.0 2.405 3.743 189 166 A 603 LEU HDy% A 603 LEU HG 1.0 1.447 2.833 190 167 A 603 LEU H A 603 LEU HA 1.0 1.998 3.288 191 168 A 603 LEU H A 603 LEU HBx 1.0 1.874 3.204 192 169 A 603 LEU H A 603 LEU HG 1.0 1.670 2.930 193 170 A 603 LEU H A 603 LEU HBy 1.0 3.230 4.484 194 171 A 603 LEU H A 603 LEU HDx% 1.0 2.748 4.086 195 172 A 603 LEU HDy% A 603 LEU H 1.0 2.615 3.935 196 173 A 603 LEU HBy A 653 LEU HDx% 1.0 2.227 3.833 197 174 A 603 LEU HA A 604 VAL H 1.0 2.417 3.785 198 175 A 603 LEU HBy A 604 VAL H 1.0 3.246 4.664 199 176 A 604 VAL HGy% A 604 VAL HA 1.0 1.622 2.768 200 177 A 604 VAL HA A 604 VAL HGx% 1.0 1.778 3.030 201 178 A 604 VAL HGx% A 604 VAL HB 1.0 1.269 2.459 202 179 A 604 VAL HA A 604 VAL HB 1.0 2.425 3.669 203 180 A 604 VAL H A 604 VAL HA 1.0 2.212 3.550 204 181 A 604 VAL H A 604 VAL HB 1.0 1.756 2.980 205 182 A 604 VAL H A 604 VAL HGy% 1.0 1.859 3.101 206 183 A 604 VAL H A 604 VAL HGx% 1.0 2.941 4.143 207 184 A 604 VAL HGx% A 605 HIS H 1.0 2.564 3.828 208 185 A 604 VAL HGx% A 605 HIS HA 1.0 2.436 3.830 209 186 A 604 VAL HA A 607 LEU HBy 1.0 2.451 3.729 210 187 A 604 VAL HA A 607 LEU HBx 1.0 2.722 4.152 211 188 A 604 VAL HA A 607 LEU H 1.0 2.731 4.097 212 189 A 604 VAL HGx% A 608 VAL HGy% 1.0 2.500 5.500 213 190 A 604 VAL HGx% A 632 ALA HB% 1.0 1.800 4.500 214 191 A 604 VAL HGx% A 633 LYS HD2 1.0 1.264 2.438 215 191 A 604 VAL HGx% A 633 LYS HD3 1.0 1.264 2.438 216 192 A 604 VAL HGx% A 633 LYS HA 1.0 2.308 3.646 217 193 A 602 HIS HA A 605 HIS HBx 1.0 3.141 4.563 218 194 A 602 HIS HA A 605 HIS H 1.0 3.312 4.690 219 195 A 604 VAL HB A 605 HIS H 1.0 2.035 3.393 220 196 A 604 VAL HGy% A 605 HIS H 1.0 3.244 4.562 221 197 A 604 VAL H A 605 HIS H 1.0 2.160 3.494 222 198 A 605 HIS H A 605 HIS HBy 1.0 3.496 4.724 223 199 A 605 HIS H A 605 HIS HA 1.0 2.338 3.706 224 200 A 605 HIS H A 605 HIS HBx 1.0 1.863 3.031 225 201 A 605 HIS HBy A 606 LYS H 1.0 3.480 4.830 226 202 A 605 HIS H A 606 LYS H 1.0 2.094 3.438 227 203 A 605 HIS HBx A 606 LYS H 1.0 2.010 3.344 228 204 A 606 LYS H A 606 LYS HA 1.0 2.291 3.677 229 205 A 607 LEU HA A 607 LEU HDy% 1.0 2.222 3.510 230 206 A 607 LEU HBy A 607 LEU HBx 1.0 1.209 2.421 231 207 A 607 LEU HBx A 607 LEU HA 1.0 2.724 4.034 232 208 A 607 LEU HBy A 607 LEU HA 1.0 2.225 3.457 233 209 A 607 LEU HBx A 607 LEU HDx% 1.0 1.739 2.981 234 210 A 607 LEU HA A 607 LEU HDx% 1.0 2.766 4.086 235 211 A 607 LEU HBx A 607 LEU HDy% 1.0 1.392 2.560 236 212 A 607 LEU HBx A 607 LEU H 1.0 2.075 3.287 237 213 A 607 LEU HBy A 607 LEU H 1.0 1.697 2.913 238 214 A 607 LEU H A 607 LEU HDy% 1.0 3.171 4.539 239 215 A 607 LEU HDy% A 608 VAL H 1.0 2.516 3.756 240 216 A 607 LEU HDy% A 632 ALA HA 1.0 1.716 3.072 241 217 A 607 LEU HDx% A 632 ALA HA 1.0 1.886 3.176 242 218 A 632 ALA HB% A 607 LEU HDx% 1.0 2.500 5.500 243 219 A 632 ALA HB% A 607 LEU HDy% 1.0 1.800 5.500 244 220 A 607 LEU HDx% A 657 ILE HD1% 1.0 2.500 5.500 245 221 A 607 LEU HDy% A 657 ILE HD1% 1.0 1.800 5.500 246 222 A 605 HIS HA A 608 VAL HGy% 1.0 2.261 3.471 247 223 A 605 HIS HA A 608 VAL HB 1.0 2.210 3.448 248 224 A 605 HIS HA A 608 VAL H 1.0 2.658 4.020 249 225 A 607 LEU HBx A 608 VAL H 1.0 1.863 3.261 250 226 A 608 VAL HA A 608 VAL HGx% 1.0 1.591 2.807 251 227 A 608 VAL HB A 608 VAL HA 1.0 2.454 3.836 252 228 A 608 VAL H A 608 VAL HB 1.0 1.849 3.169 253 229 A 608 VAL H A 608 VAL HA 1.0 2.252 3.472 254 230 A 608 VAL HGy% A 608 VAL H 1.0 1.605 2.841 255 231 A 608 VAL HA A 611 ILE H 1.0 2.708 4.156 256 232 A 608 VAL HGx% A 625 MET HE% 1.0 1.800 4.500 257 233 A 608 VAL HGx% A 628 LEU HDy% 1.0 1.800 4.500 258 234 A 608 VAL HGy% A 628 LEU HDy% 1.0 1.800 5.500 259 235 A 608 VAL HGy% A 629 VAL HGy% 1.0 1.800 4.500 260 236 A 632 ALA HB% A 608 VAL HA 1.0 2.393 3.887 261 237 A 632 ALA HB% A 608 VAL H 1.0 2.214 3.456 262 238 A 608 VAL HGy% A 632 ALA HB% 1.0 1.700 4.000 263 239 A 608 VAL HA A 609 GLN H 1.0 2.706 4.052 264 240 A 608 VAL HB A 609 GLN H 1.0 1.761 3.005 265 241 A 608 VAL HGx% A 609 GLN H 1.0 2.463 3.859 266 242 A 609 GLN HA A 609 GLN HB2 1.0 2.325 3.529 267 242 A 609 GLN HA A 609 GLN HB3 1.0 2.325 3.529 268 243 A 609 GLN HA A 609 GLN HG2 1.0 2.752 4.030 269 243 A 609 GLN HA A 609 GLN HG3 1.0 2.752 4.030 270 244 A 609 GLN HB2 A 609 GLN HG2 1.0 1.795 2.915 271 244 A 609 GLN HB3 A 609 GLN HG2 1.0 1.795 2.915 272 244 A 609 GLN HG3 A 609 GLN HB2 1.0 1.795 2.915 273 244 A 609 GLN HB3 A 609 GLN HG3 1.0 1.795 2.915 274 245 A 609 GLN H A 609 GLN HB2 1.0 1.728 2.914 275 245 A 609 GLN H A 609 GLN HB3 1.0 1.728 2.914 276 246 A 609 GLN H A 609 GLN HA 1.0 2.085 3.311 277 247 A 609 GLN HE22 A 609 GLN HE21 1.0 1.323 1.683 278 248 A 609 GLN HE21 A 609 GLN HG2 1.0 3.883 5.105 279 248 A 609 GLN HG3 A 609 GLN HE21 1.0 3.883 5.105 280 249 A 609 GLN H A 610 ALA H 1.0 2.122 3.438 281 250 A 610 ALA H A 609 GLN HB2 1.0 2.097 3.487 282 250 A 609 GLN HB3 A 610 ALA H 1.0 2.097 3.487 283 251 A 608 VAL HB A 610 ALA H 1.0 3.872 5.316 284 252 A 609 GLN HA A 610 ALA H 1.0 3.021 4.357 285 253 A 610 ALA H A 610 ALA HB% 1.0 1.627 2.839 286 254 A 610 ALA HB% A 610 ALA HA 1.0 1.449 2.539 287 255 A 610 ALA H A 610 ALA HA 1.0 2.175 3.495 288 256 A 657 ILE HD1% A 610 ALA HB% 1.0 1.800 5.500 289 257 A 610 ALA HB% A 657 ILE HG2% 1.0 1.700 4.000 290 258 A 610 ALA HB% A 611 ILE HA 1.0 2.981 4.655 291 259 A 611 ILE H A 610 ALA H 1.0 2.322 3.546 292 260 A 611 ILE H A 610 ALA HA 1.0 2.856 4.280 293 261 A 611 ILE H A 610 ALA HB% 1.0 2.122 3.408 294 262 A 611 ILE HB A 611 ILE HG1x 1.0 2.936 4.420 295 263 A 611 ILE HA A 611 ILE HG1x 1.0 3.072 4.444 296 264 A 611 ILE HA A 611 ILE HB 1.0 2.427 3.815 297 265 A 611 ILE HG1x A 611 ILE HD1% 1.0 1.535 2.741 298 266 A 611 ILE HA A 611 ILE HD1% 1.0 3.071 4.403 299 267 A 611 ILE H A 611 ILE HD1% 1.0 3.217 4.531 300 268 A 611 ILE HA A 611 ILE HG2% 1.0 2.416 3.696 301 269 A 611 ILE HG1x A 611 ILE HG2% 1.0 1.793 3.177 302 270 A 611 ILE HB A 611 ILE HG2% 1.0 1.380 2.568 303 271 A 611 ILE H A 611 ILE HA 1.0 2.585 3.921 304 272 A 611 ILE H A 611 ILE HB 1.0 2.050 3.422 305 273 A 611 ILE H A 611 ILE HG2% 1.0 3.186 4.484 306 274 A 611 ILE HA A 612 PHE H 1.0 2.908 4.290 307 275 A 611 ILE HB A 612 PHE H 1.0 2.956 4.178 308 276 A 611 ILE HD1% A 628 LEU HDx% 1.0 1.530 2.874 309 277 A 611 ILE HG2% A 628 LEU HDx% 1.0 1.800 5.500 310 278 A 628 LEU HDy% A 611 ILE HG2% 1.0 1.800 5.500 311 279 A 611 ILE HG2% A 660 ILE HG2% 1.0 1.800 5.500 312 280 A 609 GLN HA A 612 PHE H 1.0 2.682 4.130 313 281 A 611 ILE HG2% A 612 PHE HBx 1.0 2.837 4.047 314 282 A 611 ILE H A 612 PHE H 1.0 2.058 3.372 315 283 A 612 PHE H A 611 ILE HG1y 1.0 3.710 5.176 316 284 A 612 PHE H A 612 PHE HA 1.0 2.653 4.029 317 285 A 612 PHE H A 612 PHE HBx 1.0 2.594 3.974 318 286 A 625 MET HE% A 612 PHE HBx 1.0 2.495 4.193 319 287 A 625 MET HE% A 612 PHE HBy 1.0 3.062 4.806 320 288 A 612 PHE HE% B 853 VAL HA 1.0 3.767 5.315 321 289 A 612 PHE HA A 613 PRO HDy 1.0 2.117 3.337 322 290 A 612 PHE H A 613 PRO HDy 1.0 4.236 6.004 323 291 A 613 PRO HDx A 613 PRO HBy 1.0 3.017 4.461 324 292 A 613 PRO HDy A 613 PRO HBy 1.0 3.917 5.355 325 293 A 613 PRO HDy A 613 PRO HDx 1.0 1.436 2.674 326 294 A 613 PRO HBx A 613 PRO HA 1.0 2.476 3.866 327 295 A 613 PRO HBy A 613 PRO HBx 1.0 1.290 2.430 328 296 A 613 PRO HBy A 613 PRO HA 1.0 2.033 3.423 329 297 A 613 PRO HDy A 613 PRO HA 1.0 4.199 5.803 330 298 A 613 PRO HBy A 614 THR H 1.0 3.858 5.246 331 299 A 614 THR HG2% A 612 PHE HD% 1.0 4.181 5.803 332 300 A 612 PHE HE% A 614 THR HG2% 1.0 4.242 5.902 333 301 A 614 THR H A 612 PHE HD% 1.0 3.821 5.255 334 302 A 614 THR HG2% A 613 PRO HGx 1.0 1.981 3.277 335 302 A 614 THR HG2% A 613 PRO HGy 1.0 1.981 3.277 336 303 A 613 PRO HBy A 614 THR HG2% 1.0 3.762 5.112 337 304 A 614 THR HG2% A 614 THR HB 1.0 1.540 2.688 338 305 A 614 THR HG2% A 614 THR HA 1.0 1.712 2.932 339 306 A 614 THR H A 614 THR HG2% 1.0 2.051 3.385 340 307 A 614 THR H A 614 THR HA 1.0 1.933 3.201 341 308 A 614 THR H A 614 THR HB 1.0 3.496 4.884 342 309 A 614 THR H A 615 PRO HDx 1.0 4.616 6.024 343 310 A 614 THR H A 615 PRO HDy 1.0 3.386 4.770 344 311 A 615 PRO HGy A 615 PRO HBy 1.0 2.072 3.390 345 312 A 615 PRO HBy A 615 PRO HBx 1.0 1.485 2.703 346 313 A 615 PRO HDy A 615 PRO HGx 1.0 2.285 3.535 347 314 A 615 PRO HGy A 615 PRO HGx 1.0 1.482 2.706 348 315 A 615 PRO HDy A 615 PRO HA 1.0 3.923 5.589 349 316 A 615 PRO HBy A 615 PRO HGx 1.0 2.869 4.187 350 317 A 615 PRO HBx A 616 ASP H 1.0 4.149 5.485 351 318 A 615 PRO HA A 616 ASP H 1.0 1.919 3.091 352 319 A 616 ASP HBx A 616 ASP HA 1.0 2.380 3.666 353 320 A 616 ASP HA A 616 ASP HBy 1.0 2.647 3.853 354 321 A 616 ASP H A 616 ASP HBy 1.0 2.376 3.580 355 322 A 616 ASP H A 616 ASP HA 1.0 2.605 3.891 356 323 A 616 ASP HBx A 617 PRO HDy 1.0 3.146 4.358 357 324 A 616 ASP HBy A 617 PRO HDx 1.0 4.981 6.551 358 325 A 616 ASP HBy A 617 PRO HDy 1.0 3.914 5.434 359 326 A 616 ASP H A 617 PRO HDy 1.0 4.611 6.181 360 327 A 616 ASP HBx A 617 PRO HDx 1.0 4.700 6.148 361 328 A 617 PRO HBy A 617 PRO HGy 1.0 1.761 2.895 362 328 A 617 PRO HBx A 617 PRO HGy 1.0 1.761 2.895 363 328 A 617 PRO HGx A 617 PRO HBx 1.0 1.761 2.895 364 328 A 617 PRO HBy A 617 PRO HGx 1.0 1.761 2.895 365 329 A 617 PRO HA A 617 PRO HBx 1.0 2.659 3.987 366 329 A 617 PRO HBy A 617 PRO HA 1.0 2.659 3.987 367 330 A 617 PRO HDx A 617 PRO HGy 1.0 2.828 4.162 368 330 A 617 PRO HDx A 617 PRO HGx 1.0 2.828 4.162 369 331 A 618 ALA H A 617 PRO HBx 1.0 2.835 4.167 370 331 A 617 PRO HBy A 618 ALA H 1.0 2.835 4.167 371 332 A 618 ALA HB% A 617 PRO HBx 1.0 3.163 4.541 372 332 A 617 PRO HBy A 618 ALA HB% 1.0 3.163 4.541 373 333 A 617 PRO HDy A 618 ALA H 1.0 2.701 3.987 374 334 A 618 ALA HB% A 618 ALA HA 1.0 1.457 2.525 375 335 A 618 ALA H A 618 ALA HB% 1.0 1.511 2.603 376 336 A 618 ALA HB% A 620 LEU H 1.0 3.407 5.003 377 337 A 618 ALA HA A 619 ALA H 1.0 2.511 3.907 378 338 A 619 ALA H A 619 ALA HA 1.0 1.924 3.280 379 339 A 619 ALA H A 619 ALA HB% 1.0 1.434 2.518 380 340 A 620 LEU H A 619 ALA HB% 1.0 1.864 3.152 381 341 A 619 ALA H A 620 LEU HBx 1.0 3.593 4.921 382 342 A 620 LEU H A 619 ALA H 1.0 1.824 3.042 383 343 A 619 ALA HB% A 620 LEU HDx% 1.0 1.800 5.500 384 344 A 616 ASP H A 620 LEU HDy% 1.0 2.946 4.364 385 345 A 620 LEU H A 619 ALA HA 1.0 2.557 3.917 386 346 A 620 LEU H A 620 LEU HDx% 1.0 3.669 4.933 387 347 A 620 LEU HDx% A 620 LEU HA 1.0 1.714 2.918 388 348 A 620 LEU H A 620 LEU HDy% 1.0 2.866 4.068 389 349 A 620 LEU HA A 620 LEU HBy 1.0 2.713 4.039 390 350 A 620 LEU HBx A 620 LEU HBy 1.0 1.347 2.603 391 351 A 620 LEU HDx% A 620 LEU HBy 1.0 2.050 3.352 392 352 A 620 LEU HBx A 620 LEU HDy% 1.0 1.665 2.853 393 353 A 620 LEU HDy% A 620 LEU HA 1.0 1.550 2.670 394 354 A 620 LEU H A 620 LEU HBx 1.0 1.668 2.930 395 355 A 620 LEU H A 620 LEU HA 1.0 2.280 3.614 396 356 A 620 LEU HDx% A 620 LEU HG 1.0 1.800 4.500 397 357 A 620 LEU HDy% A 620 LEU HG 1.0 1.800 4.500 398 358 A 620 LEU HDx% A 621 LYS H 1.0 3.507 5.033 399 359 A 620 LEU HDy% A 621 LYS H 1.0 3.795 5.217 400 360 A 620 LEU H A 621 LYS H 1.0 2.125 3.517 401 361 A 625 MET HE% A 620 LEU HDx% 1.0 1.800 5.500 402 362 A 625 MET HE% A 620 LEU HDy% 1.0 1.700 4.000 403 363 A 619 ALA H A 621 LYS H 1.0 3.107 4.451 404 364 A 620 LEU HA A 621 LYS H 1.0 2.731 3.965 405 365 A 620 LEU HBy A 621 LYS H 1.0 2.056 3.284 406 366 A 621 LYS H A 621 LYS HG2 1.0 2.313 3.597 407 366 A 621 LYS H A 621 LYS HG3 1.0 2.313 3.597 408 367 A 621 LYS HBx A 621 LYS HA 1.0 2.132 3.470 409 368 A 621 LYS HA A 621 LYS HBy 1.0 2.919 4.127 410 369 A 621 LYS HA A 621 LYS HG2 1.0 2.729 4.081 411 369 A 621 LYS HG3 A 621 LYS HA 1.0 2.729 4.081 412 370 A 621 LYS HBy A 621 LYS HG2 1.0 1.977 3.295 413 370 A 621 LYS HG3 A 621 LYS HBy 1.0 1.977 3.295 414 371 A 621 LYS H A 621 LYS HA 1.0 2.281 3.555 415 372 A 621 LYS H A 621 LYS HBy 1.0 1.781 2.981 416 373 A 621 LYS H A 621 LYS HBx 1.0 3.140 4.500 417 374 A 621 LYS H A 622 ASP HBx 1.0 4.093 5.573 418 375 A 621 LYS H A 622 ASP HBy 1.0 3.964 5.430 419 376 A 619 ALA HB% A 622 ASP HBy 1.0 3.276 4.498 420 377 A 620 LEU HA A 622 ASP H 1.0 3.165 4.717 421 378 A 621 LYS HBy A 622 ASP H 1.0 3.095 4.429 422 379 A 621 LYS H A 622 ASP H 1.0 1.874 3.076 423 380 A 622 ASP HBy A 622 ASP H 1.0 1.842 3.070 424 381 A 622 ASP H A 622 ASP HA 1.0 2.333 3.633 425 382 A 622 ASP HBx A 622 ASP H 1.0 2.432 3.656 426 383 A 622 ASP HBy A 623 ARG H 1.0 4.068 5.544 427 384 A 622 ASP HBy A 624 ARG H 1.0 3.372 4.984 428 385 A 622 ASP HBy A 625 MET H 1.0 2.858 4.508 429 386 A 622 ASP H A 625 MET H 1.0 3.476 4.826 430 387 A 622 ASP HA A 623 ARG H 1.0 1.739 2.901 431 388 A 622 ASP H A 623 ARG H 1.0 3.934 5.358 432 389 A 623 ARG HA A 623 ARG HBx 1.0 2.385 3.625 433 389 A 623 ARG HBy A 623 ARG HA 1.0 2.385 3.625 434 390 A 623 ARG H A 623 ARG HA 1.0 2.173 3.521 435 391 A 623 ARG H A 623 ARG HBx 1.0 2.002 3.194 436 391 A 623 ARG H A 623 ARG HBy 1.0 2.002 3.194 437 392 A 623 ARG H A 623 ARG HGy 1.0 2.001 3.393 438 393 A 623 ARG H A 623 ARG HGx 1.0 3.136 4.420 439 394 A 624 ARG H A 623 ARG HGx 1.0 4.911 6.529 440 395 A 624 ARG H A 623 ARG HGy 1.0 4.398 6.032 441 396 A 623 ARG H A 624 ARG H 1.0 2.391 3.631 442 397 A 622 ASP HA A 624 ARG H 1.0 3.722 5.240 443 398 A 624 ARG H A 623 ARG HBx 1.0 2.462 3.824 444 398 A 624 ARG H A 623 ARG HBy 1.0 2.462 3.824 445 399 A 624 ARG H A 623 ARG HA 1.0 3.033 4.569 446 400 A 624 ARG H A 624 ARG HDx 1.0 4.467 5.881 447 400 A 624 ARG H A 624 ARG HDy 1.0 4.467 5.881 448 401 A 624 ARG HA A 627 ASN HD21 1.0 3.530 5.266 449 402 A 624 ARG HA A 627 ASN HBx 1.0 3.937 5.305 450 402 A 624 ARG HA A 627 ASN HBy 1.0 3.937 5.305 451 403 A 624 ARG HA A 627 ASN H 1.0 2.672 3.984 452 404 A 624 ARG H A 625 MET H 1.0 2.240 3.620 453 405 A 625 MET H A 624 ARG HA 1.0 3.369 4.971 454 406 A 625 MET HE% A 625 MET HA 1.0 2.901 4.219 455 407 A 625 MET HE% A 625 MET H 1.0 4.264 5.688 456 408 A 625 MET HE% A 625 MET HBy 1.0 1.738 3.006 457 409 A 625 MET HBy A 625 MET HGx 1.0 2.953 4.313 458 409 A 625 MET HBy A 625 MET HGy 1.0 2.953 4.313 459 410 A 625 MET H A 625 MET HA 1.0 2.538 3.788 460 411 A 625 MET H A 625 MET HBx 1.0 1.950 3.178 461 412 A 625 MET HBy A 626 GLU H 1.0 3.364 4.922 462 413 A 625 MET H A 626 GLU H 1.0 1.966 3.202 463 414 A 626 GLU H A 626 GLU HA 1.0 2.230 3.506 464 415 A 627 ASN H A 626 GLU HBx 1.0 1.834 3.028 465 415 A 627 ASN H A 626 GLU HBy 1.0 1.834 3.028 466 416 A 624 ARG HA A 627 ASN HD22 1.0 3.812 5.454 467 417 A 627 ASN HA A 627 ASN HBx 1.0 2.250 3.556 468 417 A 627 ASN HBy A 627 ASN HA 1.0 2.250 3.556 469 418 A 627 ASN H A 627 ASN HA 1.0 2.400 3.716 470 419 A 627 ASN H A 627 ASN HBx 1.0 2.866 4.082 471 419 A 627 ASN HBy A 627 ASN H 1.0 2.866 4.082 472 420 A 627 ASN HD21 A 627 ASN HD22 1.0 1.432 1.830 473 421 A 627 ASN HD22 A 627 ASN HBx 1.0 3.881 5.123 474 421 A 627 ASN HBy A 627 ASN HD22 1.0 3.881 5.123 475 422 A 628 LEU H A 627 ASN HBx 1.0 3.201 4.423 476 422 A 627 ASN HBy A 628 LEU H 1.0 3.201 4.423 477 423 A 627 ASN H A 629 VAL H 1.0 2.910 4.244 478 424 A 630 ALA HB% A 627 ASN HBx 1.0 3.102 4.470 479 424 A 627 ASN HBy A 630 ALA HB% 1.0 3.102 4.470 480 425 A 608 VAL HA A 628 LEU HDx% 1.0 1.990 3.354 481 426 A 628 LEU HDy% A 612 PHE HD% 1.0 2.881 4.091 482 427 A 628 LEU HDy% A 625 MET HA 1.0 2.100 3.360 483 428 A 625 MET HA A 628 LEU HBx 1.0 4.178 5.780 484 429 A 625 MET HA A 628 LEU HBy 1.0 2.522 3.992 485 430 A 625 MET HE% A 628 LEU HDx% 1.0 1.800 5.500 486 431 A 625 MET HE% A 628 LEU HDy% 1.0 1.300 4.000 487 432 A 627 ASN HA A 628 LEU H 1.0 2.997 4.291 488 433 A 627 ASN H A 628 LEU H 1.0 1.833 3.029 489 434 A 628 LEU HDx% A 628 LEU HA 1.0 2.575 3.899 490 435 A 628 LEU HBx A 628 LEU HBy 1.0 1.410 2.734 491 436 A 628 LEU HBy A 628 LEU HA 1.0 2.658 3.874 492 437 A 628 LEU HBx A 628 LEU HG 1.0 2.323 3.529 493 438 A 628 LEU H A 628 LEU HG 1.0 2.691 4.069 494 439 A 628 LEU H A 628 LEU HA 1.0 2.744 4.060 495 440 A 628 LEU H A 628 LEU HBx 1.0 3.210 4.576 496 441 A 628 LEU H A 628 LEU HBy 1.0 1.885 3.197 497 442 A 628 LEU HDx% A 628 LEU H 1.0 3.517 4.819 498 443 A 629 VAL H A 628 LEU HG 1.0 1.861 3.203 499 444 A 628 LEU H A 629 VAL H 1.0 1.966 3.314 500 445 A 629 VAL H A 628 LEU HBx 1.0 3.341 4.593 501 446 A 628 LEU H A 629 VAL HB 1.0 3.933 5.511 502 447 A 628 LEU HDy% A 629 VAL HGy% 1.0 1.800 5.500 503 448 A 628 LEU H B 849 ILE HG2% 1.0 3.471 4.915 504 449 A 628 LEU HDy% B 852 PHE HE% 1.0 3.549 4.937 505 450 A 608 VAL HGx% A 629 VAL HGy% 1.0 1.800 5.500 506 451 A 625 MET HE% A 629 VAL HGy% 1.0 1.800 5.500 507 452 A 629 VAL HGy% A 626 GLU HA 1.0 1.814 3.158 508 453 A 626 GLU HA A 629 VAL H 1.0 2.425 3.709 509 454 A 629 VAL H A 628 LEU HBy 1.0 2.953 4.209 510 455 A 629 VAL H A 628 LEU HA 1.0 2.901 4.249 511 456 A 629 VAL HB A 629 VAL HA 1.0 2.507 3.919 512 457 A 629 VAL HA A 629 VAL HGx% 1.0 1.523 2.687 513 458 A 629 VAL HGy% A 629 VAL H 1.0 1.467 2.635 514 459 A 629 VAL HGy% A 629 VAL HA 1.0 1.644 2.840 515 460 A 629 VAL HGy% A 629 VAL HB 1.0 1.465 2.781 516 461 A 629 VAL HB A 629 VAL HGx% 1.0 1.367 2.641 517 462 A 629 VAL H A 629 VAL HA 1.0 2.273 3.533 518 463 A 629 VAL H A 629 VAL HB 1.0 1.771 3.053 519 464 A 629 VAL H A 629 VAL HGx% 1.0 2.761 4.015 520 465 A 632 ALA HB% A 629 VAL HA 1.0 2.005 3.249 521 466 A 629 VAL HGx% A 633 LYS HEy 1.0 1.580 2.822 522 467 A 627 ASN HA A 630 ALA H 1.0 2.515 3.783 523 468 A 629 VAL HA A 630 ALA H 1.0 2.935 4.395 524 469 A 629 VAL HB A 630 ALA H 1.0 1.907 3.211 525 470 A 629 VAL HGy% A 630 ALA H 1.0 3.259 4.623 526 471 A 629 VAL HGx% A 630 ALA H 1.0 2.871 4.167 527 472 A 630 ALA HB% A 630 ALA HA 1.0 1.728 2.930 528 473 A 630 ALA H A 630 ALA HA 1.0 1.907 3.155 529 474 A 630 ALA HB% A 630 ALA H 1.0 1.486 2.608 530 475 A 630 ALA HA A 633 LYS HBy 1.0 2.420 3.958 531 476 A 630 ALA HB% A 633 LYS H 1.0 3.635 5.223 532 477 A 607 LEU HDy% A 631 TYR HD% 1.0 2.841 4.095 533 478 A 631 TYR H A 631 TYR HBy 1.0 2.138 3.340 534 478 A 631 TYR HBx A 631 TYR H 1.0 2.138 3.340 535 479 A 632 ALA HA A 631 TYR HD% 1.0 3.814 5.456 536 480 A 631 TYR HD% B 849 ILE HG1x 1.0 3.344 4.904 537 481 A 632 ALA H A 631 TYR HBy 1.0 3.402 4.756 538 481 A 631 TYR HBx A 632 ALA H 1.0 3.402 4.756 539 482 A 632 ALA H A 631 TYR HA 1.0 2.860 4.060 540 483 A 632 ALA HB% A 632 ALA HA 1.0 1.501 2.739 541 484 A 632 ALA HA A 632 ALA H 1.0 2.153 3.535 542 485 A 632 ALA HB% A 632 ALA H 1.0 1.601 2.805 543 486 A 632 ALA HB% A 633 LYS H 1.0 1.925 3.139 544 487 A 632 ALA HA A 633 LYS H 1.0 2.770 4.338 545 488 A 632 ALA HA A 635 VAL HB 1.0 2.147 3.451 546 489 A 632 ALA HA A 635 VAL H 1.0 2.797 4.181 547 490 A 604 VAL HGy% A 633 LYS HA 1.0 2.134 3.482 548 491 A 604 VAL HGx% A 633 LYS H 1.0 2.771 4.153 549 492 A 604 VAL HGy% A 633 LYS H 1.0 3.133 4.525 550 493 A 633 LYS HBy A 632 ALA H 1.0 3.476 4.788 551 494 A 633 LYS H A 632 ALA H 1.0 2.238 3.506 552 495 A 633 LYS HA A 633 LYS HBy 1.0 2.273 3.587 553 496 A 633 LYS HD3 A 633 LYS HG2 1.0 2.101 3.339 554 496 A 633 LYS HD2 A 633 LYS HG2 1.0 2.101 3.339 555 496 A 633 LYS HG3 A 633 LYS HD2 1.0 2.101 3.339 556 496 A 633 LYS HD3 A 633 LYS HG3 1.0 2.101 3.339 557 497 A 633 LYS HEx A 633 LYS HG2 1.0 3.406 4.902 558 497 A 633 LYS HG3 A 633 LYS HEx 1.0 3.406 4.902 559 498 A 633 LYS HA A 633 LYS HG2 1.0 3.490 4.824 560 498 A 633 LYS HA A 633 LYS HG3 1.0 3.490 4.824 561 499 A 633 LYS H A 633 LYS HG2 1.0 3.233 4.869 562 499 A 633 LYS H A 633 LYS HG3 1.0 3.233 4.869 563 500 A 633 LYS HA A 633 LYS HD2 1.0 1.830 3.166 564 500 A 633 LYS HD3 A 633 LYS HA 1.0 1.830 3.166 565 501 A 633 LYS HEx A 633 LYS HD2 1.0 1.647 2.899 566 501 A 633 LYS HD3 A 633 LYS HEx 1.0 1.647 2.899 567 502 A 633 LYS HA A 633 LYS H 1.0 2.096 3.394 568 503 A 633 LYS HBy A 633 LYS H 1.0 1.455 2.653 569 504 A 633 LYS H A 633 LYS HD2 1.0 1.874 3.114 570 504 A 633 LYS HD3 A 633 LYS H 1.0 1.874 3.114 571 505 A 633 LYS HA A 636 GLU H 1.0 2.646 3.944 572 506 A 631 TYR HA A 634 LYS H 1.0 2.823 4.157 573 507 A 633 LYS H A 634 LYS H 1.0 2.030 3.354 574 508 A 634 LYS H A 633 LYS HBx 1.0 2.070 3.298 575 509 A 634 LYS H A 634 LYS HA 1.0 2.138 3.376 576 510 A 635 VAL H A 634 LYS H 1.0 2.053 3.329 577 511 A 607 LEU HDx% A 635 VAL HGx% 1.0 1.800 5.000 578 512 A 607 LEU HDx% A 635 VAL HGy% 1.0 1.800 5.500 579 513 A 631 TYR HD% A 635 VAL HGy% 1.0 3.359 4.991 580 514 A 635 VAL HGy% A 631 TYR HE% 1.0 2.945 4.285 581 515 A 635 VAL HGx% A 631 TYR HE% 1.0 4.127 5.781 582 516 A 634 LYS H A 635 VAL HGy% 1.0 4.047 5.593 583 517 A 635 VAL H A 634 LYS HA 1.0 2.984 4.284 584 518 A 635 VAL H A 635 VAL HGy% 1.0 2.144 3.338 585 519 A 635 VAL HGy% A 635 VAL HA 1.0 1.585 2.731 586 520 A 635 VAL HGx% A 635 VAL HA 1.0 1.923 3.169 587 521 A 635 VAL HGx% A 635 VAL HGy% 1.0 1.136 2.352 588 522 A 635 VAL HB A 635 VAL HGy% 1.0 1.450 2.846 589 523 A 635 VAL HB A 635 VAL HA 1.0 2.222 3.610 590 524 A 635 VAL H A 635 VAL HA 1.0 2.226 3.574 591 525 A 635 VAL HB A 635 VAL H 1.0 1.597 2.821 592 526 A 635 VAL H A 635 VAL HGx% 1.0 2.879 4.089 593 527 A 635 VAL HB A 636 GLU H 1.0 2.028 3.374 594 528 A 636 GLU H A 635 VAL HGx% 1.0 1.902 3.244 595 529 A 636 GLU H A 635 VAL HGy% 1.0 3.179 4.579 596 530 A 635 VAL HGx% A 637 GLY H 1.0 3.836 5.440 597 531 A 635 VAL HA A 638 ASP HBx 1.0 2.617 3.945 598 532 A 635 VAL HA A 638 ASP HBy 1.0 3.630 5.146 599 533 A 635 VAL HA A 638 ASP H 1.0 2.787 4.123 600 534 A 635 VAL HGx% A 639 MET HGy 1.0 1.708 3.010 601 535 A 635 VAL HGx% A 639 MET H 1.0 3.498 5.132 602 536 A 635 VAL HGx% A 639 MET HE% 1.0 1.700 4.000 603 537 A 635 VAL HGy% A 639 MET HE% 1.0 1.800 3.222 604 538 A 604 VAL HGy% A 636 GLU HA 1.0 3.942 5.482 605 539 A 604 VAL HGy% A 636 GLU H 1.0 3.354 4.700 606 540 A 635 VAL H A 636 GLU H 1.0 2.062 3.398 607 541 A 636 GLU H A 635 VAL HA 1.0 2.734 4.070 608 542 A 636 GLU HA A 636 GLU HGx 1.0 3.330 4.600 609 542 A 636 GLU HA A 636 GLU HGy 1.0 3.330 4.600 610 543 A 636 GLU H A 636 GLU HA 1.0 2.331 3.689 611 544 A 636 GLU HA A 639 MET HBx 1.0 2.343 3.675 612 545 A 639 MET H A 636 GLU HA 1.0 3.140 4.590 613 546 A 637 GLY H A 636 GLU HBx 1.0 3.802 5.276 614 546 A 637 GLY H A 636 GLU HBy 1.0 3.802 5.276 615 547 A 637 GLY H A 637 GLY HAx 1.0 2.447 3.697 616 548 A 637 GLY H A 637 GLY HAy 1.0 2.104 3.468 617 549 A 638 ASP H A 637 GLY HAx 1.0 3.226 4.432 618 550 A 638 ASP H A 637 GLY HAy 1.0 2.301 3.691 619 551 A 638 ASP H A 638 ASP HA 1.0 2.530 3.866 620 552 A 638 ASP HBx A 638 ASP H 1.0 2.198 3.472 621 553 A 638 ASP HBx A 639 MET HE% 1.0 2.947 4.573 622 554 A 638 ASP H A 640 TYR H 1.0 3.521 5.065 623 555 A 635 VAL HGx% A 639 MET HGx 1.0 2.079 3.471 624 556 A 639 MET HGy A 639 MET HE% 1.0 2.231 3.821 625 557 A 639 MET HGx A 639 MET HBy 1.0 2.357 3.769 626 558 A 639 MET HGy A 639 MET HGx 1.0 1.204 2.428 627 559 A 639 MET HGx A 639 MET HA 1.0 3.803 5.289 628 560 A 639 MET HE% A 639 MET HGx 1.0 1.471 2.715 629 561 A 639 MET H A 639 MET HA 1.0 2.558 3.862 630 562 A 639 MET HGy A 639 MET H 1.0 1.627 2.991 631 563 A 639 MET H A 639 MET HBx 1.0 2.471 3.785 632 564 A 639 MET H A 639 MET HBy 1.0 3.503 4.815 633 565 A 639 MET H A 640 TYR H 1.0 2.250 3.492 634 566 A 639 MET HE% A 653 LEU HA 1.0 1.715 2.973 635 567 A 639 MET HGx A 653 LEU HG 1.0 2.033 3.689 636 568 A 639 MET HE% A 656 LYS H 1.0 3.100 4.436 637 569 A 637 GLY HAx A 640 TYR H 1.0 2.962 4.408 638 570 A 639 MET HBx A 640 TYR H 1.0 2.375 3.759 639 571 A 640 TYR H A 639 MET HBy 1.0 3.630 5.048 640 572 A 640 TYR HE% A 640 TYR HBy 1.0 4.198 5.782 641 573 A 640 TYR H A 640 TYR HA 1.0 2.469 3.697 642 574 A 640 TYR H A 640 TYR HBx 1.0 2.186 3.556 643 575 A 649 TYR HE% A 640 TYR H 1.0 4.138 5.728 644 576 A 641 GLU H A 640 TYR HD% 1.0 4.415 5.987 645 577 A 640 TYR H A 641 GLU H 1.0 2.455 3.675 646 578 A 640 TYR HBx A 641 GLU H 1.0 3.691 5.037 647 579 A 641 GLU HGy A 641 GLU HA 1.0 3.098 4.414 648 580 A 641 GLU HGx A 641 GLU HBx 1.0 2.553 3.769 649 581 A 641 GLU HGy A 641 GLU HBx 1.0 2.265 3.581 650 582 A 641 GLU HGy A 641 GLU HBy 1.0 2.316 3.594 651 583 A 641 GLU H A 641 GLU HBx 1.0 3.441 4.777 652 584 A 641 GLU H A 641 GLU HBy 1.0 1.906 3.056 653 585 A 641 GLU H A 641 GLU HA 1.0 2.415 3.705 654 586 A 641 GLU H A 641 GLU HGy 1.0 3.562 4.882 655 587 A 641 GLU HBy A 642 SER H 1.0 2.002 3.392 656 588 A 642 SER H A 642 SER HB2 1.0 1.916 3.152 657 588 A 642 SER H A 642 SER HB3 1.0 1.916 3.152 658 589 A 642 SER H A 642 SER HA 1.0 2.132 3.334 659 590 A 642 SER H A 643 ALA HB% 1.0 3.767 5.349 660 591 A 640 TYR H A 643 ALA HB% 1.0 3.684 5.346 661 592 A 642 SER HA A 643 ALA H 1.0 2.637 3.985 662 593 A 643 ALA H A 642 SER HB2 1.0 1.930 3.304 663 593 A 642 SER HB3 A 643 ALA H 1.0 1.930 3.304 664 594 A 643 ALA HB% A 643 ALA HA 1.0 1.365 2.547 665 595 A 643 ALA HB% A 643 ALA H 1.0 1.572 2.734 666 596 A 643 ALA H A 643 ALA HA 1.0 2.001 3.357 667 597 A 643 ALA H A 644 ASN H 1.0 2.572 3.928 668 598 A 643 ALA HB% A 644 ASN H 1.0 2.535 3.739 669 599 A 643 ALA HB% A 649 TYR H 1.0 3.184 4.408 670 600 A 643 ALA HB% A 652 LEU HDx% 1.0 1.800 5.000 671 601 A 643 ALA HA A 644 ASN HBy 1.0 4.369 5.947 672 602 A 644 ASN HBy A 644 ASN HA 1.0 2.613 3.923 673 603 A 644 ASN HBy A 644 ASN HD22 1.0 3.611 4.857 674 604 A 644 ASN HBy A 644 ASN HBx 1.0 1.370 2.428 675 605 A 644 ASN HD22 A 644 ASN HBx 1.0 4.046 5.360 676 606 A 644 ASN HD22 A 644 ASN HD21 1.0 1.266 2.322 677 607 A 644 ASN HBy A 644 ASN HD21 1.0 2.648 3.970 678 608 A 644 ASN H A 644 ASN HA 1.0 2.626 3.930 679 609 A 644 ASN H A 648 GLU HB2 1.0 3.006 4.316 680 609 A 644 ASN H A 648 GLU HB3 1.0 3.006 4.316 681 610 A 643 ALA HA A 645 SER H 1.0 2.398 3.682 682 611 A 644 ASN HBx A 645 SER H 1.0 3.386 4.774 683 612 A 644 ASN H A 645 SER H 1.0 2.113 3.379 684 613 A 644 ASN HA A 645 SER H 1.0 2.596 3.928 685 614 A 644 ASN HBy A 645 SER H 1.0 4.030 5.448 686 615 A 645 SER HA A 645 SER HB2 1.0 2.042 3.300 687 615 A 645 SER HA A 645 SER HB3 1.0 2.042 3.300 688 616 A 645 SER H A 645 SER HB2 1.0 3.435 4.689 689 616 A 645 SER H A 645 SER HB3 1.0 3.435 4.689 690 617 A 645 SER H A 645 SER HA 1.0 2.608 3.874 691 618 A 645 SER HA A 646 ARG HA 1.0 3.964 5.372 692 619 A 646 ARG H A 645 SER HB2 1.0 2.358 3.620 693 619 A 645 SER HB3 A 646 ARG H 1.0 2.358 3.620 694 620 A 645 SER HA A 646 ARG H 1.0 1.958 3.234 695 621 A 645 SER HA A 647 ASP H 1.0 3.986 5.458 696 622 A 595 VAL HGy% A 646 ARG HDx 1.0 2.639 4.063 697 623 A 595 VAL HGy% A 646 ARG HDy 1.0 2.709 4.193 698 624 A 645 SER H A 646 ARG HA 1.0 3.688 5.296 699 625 A 645 SER H A 646 ARG H 1.0 3.900 5.498 700 626 A 646 ARG HA A 646 ARG HGy 1.0 3.531 4.749 701 626 A 646 ARG HA A 646 ARG HGx 1.0 3.531 4.749 702 627 A 646 ARG HA A 646 ARG HBx 1.0 1.938 3.152 703 628 A 646 ARG H A 646 ARG HBx 1.0 3.260 4.668 704 629 A 646 ARG HDx A 646 ARG HGy 1.0 2.535 3.887 705 629 A 646 ARG HDx A 646 ARG HGx 1.0 2.535 3.887 706 630 A 646 ARG HDy A 646 ARG HGy 1.0 1.865 3.135 707 630 A 646 ARG HDy A 646 ARG HGx 1.0 1.865 3.135 708 631 A 646 ARG HA A 646 ARG H 1.0 2.298 3.684 709 632 A 646 ARG H A 646 ARG HBy 1.0 1.846 3.118 710 633 A 646 ARG HA A 647 ASP H 1.0 2.935 4.257 711 634 A 646 ARG HA A 649 TYR HBx 1.0 2.976 4.542 712 635 A 646 ARG HA A 649 TYR HBy 1.0 2.994 4.644 713 636 A 646 ARG HDx A 649 TYR HD% 1.0 4.078 5.504 714 637 A 646 ARG HDy A 649 TYR HD% 1.0 5.013 6.427 715 638 A 649 TYR H A 646 ARG HA 1.0 2.619 3.953 716 639 A 646 ARG H A 647 ASP HB2 1.0 4.597 6.245 717 639 A 646 ARG H A 647 ASP HB3 1.0 4.597 6.245 718 640 A 646 ARG H A 647 ASP H 1.0 2.164 3.442 719 641 A 647 ASP H A 646 ARG HGy 1.0 4.158 5.468 720 641 A 647 ASP H A 646 ARG HGx 1.0 4.158 5.468 721 642 A 647 ASP HA A 647 ASP HB2 1.0 2.757 3.997 722 642 A 647 ASP HB3 A 647 ASP HA 1.0 2.757 3.997 723 643 A 647 ASP H A 647 ASP HA 1.0 2.421 3.709 724 644 A 647 ASP H A 647 ASP HB2 1.0 2.030 3.178 725 644 A 647 ASP H A 647 ASP HB3 1.0 2.030 3.178 726 645 A 648 GLU HA A 647 ASP HB2 1.0 3.410 4.842 727 645 A 647 ASP HB3 A 648 GLU HA 1.0 3.410 4.842 728 646 A 648 GLU H A 647 ASP HB2 1.0 2.079 3.399 729 646 A 647 ASP HB3 A 648 GLU H 1.0 2.079 3.399 730 647 A 645 SER H A 648 GLU HB2 1.0 2.121 3.377 731 647 A 648 GLU HB3 A 645 SER H 1.0 2.121 3.377 732 648 A 645 SER H A 648 GLU H 1.0 4.074 5.614 733 649 A 647 ASP HA A 648 GLU H 1.0 3.177 4.539 734 650 A 647 ASP H A 648 GLU H 1.0 2.071 3.333 735 651 A 648 GLU H A 648 GLU HB2 1.0 1.972 3.148 736 651 A 648 GLU HB3 A 648 GLU H 1.0 1.972 3.148 737 652 A 648 GLU HGx A 648 GLU HB2 1.0 2.145 3.531 738 652 A 648 GLU HB3 A 648 GLU HGx 1.0 2.145 3.531 739 653 A 648 GLU H A 648 GLU HGx 1.0 4.386 6.002 740 654 A 648 GLU HA A 648 GLU HB2 1.0 2.243 3.413 741 654 A 648 GLU HB3 A 648 GLU HA 1.0 2.243 3.413 742 655 A 648 GLU HGy A 648 GLU HB2 1.0 1.824 3.176 743 655 A 648 GLU HB3 A 648 GLU HGy 1.0 1.824 3.176 744 656 A 648 GLU HA A 648 GLU H 1.0 2.314 3.656 745 657 A 649 TYR H A 648 GLU HB2 1.0 2.065 3.295 746 657 A 649 TYR H A 648 GLU HB3 1.0 2.065 3.295 747 658 A 652 LEU HDx% A 648 GLU HGy 1.0 2.520 3.854 748 659 A 640 TYR HA A 649 TYR HD% 1.0 3.818 5.388 749 660 A 643 ALA HB% A 649 TYR HA 1.0 2.550 3.820 750 661 A 643 ALA HB% A 649 TYR HBx 1.0 2.926 4.258 751 662 A 643 ALA HB% A 649 TYR HBy 1.0 1.785 3.099 752 663 A 649 TYR H A 647 ASP HA 1.0 3.386 4.864 753 664 A 648 GLU HGy A 649 TYR HA 1.0 3.827 5.543 754 665 A 649 TYR H A 648 GLU H 1.0 2.196 3.572 755 666 A 649 TYR HE% A 649 TYR HBx 1.0 4.077 5.719 756 667 A 649 TYR H A 649 TYR HA 1.0 2.270 3.628 757 668 A 649 TYR H A 649 TYR HBx 1.0 2.494 3.860 758 669 A 649 TYR H A 649 TYR HBy 1.0 2.121 3.331 759 670 A 649 TYR H A 650 TYR H 1.0 2.225 3.595 760 671 A 649 TYR HBx A 650 TYR H 1.0 2.006 3.316 761 672 A 649 TYR HA A 652 LEU HBx 1.0 4.186 5.926 762 673 A 603 LEU HDy% A 650 TYR HA 1.0 2.679 4.391 763 674 A 603 LEU HDy% A 650 TYR HD% 1.0 3.118 4.622 764 675 A 647 ASP HA A 650 TYR H 1.0 3.149 4.431 765 676 A 649 TYR HD% A 650 TYR H 1.0 4.022 5.384 766 677 A 650 TYR H A 650 TYR HA 1.0 2.443 3.755 767 678 A 650 TYR H A 650 TYR HBy 1.0 2.200 3.432 768 679 A 650 TYR HBy A 651 HIS H 1.0 3.432 5.062 769 680 A 651 HIS H A 650 TYR HBx 1.0 2.145 3.425 770 681 A 648 GLU HA A 651 HIS HBx 1.0 2.390 3.758 771 681 A 648 GLU HA A 651 HIS HBy 1.0 2.390 3.758 772 682 A 649 TYR H A 651 HIS H 1.0 3.764 5.502 773 683 A 650 TYR H A 651 HIS H 1.0 2.236 3.608 774 684 A 650 TYR HA A 651 HIS H 1.0 2.573 3.833 775 685 A 651 HIS HA A 651 HIS HBx 1.0 2.690 3.990 776 685 A 651 HIS HBy A 651 HIS HA 1.0 2.690 3.990 777 686 A 651 HIS H A 651 HIS HBx 1.0 1.891 3.055 778 686 A 651 HIS H A 651 HIS HBy 1.0 1.891 3.055 779 687 A 651 HIS H A 651 HIS HA 1.0 2.342 3.620 780 688 A 651 HIS H A 652 LEU H 1.0 2.118 3.464 781 689 A 652 LEU H A 651 HIS HBx 1.0 2.030 3.396 782 689 A 651 HIS HBy A 652 LEU H 1.0 2.030 3.396 783 690 A 639 MET HA A 652 LEU HDx% 1.0 2.389 3.725 784 691 A 643 ALA HA A 652 LEU HDx% 1.0 2.539 3.911 785 692 A 643 ALA H A 652 LEU HDx% 1.0 2.697 4.129 786 693 A 648 GLU HGx A 652 LEU HDy% 1.0 2.473 3.713 787 694 A 650 TYR H A 652 LEU H 1.0 3.689 5.385 788 695 A 651 HIS HA A 652 LEU H 1.0 3.120 4.536 789 696 A 652 LEU HDx% A 652 LEU H 1.0 2.901 4.205 790 697 A 652 LEU H A 652 LEU HDy% 1.0 3.046 4.284 791 698 A 652 LEU HBx A 652 LEU HDy% 1.0 1.846 3.050 792 699 A 652 LEU HG A 652 LEU HA 1.0 2.451 3.685 793 700 A 652 LEU HBx A 652 LEU HG 1.0 2.104 3.366 794 701 A 652 LEU HDy% A 652 LEU HG 1.0 1.294 2.516 795 702 A 652 LEU HDy% A 652 LEU HA 1.0 1.723 2.853 796 703 A 652 LEU HDx% A 652 LEU HG 1.0 1.299 2.513 797 704 A 652 LEU HDx% A 652 LEU HBx 1.0 1.765 2.937 798 705 A 652 LEU H A 652 LEU HA 1.0 2.167 3.473 799 706 A 652 LEU H A 652 LEU HBy 1.0 2.013 3.225 800 707 A 652 LEU H A 652 LEU HG 1.0 1.745 2.975 801 708 A 652 LEU HDx% A 653 LEU H 1.0 3.651 5.171 802 709 A 652 LEU HDy% A 653 LEU H 1.0 4.063 5.517 803 710 A 652 LEU H A 653 LEU H 1.0 2.138 3.518 804 711 A 603 LEU HDx% A 653 LEU HDx% 1.0 0.918 2.188 805 712 A 603 LEU HBx A 653 LEU HDx% 1.0 2.422 3.704 806 713 A 603 LEU HBx A 653 LEU HDy% 1.0 2.427 3.825 807 714 A 639 MET HGx A 653 LEU HDy% 1.0 2.332 3.602 808 715 A 639 MET HE% A 653 LEU HDy% 1.0 1.800 5.500 809 716 A 652 LEU HBx A 653 LEU H 1.0 2.874 4.210 810 717 A 653 LEU HA A 653 LEU HG 1.0 1.659 2.903 811 718 A 653 LEU HDx% A 653 LEU HA 1.0 3.323 4.725 812 719 A 653 LEU HA A 653 LEU HBx 1.0 2.327 3.635 813 720 A 653 LEU HA A 653 LEU HBy 1.0 2.204 3.418 814 721 A 653 LEU HBx A 653 LEU HBy 1.0 1.301 2.557 815 722 A 653 LEU HDx% A 653 LEU HBx 1.0 1.837 3.159 816 723 A 653 LEU HDx% A 653 LEU HG 1.0 1.235 2.471 817 724 A 653 LEU HDx% A 653 LEU HBy 1.0 2.198 3.552 818 725 A 653 LEU HDx% A 653 LEU H 1.0 2.711 4.171 819 726 A 653 LEU HDx% A 653 LEU HDy% 1.0 1.505 2.727 820 727 A 653 LEU HG A 653 LEU HDy% 1.0 1.219 2.431 821 728 A 653 LEU HA A 653 LEU HDy% 1.0 1.959 3.135 822 729 A 653 LEU H A 653 LEU HDy% 1.0 3.528 4.888 823 730 A 653 LEU HDy% A 653 LEU HBy 1.0 1.567 2.895 824 731 A 653 LEU HA A 653 LEU H 1.0 2.219 3.601 825 732 A 653 LEU H A 653 LEU HBx 1.0 1.672 2.908 826 733 A 653 LEU H A 653 LEU HBy 1.0 3.284 4.504 827 734 A 653 LEU HBx A 654 ALA H 1.0 2.413 3.769 828 735 A 653 LEU HDx% A 654 ALA H 1.0 3.636 5.090 829 736 A 653 LEU HBy A 654 ALA H 1.0 3.258 4.762 830 737 A 653 LEU H A 654 ALA H 1.0 2.096 3.398 831 738 A 651 HIS HA A 654 ALA HB% 1.0 1.847 3.095 832 739 A 654 ALA HB% A 654 ALA HA 1.0 1.491 2.627 833 740 A 654 ALA H A 654 ALA HA 1.0 2.165 3.477 834 741 A 654 ALA HB% A 655 GLU H 1.0 1.805 3.087 835 742 A 656 LYS H A 654 ALA HB% 1.0 3.411 4.913 836 743 A 654 ALA HA A 657 ILE HB 1.0 2.345 3.659 837 744 A 654 ALA H A 655 GLU H 1.0 2.659 4.125 838 745 A 654 ALA HA A 655 GLU H 1.0 2.726 4.006 839 746 A 655 GLU H A 655 GLU HGy 1.0 4.226 5.528 840 747 A 655 GLU HBy A 655 GLU HA 1.0 2.516 3.706 841 748 A 655 GLU H A 655 GLU HBx 1.0 2.821 4.185 842 749 A 655 GLU H A 655 GLU HA 1.0 2.352 3.632 843 750 A 655 GLU H A 655 GLU HGx 1.0 3.738 4.962 844 751 A 655 GLU H A 655 GLU HBy 1.0 1.630 2.746 845 752 A 656 LYS H A 655 GLU H 1.0 2.170 3.512 846 753 A 655 GLU HGy A 659 LYS HEx 1.0 2.659 4.185 847 753 A 655 GLU HGy A 659 LYS HEy 1.0 2.659 4.185 848 754 A 653 LEU HA A 656 LYS H 1.0 2.838 4.302 849 755 A 656 LYS H A 655 GLU HBy 1.0 1.845 2.991 850 756 A 656 LYS H A 656 LYS HA 1.0 2.132 3.508 851 757 A 610 ALA HB% A 657 ILE HA 1.0 2.587 4.195 852 758 A 610 ALA H A 657 ILE HG2% 1.0 2.865 4.621 853 759 A 657 ILE HD1% A 654 ALA HA 1.0 2.094 3.456 854 760 A 654 ALA HA A 657 ILE H 1.0 2.829 4.253 855 761 A 654 ALA HB% A 657 ILE H 1.0 3.405 4.957 856 762 A 656 LYS H A 657 ILE H 1.0 2.412 3.796 857 763 A 657 ILE HG2% A 657 ILE HA 1.0 1.770 3.018 858 764 A 657 ILE HD1% A 657 ILE HB 1.0 1.588 2.758 859 765 A 657 ILE HD1% A 657 ILE HA 1.0 3.404 4.740 860 766 A 657 ILE HD1% A 657 ILE H 1.0 3.190 4.454 861 767 A 657 ILE HG2% A 657 ILE HB 1.0 1.320 2.488 862 768 A 657 ILE HB A 657 ILE HA 1.0 2.928 4.534 863 769 A 657 ILE HA A 657 ILE H 1.0 2.597 3.969 864 770 A 657 ILE HB A 657 ILE H 1.0 1.810 3.056 865 771 A 657 ILE HG2% A 657 ILE H 1.0 2.761 4.055 866 772 A 657 ILE HD1% A 657 ILE HG2% 1.0 1.800 4.500 867 773 A 657 ILE HG2% A 658 TYR HA 1.0 2.704 4.166 868 774 A 657 ILE HG2% A 658 TYR H 1.0 2.655 3.903 869 775 A 657 ILE HA A 660 ILE HB 1.0 2.359 3.781 870 776 A 657 ILE HA A 660 ILE H 1.0 3.074 4.686 871 777 A 657 ILE HG2% A 661 GLN HGy 1.0 2.167 3.455 872 778 A 657 ILE HG2% A 661 GLN HGx 1.0 2.910 4.224 873 779 A 657 ILE HG2% A 661 GLN HE22 1.0 3.028 4.578 874 780 A 657 ILE HG2% A 661 GLN HE21 1.0 2.575 4.071 875 781 A 657 ILE HG2% A 661 GLN H 1.0 3.161 4.781 876 782 A 657 ILE HA A 661 GLN H 1.0 3.774 5.434 877 783 A 657 ILE HB A 658 TYR H 1.0 1.761 2.953 878 784 A 658 TYR H A 658 TYR HBy 1.0 2.238 3.456 879 785 A 658 TYR HE% A 658 TYR HBx 1.0 3.946 5.370 880 786 A 658 TYR H A 658 TYR HBx 1.0 2.594 3.866 881 787 A 658 TYR HBx A 659 LYS H 1.0 2.454 3.828 882 788 A 658 TYR HBy A 659 LYS H 1.0 3.407 4.749 883 789 A 659 LYS HA A 659 LYS HDx 1.0 1.621 2.883 884 790 A 659 LYS HA A 659 LYS HDy 1.0 2.542 3.828 885 791 A 659 LYS H A 659 LYS HDy 1.0 4.181 5.505 886 792 A 659 LYS H A 659 LYS HA 1.0 2.398 3.638 887 793 A 660 ILE H A 659 LYS HDy 1.0 5.144 6.766 888 794 A 660 ILE H A 659 LYS HA 1.0 3.118 4.678 889 795 A 659 LYS HA A 662 LYS H 1.0 2.752 4.142 890 796 A 659 LYS HA B 844 ILE HG2% 1.0 4.141 5.683 891 797 A 607 LEU HDx% A 660 ILE HD1% 1.0 3.300 5.100 892 798 A 607 LEU HDy% A 660 ILE HD1% 1.0 2.600 4.400 893 799 A 660 ILE HG2% A 657 ILE HA 1.0 3.129 4.557 894 800 A 660 ILE H A 659 LYS H 1.0 2.083 3.463 895 801 A 660 ILE HB A 660 ILE HA 1.0 2.351 3.723 896 802 A 660 ILE HB A 660 ILE HD1% 1.0 1.620 2.740 897 803 A 660 ILE HG2% A 660 ILE H 1.0 2.863 4.299 898 804 A 660 ILE H A 660 ILE HD1% 1.0 3.344 4.668 899 805 A 660 ILE HG2% A 660 ILE HB 1.0 1.256 2.418 900 806 A 660 ILE HG2% A 660 ILE HA 1.0 1.963 3.275 901 807 A 660 ILE H A 660 ILE HA 1.0 2.638 4.018 902 808 A 660 ILE HB A 660 ILE H 1.0 1.661 2.871 903 809 A 660 ILE HG2% A 660 ILE HD1% 1.0 1.800 4.500 904 810 A 660 ILE HG2% A 661 GLN HA 1.0 2.253 3.531 905 811 A 660 ILE HG2% A 661 GLN H 1.0 2.360 3.572 906 812 A 661 GLN H A 660 ILE HA 1.0 3.253 4.943 907 813 A 660 ILE HA A 663 GLU HBy 1.0 2.346 3.630 908 814 A 660 ILE HA A 663 GLU H 1.0 3.006 4.506 909 815 A 660 ILE HG2% A 664 LEU HDx% 1.0 1.800 5.500 910 816 A 660 ILE HG2% A 661 GLN HGy 1.0 2.672 3.984 911 817 A 661 GLN H A 661 GLN HBx 1.0 2.439 3.821 912 818 A 661 GLN HGx A 661 GLN HBy 1.0 2.388 3.614 913 819 A 661 GLN HGy A 661 GLN HGx 1.0 1.338 2.514 914 820 A 661 GLN HBx A 661 GLN HBy 1.0 1.427 2.709 915 821 A 661 GLN HGy A 661 GLN H 1.0 2.394 3.782 916 822 A 661 GLN HE22 A 661 GLN HE21 1.0 1.277 2.339 917 823 A 661 GLN H A 661 GLN HA 1.0 2.535 3.799 918 824 A 661 GLN HGx A 661 GLN H 1.0 3.355 4.649 919 825 A 661 GLN H A 661 GLN HBy 1.0 3.096 4.416 920 826 A 661 GLN HGx A 661 GLN HE22 1.0 3.237 4.783 921 827 A 662 LYS H A 661 GLN HBy 1.0 3.353 4.783 922 828 A 662 LYS H A 661 GLN HBx 1.0 2.073 3.369 923 829 A 661 GLN HA A 664 LEU H 1.0 2.979 4.523 924 830 A 661 GLN H A 662 LYS H 1.0 1.983 3.269 925 831 A 662 LYS H A 662 LYS HA 1.0 1.922 3.072 926 832 A 663 GLU HBy A 663 GLU H 1.0 1.670 2.786 927 833 A 663 GLU HBy A 663 GLU HA 1.0 2.262 3.382 928 834 A 663 GLU HA A 663 GLU HBx 1.0 1.849 2.963 929 835 A 663 GLU HA A 663 GLU HGx 1.0 2.472 3.690 930 835 A 663 GLU HA A 663 GLU HGy 1.0 2.472 3.690 931 836 A 663 GLU H A 663 GLU HGx 1.0 2.085 3.471 932 836 A 663 GLU H A 663 GLU HGy 1.0 2.085 3.471 933 837 A 663 GLU H A 663 GLU HA 1.0 2.148 3.370 934 838 A 663 GLU H A 664 LEU H 1.0 1.884 3.114 935 839 A 664 LEU H A 663 GLU HGx 1.0 3.952 5.354 936 839 A 664 LEU H A 663 GLU HGy 1.0 3.952 5.354 937 840 A 611 ILE HA A 664 LEU HDx% 1.0 2.962 4.242 938 841 A 663 GLU HBy A 664 LEU H 1.0 2.060 3.346 939 842 A 664 LEU HDy% A 664 LEU HA 1.0 1.491 2.695 940 843 A 664 LEU HA A 664 LEU HBx 1.0 2.482 3.764 941 844 A 664 LEU HBx A 664 LEU HG 1.0 2.172 3.540 942 845 A 664 LEU HBx A 664 LEU HBy 1.0 1.420 2.754 943 846 A 664 LEU HDy% A 664 LEU HBx 1.0 2.752 4.034 944 847 A 664 LEU HA A 664 LEU HBy 1.0 1.935 3.221 945 848 A 664 LEU HDy% A 664 LEU HG 1.0 1.228 2.408 946 849 A 664 LEU HDy% A 664 LEU HBy 1.0 1.773 3.109 947 850 A 664 LEU HDx% A 664 LEU HG 1.0 1.364 2.662 948 851 A 664 LEU HDx% A 664 LEU HBy 1.0 1.900 3.252 949 852 A 664 LEU HDx% A 664 LEU HBx 1.0 1.693 2.937 950 853 A 664 LEU H A 664 LEU HA 1.0 1.954 3.274 951 854 A 664 LEU H A 664 LEU HG 1.0 1.685 3.067 952 855 A 664 LEU H A 664 LEU HBy 1.0 3.294 4.580 953 856 A 664 LEU H A 664 LEU HBx 1.0 1.946 3.264 954 857 A 664 LEU H A 664 LEU HDy% 1.0 2.747 3.963 955 858 A 664 LEU HDx% A 664 LEU H 1.0 3.112 4.382 956 859 A 664 LEU HBx A 665 GLU H 1.0 2.309 3.663 957 860 A 664 LEU HDx% A 665 GLU H 1.0 3.800 5.278 958 861 A 664 LEU HBy A 665 GLU H 1.0 3.439 4.863 959 862 A 664 LEU H A 665 GLU H 1.0 1.937 3.209 960 863 A 665 GLU H A 665 GLU HA 1.0 2.017 3.129 961 864 A 667 LYS HE3 A 667 LYS HG2 1.0 3.066 4.358 962 864 A 667 LYS HE2 A 667 LYS HG2 1.0 3.066 4.358 963 864 A 667 LYS HG3 A 667 LYS HE2 1.0 3.066 4.358 964 864 A 667 LYS HG3 A 667 LYS HE3 1.0 3.066 4.358 965 865 A 667 LYS HA A 667 LYS HG2 1.0 3.390 4.712 966 865 A 667 LYS HG3 A 667 LYS HA 1.0 3.390 4.712 967 866 A 667 LYS H A 667 LYS HG2 1.0 1.664 3.020 968 866 A 667 LYS HG3 A 667 LYS H 1.0 1.664 3.020 969 867 A 667 LYS HA A 667 LYS H 1.0 2.244 3.550 970 868 A 667 LYS HA A 668 ARG H 1.0 2.948 4.188 971 869 A 668 ARG H A 668 ARG HA 1.0 1.721 2.943 972 870 A 668 ARG H A 669 ARG H 1.0 1.975 3.233 973 871 A 668 ARG HA A 669 ARG H 1.0 1.919 3.179 974 872 A 669 ARG H A 669 ARG HA 1.0 2.060 3.298 975 873 A 669 ARG HA A 670 SER H 1.0 2.486 3.774 976 874 A 670 SER H A 669 ARG HB2 1.0 1.766 3.032 977 874 A 670 SER H A 669 ARG HB3 1.0 1.766 3.032 978 875 A 670 SER HA A 670 SER HB2 1.0 2.663 3.889 979 875 A 670 SER HB3 A 670 SER HA 1.0 2.663 3.889 980 876 A 670 SER H A 670 SER HA 1.0 2.257 3.489 981 877 A 670 SER H A 670 SER HB2 1.0 1.858 3.018 982 877 A 670 SER H A 670 SER HB3 1.0 1.858 3.018 983 878 A 671 ARG H A 670 SER HB2 1.0 2.940 4.214 984 878 A 670 SER HB3 A 671 ARG H 1.0 2.940 4.214 985 879 A 671 ARG H A 671 ARG HA 1.0 1.844 3.020 986 880 A 671 ARG HA A 672 LEU H 1.0 1.732 2.908 987 881 A 672 LEU HDx% A 672 LEU HA 1.0 3.075 4.301 988 882 A 672 LEU HA A 672 LEU HBx 1.0 2.413 3.615 989 883 A 672 LEU H A 672 LEU HBy 1.0 2.249 3.507 990 884 A 672 LEU H A 672 LEU HBx 1.0 3.109 4.359 991 885 A 672 LEU HA A 672 LEU HDy% 1.0 1.732 2.928 992 886 A 672 LEU H A 672 LEU HA 1.0 2.152 3.508 993 887 B 840 ASP HBy B 840 ASP H1 1.0 3.605 4.963 994 888 B 840 ASP HBx B 840 ASP HA 1.0 2.935 4.233 995 889 B 840 ASP H1 B 840 ASP HA 1.0 1.985 3.133 996 890 B 840 ASP H1 B 840 ASP HBx 1.0 2.255 3.473 997 891 B 841 ALA HB% B 841 ALA H 1.0 1.662 2.786 998 892 B 841 ALA HB% B 842 GLY H 1.0 2.819 4.097 999 893 B 842 GLY H B 842 GLY HA2 1.0 1.548 2.570 1000 893 B 842 GLY H B 842 GLY HA3 1.0 1.548 2.570 1001 894 B 843 ASN H B 842 GLY HA2 1.0 1.495 2.539 1002 894 B 842 GLY HA3 B 843 ASN H 1.0 1.495 2.539 1003 895 B 843 ASN HBy B 843 ASN HBx 1.0 1.297 2.383 1004 896 B 843 ASN HBx B 843 ASN HA 1.0 2.276 3.476 1005 897 B 843 ASN HBy B 843 ASN HA 1.0 2.841 4.077 1006 898 B 843 ASN H B 843 ASN HBx 1.0 2.914 4.152 1007 899 B 843 ASN H B 843 ASN HBy 1.0 1.683 2.819 1008 900 B 843 ASN HBy B 843 ASN HD22 1.0 2.864 4.256 1009 901 B 843 ASN HD22 B 843 ASN HD21 1.0 1.369 1.701 1010 902 B 843 ASN HBx B 843 ASN HD21 1.0 3.540 4.834 1011 903 B 843 ASN HBy B 843 ASN HD21 1.0 3.221 4.617 1012 904 B 843 ASN H B 844 ILE H 1.0 2.299 3.673 1013 905 B 844 ILE HD1% A 659 LYS HEx 1.0 3.454 4.966 1014 905 A 659 LYS HEy B 844 ILE HD1% 1.0 3.454 4.966 1015 906 A 659 LYS HDy B 844 ILE HD1% 1.0 2.206 3.572 1016 907 B 843 ASN HA B 844 ILE H 1.0 2.407 3.791 1017 908 B 844 ILE HD1% B 844 ILE HB 1.0 1.763 2.939 1018 909 B 844 ILE HG2% B 844 ILE HG1x 1.0 1.676 2.894 1019 910 B 844 ILE HG2% B 844 ILE HB 1.0 1.476 2.586 1020 911 B 844 ILE HG2% B 844 ILE HA 1.0 1.682 2.908 1021 912 B 844 ILE HB B 844 ILE HA 1.0 2.515 3.903 1022 913 B 844 ILE HD1% B 844 ILE HG1y 1.0 1.714 3.020 1023 914 B 844 ILE HG1x B 844 ILE HG1y 1.0 1.189 2.387 1024 915 B 844 ILE HB B 844 ILE HG1x 1.0 2.588 3.884 1025 916 B 844 ILE HB B 844 ILE HG1y 1.0 2.228 3.590 1026 917 B 844 ILE HG1x B 844 ILE HA 1.0 2.439 3.951 1027 918 B 844 ILE HA B 844 ILE HG1y 1.0 2.965 4.467 1028 919 B 844 ILE H B 844 ILE HA 1.0 2.591 4.119 1029 920 B 844 ILE H B 844 ILE HB 1.0 2.727 4.135 1030 921 B 844 ILE H B 844 ILE HD1% 1.0 3.702 5.122 1031 922 A 631 TYR HD% B 845 LEU HD1% 1.0 3.807 5.467 1032 922 A 631 TYR HD% B 845 LEU HD2% 1.0 3.807 5.467 1033 923 A 631 TYR HE% B 845 LEU HD1% 1.0 3.677 4.997 1034 923 A 631 TYR HE% B 845 LEU HD2% 1.0 3.677 4.997 1035 924 A 660 ILE HB B 845 LEU HD1% 1.0 1.721 3.065 1036 924 A 660 ILE HB B 845 LEU HD2% 1.0 1.721 3.065 1037 925 B 844 ILE HA B 845 LEU H 1.0 2.129 3.435 1038 926 B 845 LEU HG B 845 LEU HB2 1.0 2.465 3.719 1039 926 B 845 LEU HB3 B 845 LEU HG 1.0 2.465 3.719 1040 927 B 845 LEU HG B 845 LEU HD1% 1.0 1.810 3.116 1041 927 B 845 LEU HD2% B 845 LEU HG 1.0 1.810 3.116 1042 928 B 845 LEU HA B 845 LEU HD1% 1.0 2.762 4.006 1043 928 B 845 LEU HD2% B 845 LEU HA 1.0 2.762 4.006 1044 929 B 845 LEU H B 845 LEU HA 1.0 2.351 3.705 1045 930 B 845 LEU H B 845 LEU HB2 1.0 1.793 3.137 1046 930 B 845 LEU H B 845 LEU HB3 1.0 1.793 3.137 1047 931 B 845 LEU H B 845 LEU HG 1.0 2.486 3.860 1048 932 B 845 LEU H B 845 LEU HD1% 1.0 1.702 3.090 1049 932 B 845 LEU HD2% B 845 LEU H 1.0 1.702 3.090 1050 933 B 847 SER H B 847 SER HA 1.0 1.930 3.060 1051 934 B 848 ASP HBy B 848 ASP H 1.0 1.996 3.246 1052 935 B 848 ASP H B 848 ASP HBx 1.0 2.419 3.691 1053 936 B 848 ASP H B 850 MET H 1.0 3.078 4.526 1054 937 A 628 LEU H B 849 ILE HD1% 1.0 3.760 5.572 1055 938 A 631 TYR HE% B 849 ILE HD1% 1.0 4.188 5.794 1056 939 A 631 TYR HD% B 849 ILE HD1% 1.0 3.637 5.133 1057 940 B 849 ILE HG2% A 631 TYR HE% 1.0 4.111 5.781 1058 941 B 849 ILE HG2% A 631 TYR HD% 1.0 3.587 5.077 1059 942 B 848 ASP H B 849 ILE H 1.0 2.028 3.332 1060 943 B 848 ASP HBy B 849 ILE H 1.0 3.489 4.797 1061 944 B 849 ILE H B 848 ASP HA 1.0 2.842 4.140 1062 945 B 849 ILE HG1x B 849 ILE HD1% 1.0 1.876 3.220 1063 946 B 849 ILE HD1% B 849 ILE HG1y 1.0 1.803 3.089 1064 947 B 849 ILE HG2% B 849 ILE HD1% 1.0 1.709 3.105 1065 948 B 849 ILE HG2% B 849 ILE HB 1.0 2.037 3.603 1066 949 B 849 ILE HD1% B 849 ILE HB 1.0 3.140 4.910 1067 950 B 849 ILE HG2% B 849 ILE HA 1.0 1.941 3.287 1068 951 B 849 ILE HG2% B 849 ILE H 1.0 3.025 4.265 1069 952 B 849 ILE H B 849 ILE HG1y 1.0 1.387 2.773 1070 953 B 849 ILE H B 849 ILE HB 1.0 2.020 3.322 1071 954 B 849 ILE H B 849 ILE HA 1.0 2.271 3.483 1072 955 B 850 MET H B 849 ILE H 1.0 1.845 3.187 1073 956 B 849 ILE HG2% B 850 MET H 1.0 2.845 4.113 1074 957 B 850 MET H B 849 ILE HB 1.0 2.124 3.382 1075 958 B 850 MET HE% B 850 MET HA 1.0 1.591 2.803 1076 959 B 850 MET H B 850 MET HE% 1.0 2.468 3.674 1077 960 B 850 MET HA B 850 MET HBy 1.0 2.383 3.777 1078 961 B 850 MET H B 850 MET HA 1.0 2.180 3.532 1079 962 B 850 MET H B 850 MET HBx 1.0 2.078 3.426 1080 963 B 850 MET H B 850 MET HBy 1.0 3.330 4.554 1081 964 B 850 MET HBx B 851 ASP H 1.0 2.284 3.538 1082 965 B 850 MET HBy B 851 ASP H 1.0 3.214 4.456 1083 966 B 851 ASP H B 850 MET HG2 1.0 3.661 5.029 1084 966 B 851 ASP H B 850 MET HG3 1.0 3.661 5.029 1085 967 B 850 MET H B 851 ASP H 1.0 2.378 3.658 1086 968 B 851 ASP HBy B 851 ASP HA 1.0 2.992 4.272 1087 969 B 851 ASP HA B 851 ASP HBx 1.0 2.336 3.712 1088 970 B 851 ASP H B 851 ASP HBy 1.0 1.868 3.066 1089 971 B 851 ASP H B 851 ASP HA 1.0 2.257 3.539 1090 972 B 851 ASP H B 851 ASP HBx 1.0 3.187 4.449 1091 973 B 851 ASP HBx B 852 PHE H 1.0 3.014 4.214 1092 974 B 851 ASP HBy B 852 PHE H 1.0 2.616 3.946 1093 975 B 851 ASP H B 852 PHE H 1.0 2.520 3.732 1094 976 B 849 ILE HA B 852 PHE H 1.0 2.708 4.060 1095 977 B 852 PHE H B 852 PHE HB2 1.0 2.135 3.345 1096 977 B 852 PHE H B 852 PHE HB3 1.0 2.135 3.345 1097 978 B 852 PHE H B 852 PHE HA 1.0 2.301 3.623 1098 979 B 852 PHE H B 853 VAL HGx% 1.0 3.324 4.756 1099 980 B 852 PHE H B 853 VAL H 1.0 2.305 3.691 1100 981 B 853 VAL H B 852 PHE HB2 1.0 2.292 3.604 1101 981 B 852 PHE HB3 B 853 VAL H 1.0 2.292 3.604 1102 982 A 611 ILE HA B 853 VAL HGx% 1.0 3.051 4.777 1103 983 A 611 ILE HA B 853 VAL HGy% 1.0 3.125 4.969 1104 984 A 612 PHE HA B 853 VAL HGx% 1.0 3.524 5.174 1105 985 A 612 PHE HBy B 853 VAL HGy% 1.0 3.681 5.357 1106 986 A 612 PHE HA B 853 VAL HGy% 1.0 2.956 4.770 1107 987 B 852 PHE HA B 853 VAL HGx% 1.0 4.160 5.858 1108 988 B 852 PHE HA B 853 VAL H 1.0 3.259 4.823 1109 989 B 853 VAL HGy% B 853 VAL HB 1.0 1.958 3.316 1110 990 B 853 VAL HGx% B 853 VAL HB 1.0 1.819 3.037 1111 991 B 853 VAL H B 853 VAL HB 1.0 2.327 3.579 1112 992 B 853 VAL H B 853 VAL HGy% 1.0 2.995 4.375 1113 993 B 853 VAL H B 854 LEU H 1.0 2.357 3.745 1114 994 B 853 VAL HGy% B 854 LEU H 1.0 2.466 3.948 1115 995 B 851 ASP HA B 854 LEU H 1.0 3.142 4.564 1116 996 B 853 VAL H B 854 LEU HDy% 1.0 3.293 4.891 1117 997 B 854 LEU H B 854 LEU HDx% 1.0 3.679 5.167 1118 998 B 854 LEU HDy% B 854 LEU HA 1.0 1.739 2.887 1119 999 B 854 LEU HDx% B 854 LEU HA 1.0 2.005 3.341 1120 1000 B 854 LEU HDy% B 854 LEU HG 1.0 1.513 2.765 1121 1001 B 854 LEU HDx% B 854 LEU HG 1.0 1.533 2.783 1122 1002 B 854 LEU H B 854 LEU HA 1.0 2.507 3.787 1123 1003 B 854 LEU H B 854 LEU HG 1.0 3.162 4.436 1124 1004 B 854 LEU H B 854 LEU HDy% 1.0 1.830 3.084 1125 1005 B 854 LEU HDy% B 855 LYS H 1.0 3.970 5.682 1126 1006 B 854 LEU H B 855 LYS H 1.0 2.291 3.499 1127 1007 B 854 LEU HA B 855 LYS H 1.0 3.077 4.547 1128 1008 B 855 LYS HA B 855 LYS HGy 1.0 2.893 4.307 1129 1008 B 855 LYS HGx B 855 LYS HA 1.0 2.893 4.307 1130 1009 B 855 LYS H B 855 LYS HA 1.0 2.210 3.488 1131 1010 B 855 LYS H B 856 ASN H 1.0 2.295 3.645 1132 1011 B 855 LYS HA B 856 ASN H 1.0 2.737 4.089 1133 1012 B 856 ASN H B 855 LYS HBy 1.0 3.490 4.852 1134 1012 B 856 ASN H B 855 LYS HBx 1.0 3.490 4.852 1135 1013 B 856 ASN H B 856 ASN HA 1.0 2.783 4.095 1136 1014 B 857 THR HG2% B 857 THR H 1.0 3.340 4.626 1137 1015 B 857 THR H B 857 THR HB 1.0 2.148 3.402 1138 1016 B 857 THR H B 857 THR HA 1.0 1.987 3.163 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 588 ARG C A 589 LYS N A 589 LYS CA A 589 LYS C 1.0 -164.47 -25.31 PHI 2 2 A 589 LYS N A 589 LYS CA A 589 LYS C A 590 GLY N 1.0 69.04 177.94 PSI 3 3 A 590 GLY C A 591 TRP N A 591 TRP CA A 591 TRP C 1.0 -83.03 -50.73 PHI 4 4 A 591 TRP N A 591 TRP CA A 591 TRP C A 592 HIS N 1.0 -78.21 18.91 PSI 5 5 A 591 TRP C A 592 HIS N A 592 HIS CA A 592 HIS C 1.0 -92.86 -45.50 PHI 6 6 A 592 HIS N A 592 HIS CA A 592 HIS C A 593 GLU N 1.0 -56.96 1.10 PSI 7 7 A 592 HIS C A 593 GLU N A 593 GLU CA A 593 GLU C 1.0 -96.13 -45.43 PHI 8 8 A 593 GLU N A 593 GLU CA A 593 GLU C A 594 HIS N 1.0 -46.98 -15.76 PSI 9 9 A 594 HIS C A 595 VAL N A 595 VAL CA A 595 VAL C 1.0 -180.47 -61.37 PHI 10 10 A 595 VAL N A 595 VAL CA A 595 VAL C A 596 THR N 1.0 134.92 179.48 PSI 11 11 A 595 VAL C A 596 THR N A 596 THR CA A 596 THR C 1.0 -94.04 -62.36 PHI 12 12 A 596 THR N A 596 THR CA A 596 THR C A 597 GLN N 1.0 143.42 188.42 PSI 13 13 A 596 THR C A 597 GLN N A 597 GLN CA A 597 GLN C 1.0 -70.00 -50.00 PHI 14 14 A 597 GLN N A 597 GLN CA A 597 GLN C A 598 ASP N 1.0 -55.00 -35.00 PSI 15 15 A 597 GLN C A 598 ASP N A 598 ASP CA A 598 ASP C 1.0 -70.00 -50.00 PHI 16 16 A 598 ASP N A 598 ASP CA A 598 ASP C A 599 LEU N 1.0 -55.00 -35.00 PSI 17 17 A 598 ASP C A 599 LEU N A 599 LEU CA A 599 LEU C 1.0 -70.00 -50.00 PHI 18 18 A 599 LEU N A 599 LEU CA A 599 LEU C A 600 ARG N 1.0 -55.00 -35.00 PSI 19 19 A 599 LEU C A 600 ARG N A 600 ARG CA A 600 ARG C 1.0 -70.00 -50.00 PHI 20 20 A 600 ARG N A 600 ARG CA A 600 ARG C A 601 SER N 1.0 -55.00 -35.00 PSI 21 21 A 600 ARG C A 601 SER N A 601 SER CA A 601 SER C 1.0 -70.00 -50.00 PHI 22 22 A 601 SER N A 601 SER CA A 601 SER C A 602 HIS N 1.0 -55.00 -35.00 PSI 23 23 A 601 SER C A 602 HIS N A 602 HIS CA A 602 HIS C 1.0 -70.00 -50.00 PHI 24 24 A 602 HIS N A 602 HIS CA A 602 HIS C A 603 LEU N 1.0 -55.00 -35.00 PSI 25 25 A 602 HIS C A 603 LEU N A 603 LEU CA A 603 LEU C 1.0 -70.00 -50.00 PHI 26 26 A 603 LEU N A 603 LEU CA A 603 LEU C A 604 VAL N 1.0 -55.00 -35.00 PSI 27 27 A 603 LEU C A 604 VAL N A 604 VAL CA A 604 VAL C 1.0 -70.00 -50.00 PHI 28 28 A 604 VAL N A 604 VAL CA A 604 VAL C A 605 HIS N 1.0 -55.00 -35.00 PSI 29 29 A 604 VAL C A 605 HIS N A 605 HIS CA A 605 HIS C 1.0 -70.00 -50.00 PHI 30 30 A 605 HIS N A 605 HIS CA A 605 HIS C A 606 LYS N 1.0 -55.00 -35.00 PSI 31 31 A 605 HIS C A 606 LYS N A 606 LYS CA A 606 LYS C 1.0 -70.00 -50.00 PHI 32 32 A 606 LYS N A 606 LYS CA A 606 LYS C A 607 LEU N 1.0 -55.00 -35.00 PSI 33 33 A 606 LYS C A 607 LEU N A 607 LEU CA A 607 LEU C 1.0 -70.00 -50.00 PHI 34 34 A 607 LEU N A 607 LEU CA A 607 LEU C A 608 VAL N 1.0 -55.00 -35.00 PSI 35 35 A 607 LEU C A 608 VAL N A 608 VAL CA A 608 VAL C 1.0 -70.00 -50.00 PHI 36 36 A 608 VAL N A 608 VAL CA A 608 VAL C A 609 GLN N 1.0 -55.00 -35.00 PSI 37 37 A 608 VAL C A 609 GLN N A 609 GLN CA A 609 GLN C 1.0 -70.00 -50.00 PHI 38 38 A 609 GLN N A 609 GLN CA A 609 GLN C A 610 ALA N 1.0 -55.00 -35.00 PSI 39 39 A 609 GLN C A 610 ALA N A 610 ALA CA A 610 ALA C 1.0 -70.00 -50.00 PHI 40 40 A 610 ALA N A 610 ALA CA A 610 ALA C A 611 ILE N 1.0 -55.00 -35.00 PSI 41 41 A 610 ALA C A 611 ILE N A 611 ILE CA A 611 ILE C 1.0 -100.17 -60.77 PHI 42 42 A 611 ILE N A 611 ILE CA A 611 ILE C A 612 PHE N 1.0 -56.78 -8.96 PSI 43 43 A 611 ILE C A 612 PHE N A 612 PHE CA A 612 PHE C 1.0 -155.49 -94.95 PHI 44 44 A 612 PHE N A 612 PHE CA A 612 PHE C A 613 PRO N 1.0 30.52 139.86 PSI 45 45 A 612 PHE C A 613 PRO N A 613 PRO CA A 613 PRO C 1.0 -88.27 -39.39 PHI 46 46 A 613 PRO N A 613 PRO CA A 613 PRO C A 614 THR N 1.0 -44.48 4.50 PSI 47 47 A 613 PRO C A 614 THR N A 614 THR CA A 614 THR C 1.0 -154.07 -55.11 PHI 48 48 A 614 THR N A 614 THR CA A 614 THR C A 615 PRO N 1.0 47.36 184.22 PSI 49 49 A 615 PRO C A 616 ASP N A 616 ASP CA A 616 ASP C 1.0 -129.32 -38.52 PHI 50 50 A 616 ASP N A 616 ASP CA A 616 ASP C A 617 PRO N 1.0 82.62 186.50 PSI 51 51 A 616 ASP C A 617 PRO N A 617 PRO CA A 617 PRO C 1.0 -61.33 -41.21 PHI 52 52 A 617 PRO N A 617 PRO CA A 617 PRO C A 618 ALA N 1.0 -47.79 -26.61 PSI 53 53 A 617 PRO C A 618 ALA N A 618 ALA CA A 618 ALA C 1.0 -92.59 -42.57 PHI 54 54 A 618 ALA N A 618 ALA CA A 618 ALA C A 619 ALA N 1.0 -56.38 -8.00 PSI 55 55 A 618 ALA C A 619 ALA N A 619 ALA CA A 619 ALA C 1.0 -71.52 -58.08 PHI 56 56 A 619 ALA N A 619 ALA CA A 619 ALA C A 620 LEU N 1.0 -51.77 -29.31 PSI 57 57 A 619 ALA C A 620 LEU N A 620 LEU CA A 620 LEU C 1.0 -76.75 -49.37 PHI 58 58 A 620 LEU N A 620 LEU CA A 620 LEU C A 621 LYS N 1.0 -48.24 -12.84 PSI 59 59 A 620 LEU C A 621 LYS N A 621 LYS CA A 621 LYS C 1.0 -117.18 -76.82 PHI 60 60 A 621 LYS N A 621 LYS CA A 621 LYS C A 622 ASP N 1.0 -32.41 15.73 PSI 61 61 A 621 LYS C A 622 ASP N A 622 ASP CA A 622 ASP C 1.0 -99.54 -61.62 PHI 62 62 A 622 ASP N A 622 ASP CA A 622 ASP C A 623 ARG N 1.0 78.08 145.24 PSI 63 63 A 622 ASP C A 623 ARG N A 623 ARG CA A 623 ARG C 1.0 -70.00 -50.00 PHI 64 64 A 623 ARG N A 623 ARG CA A 623 ARG C A 624 ARG N 1.0 -55.00 -35.00 PSI 65 65 A 623 ARG C A 624 ARG N A 624 ARG CA A 624 ARG C 1.0 -70.00 -50.00 PHI 66 66 A 624 ARG N A 624 ARG CA A 624 ARG C A 625 MET N 1.0 -55.00 -35.00 PSI 67 67 A 624 ARG C A 625 MET N A 625 MET CA A 625 MET C 1.0 -70.00 -50.00 PHI 68 68 A 625 MET N A 625 MET CA A 625 MET C A 626 GLU N 1.0 -55.00 -35.00 PSI 69 69 A 625 MET C A 626 GLU N A 626 GLU CA A 626 GLU C 1.0 -70.00 -50.00 PHI 70 70 A 626 GLU N A 626 GLU CA A 626 GLU C A 627 ASN N 1.0 -55.00 -35.00 PSI 71 71 A 626 GLU C A 627 ASN N A 627 ASN CA A 627 ASN C 1.0 -70.00 -50.00 PHI 72 72 A 627 ASN N A 627 ASN CA A 627 ASN C A 628 LEU N 1.0 -55.00 -35.00 PSI 73 73 A 627 ASN C A 628 LEU N A 628 LEU CA A 628 LEU C 1.0 -70.00 -50.00 PHI 74 74 A 628 LEU N A 628 LEU CA A 628 LEU C A 629 VAL N 1.0 -55.00 -35.00 PSI 75 75 A 628 LEU C A 629 VAL N A 629 VAL CA A 629 VAL C 1.0 -70.00 -50.00 PHI 76 76 A 629 VAL N A 629 VAL CA A 629 VAL C A 630 ALA N 1.0 -55.00 -35.00 PSI 77 77 A 629 VAL C A 630 ALA N A 630 ALA CA A 630 ALA C 1.0 -70.00 -50.00 PHI 78 78 A 630 ALA N A 630 ALA CA A 630 ALA C A 631 TYR N 1.0 -55.00 -35.00 PSI 79 79 A 630 ALA C A 631 TYR N A 631 TYR CA A 631 TYR C 1.0 -70.00 -50.00 PHI 80 80 A 631 TYR N A 631 TYR CA A 631 TYR C A 632 ALA N 1.0 -55.00 -35.00 PSI 81 81 A 631 TYR C A 632 ALA N A 632 ALA CA A 632 ALA C 1.0 -70.00 -50.00 PHI 82 82 A 632 ALA N A 632 ALA CA A 632 ALA C A 633 LYS N 1.0 -55.00 -35.00 PSI 83 83 A 632 ALA C A 633 LYS N A 633 LYS CA A 633 LYS C 1.0 -70.00 -50.00 PHI 84 84 A 633 LYS N A 633 LYS CA A 633 LYS C A 634 LYS N 1.0 -55.00 -35.00 PSI 85 85 A 633 LYS C A 634 LYS N A 634 LYS CA A 634 LYS C 1.0 -70.00 -50.00 PHI 86 86 A 634 LYS N A 634 LYS CA A 634 LYS C A 635 VAL N 1.0 -55.00 -35.00 PSI 87 87 A 634 LYS C A 635 VAL N A 635 VAL CA A 635 VAL C 1.0 -70.00 -50.00 PHI 88 88 A 635 VAL N A 635 VAL CA A 635 VAL C A 636 GLU N 1.0 -55.00 -35.00 PSI 89 89 A 635 VAL C A 636 GLU N A 636 GLU CA A 636 GLU C 1.0 -70.00 -50.00 PHI 90 90 A 636 GLU N A 636 GLU CA A 636 GLU C A 637 GLY N 1.0 -55.00 -35.00 PSI 91 91 A 636 GLU C A 637 GLY N A 637 GLY CA A 637 GLY C 1.0 -70.00 -50.00 PHI 92 92 A 637 GLY N A 637 GLY CA A 637 GLY C A 638 ASP N 1.0 -55.00 -35.00 PSI 93 93 A 637 GLY C A 638 ASP N A 638 ASP CA A 638 ASP C 1.0 -70.00 -50.00 PHI 94 94 A 638 ASP N A 638 ASP CA A 638 ASP C A 639 MET N 1.0 -55.00 -35.00 PSI 95 95 A 638 ASP C A 639 MET N A 639 MET CA A 639 MET C 1.0 -70.00 -50.00 PHI 96 96 A 639 MET N A 639 MET CA A 639 MET C A 640 TYR N 1.0 -55.00 -35.00 PSI 97 97 A 639 MET C A 640 TYR N A 640 TYR CA A 640 TYR C 1.0 -70.00 -50.00 PHI 98 98 A 640 TYR N A 640 TYR CA A 640 TYR C A 641 GLU N 1.0 -55.00 -35.00 PSI 99 99 A 640 TYR C A 641 GLU N A 641 GLU CA A 641 GLU C 1.0 -70.00 -50.00 PHI 100 100 A 641 GLU N A 641 GLU CA A 641 GLU C A 642 SER N 1.0 -55.00 -35.00 PSI 101 101 A 641 GLU C A 642 SER N A 642 SER CA A 642 SER C 1.0 -70.00 -50.00 PHI 102 102 A 642 SER N A 642 SER CA A 642 SER C A 643 ALA N 1.0 -55.00 -35.00 PSI 103 103 A 642 SER C A 643 ALA N A 643 ALA CA A 643 ALA C 1.0 -114.18 -43.38 PHI 104 104 A 643 ALA N A 643 ALA CA A 643 ALA C A 644 ASN N 1.0 -73.47 14.47 PSI 105 105 A 643 ALA C A 644 ASN N A 644 ASN CA A 644 ASN C 1.0 -126.33 -71.37 PHI 106 106 A 644 ASN N A 644 ASN CA A 644 ASN C A 645 SER N 1.0 -58.79 26.57 PSI 107 107 A 644 ASN C A 645 SER N A 645 SER CA A 645 SER C 1.0 -190.02 -52.80 PHI 108 108 A 645 SER N A 645 SER CA A 645 SER C A 646 ARG N 1.0 116.16 186.74 PSI 109 109 A 645 SER C A 646 ARG N A 646 ARG CA A 646 ARG C 1.0 -70.00 -50.00 PHI 110 110 A 646 ARG N A 646 ARG CA A 646 ARG C A 647 ASP N 1.0 -55.00 -35.00 PSI 111 111 A 646 ARG C A 647 ASP N A 647 ASP CA A 647 ASP C 1.0 -70.00 -50.00 PHI 112 112 A 647 ASP N A 647 ASP CA A 647 ASP C A 648 GLU N 1.0 -55.00 -35.00 PSI 113 113 A 647 ASP C A 648 GLU N A 648 GLU CA A 648 GLU C 1.0 -70.00 -50.00 PHI 114 114 A 648 GLU N A 648 GLU CA A 648 GLU C A 649 TYR N 1.0 -55.00 -35.00 PSI 115 115 A 648 GLU C A 649 TYR N A 649 TYR CA A 649 TYR C 1.0 -70.00 -50.00 PHI 116 116 A 649 TYR N A 649 TYR CA A 649 TYR C A 650 TYR N 1.0 -55.00 -35.00 PSI 117 117 A 649 TYR C A 650 TYR N A 650 TYR CA A 650 TYR C 1.0 -70.00 -50.00 PHI 118 118 A 650 TYR N A 650 TYR CA A 650 TYR C A 651 HIS N 1.0 -55.00 -35.00 PSI 119 119 A 650 TYR C A 651 HIS N A 651 HIS CA A 651 HIS C 1.0 -70.00 -50.00 PHI 120 120 A 651 HIS N A 651 HIS CA A 651 HIS C A 652 LEU N 1.0 -55.00 -35.00 PSI 121 121 A 651 HIS C A 652 LEU N A 652 LEU CA A 652 LEU C 1.0 -70.00 -50.00 PHI 122 122 A 652 LEU N A 652 LEU CA A 652 LEU C A 653 LEU N 1.0 -55.00 -35.00 PSI 123 123 A 652 LEU C A 653 LEU N A 653 LEU CA A 653 LEU C 1.0 -70.00 -50.00 PHI 124 124 A 653 LEU N A 653 LEU CA A 653 LEU C A 654 ALA N 1.0 -55.00 -35.00 PSI 125 125 A 653 LEU C A 654 ALA N A 654 ALA CA A 654 ALA C 1.0 -70.00 -50.00 PHI 126 126 A 654 ALA N A 654 ALA CA A 654 ALA C A 655 GLU N 1.0 -55.00 -35.00 PSI 127 127 A 654 ALA C A 655 GLU N A 655 GLU CA A 655 GLU C 1.0 -70.00 -50.00 PHI 128 128 A 655 GLU N A 655 GLU CA A 655 GLU C A 656 LYS N 1.0 -55.00 -35.00 PSI 129 129 A 655 GLU C A 656 LYS N A 656 LYS CA A 656 LYS C 1.0 -70.00 -50.00 PHI 130 130 A 656 LYS N A 656 LYS CA A 656 LYS C A 657 ILE N 1.0 -55.00 -35.00 PSI 131 131 A 656 LYS C A 657 ILE N A 657 ILE CA A 657 ILE C 1.0 -70.00 -50.00 PHI 132 132 A 657 ILE N A 657 ILE CA A 657 ILE C A 658 TYR N 1.0 -55.00 -35.00 PSI 133 133 A 657 ILE C A 658 TYR N A 658 TYR CA A 658 TYR C 1.0 -70.00 -50.00 PHI 134 134 A 658 TYR N A 658 TYR CA A 658 TYR C A 659 LYS N 1.0 -55.00 -35.00 PSI 135 135 A 658 TYR C A 659 LYS N A 659 LYS CA A 659 LYS C 1.0 -70.00 -50.00 PHI 136 136 A 659 LYS N A 659 LYS CA A 659 LYS C A 660 ILE N 1.0 -55.00 -35.00 PSI 137 137 A 659 LYS C A 660 ILE N A 660 ILE CA A 660 ILE C 1.0 -70.00 -50.00 PHI 138 138 A 660 ILE N A 660 ILE CA A 660 ILE C A 661 GLN N 1.0 -55.00 -35.00 PSI 139 139 A 660 ILE C A 661 GLN N A 661 GLN CA A 661 GLN C 1.0 -70.00 -50.00 PHI 140 140 A 661 GLN N A 661 GLN CA A 661 GLN C A 662 LYS N 1.0 -55.00 -35.00 PSI 141 141 A 661 GLN C A 662 LYS N A 662 LYS CA A 662 LYS C 1.0 -70.00 -50.00 PHI 142 142 A 662 LYS N A 662 LYS CA A 662 LYS C A 663 GLU N 1.0 -55.00 -35.00 PSI 143 143 A 662 LYS C A 663 GLU N A 663 GLU CA A 663 GLU C 1.0 -70.00 -50.00 PHI 144 144 A 663 GLU N A 663 GLU CA A 663 GLU C A 664 LEU N 1.0 -55.00 -35.00 PSI 145 145 A 663 GLU C A 664 LEU N A 664 LEU CA A 664 LEU C 1.0 -70.00 -50.00 PHI 146 146 A 664 LEU N A 664 LEU CA A 664 LEU C A 665 GLU N 1.0 -55.00 -35.00 PSI 147 147 A 664 LEU C A 665 GLU N A 665 GLU CA A 665 GLU C 1.0 -70.00 -50.00 PHI 148 148 A 665 GLU N A 665 GLU CA A 665 GLU C A 666 GLU N 1.0 -55.00 -35.00 PSI 149 149 A 665 GLU C A 666 GLU N A 666 GLU CA A 666 GLU C 1.0 -70.00 -50.00 PHI 150 150 A 666 GLU N A 666 GLU CA A 666 GLU C A 667 LYS N 1.0 -55.00 -35.00 PSI 151 151 A 666 GLU C A 667 LYS N A 667 LYS CA A 667 LYS C 1.0 -70.00 -50.00 PHI 152 152 A 667 LYS N A 667 LYS CA A 667 LYS C A 668 ARG N 1.0 -55.60 -35.60 PSI 153 153 A 667 LYS C A 668 ARG N A 668 ARG CA A 668 ARG C 1.0 -113.76 -57.10 PHI 154 154 A 668 ARG N A 668 ARG CA A 668 ARG C A 669 ARG N 1.0 -53.82 20.26 PSI 155 155 A 668 ARG C A 669 ARG N A 669 ARG CA A 669 ARG C 1.0 -75.38 -46.18 PHI 156 156 A 669 ARG N A 669 ARG CA A 669 ARG C A 670 SER N 1.0 -34.95 -7.29 PSI 157 157 A 669 ARG C A 670 SER N A 670 SER CA A 670 SER C 1.0 -131.06 -46.64 PHI 158 158 A 670 SER N A 670 SER CA A 670 SER C A 671 ARG N 1.0 -42.43 8.77 PSI 159 159 B 843 ASN C B 844 ILE N B 844 ILE CA B 844 ILE C 1.0 -144.14 -69.30 PHI 160 160 B 844 ILE N B 844 ILE CA B 844 ILE C B 845 LEU N 1.0 110.51 150.71 PSI 161 161 B 844 ILE C B 845 LEU N B 845 LEU CA B 845 LEU C 1.0 -149.80 -79.88 PHI 162 162 B 845 LEU N B 845 LEU CA B 845 LEU C B 846 PRO N 1.0 56.29 191.21 PSI 163 163 B 846 PRO C B 847 SER N B 847 SER CA B 847 SER C 1.0 -70.00 -50.00 PHI 164 164 B 847 SER N B 847 SER CA B 847 SER C B 848 ASP N 1.0 -55.00 -35.00 PSI 165 165 B 847 SER C B 848 ASP N B 848 ASP CA B 848 ASP C 1.0 -70.00 -50.00 PHI 166 166 B 848 ASP N B 848 ASP CA B 848 ASP C B 849 ILE N 1.0 -55.00 -35.00 PSI 167 167 B 848 ASP C B 849 ILE N B 849 ILE CA B 849 ILE C 1.0 -70.00 -50.00 PHI 168 168 B 849 ILE N B 849 ILE CA B 849 ILE C B 850 MET N 1.0 -55.00 -35.00 PSI 169 169 B 849 ILE C B 850 MET N B 850 MET CA B 850 MET C 1.0 -70.00 -50.00 PHI 170 170 B 850 MET N B 850 MET CA B 850 MET C B 851 ASP N 1.0 -55.00 -35.00 PSI 171 171 B 850 MET C B 851 ASP N B 851 ASP CA B 851 ASP C 1.0 -70.00 -50.00 PHI 172 172 B 851 ASP N B 851 ASP CA B 851 ASP C B 852 PHE N 1.0 -55.00 -35.00 PSI 173 173 B 851 ASP C B 852 PHE N B 852 PHE CA B 852 PHE C 1.0 -70.00 -50.00 PHI 174 174 B 852 PHE N B 852 PHE CA B 852 PHE C B 853 VAL N 1.0 -55.00 -35.00 PSI 175 175 B 852 PHE C B 853 VAL N B 853 VAL CA B 853 VAL C 1.0 -70.00 -50.00 PHI 176 176 B 853 VAL N B 853 VAL CA B 853 VAL C B 854 LEU N 1.0 -55.00 -35.00 PSI 177 177 B 853 VAL C B 854 LEU N B 854 LEU CA B 854 LEU C 1.0 -70.00 -50.00 PHI 178 178 B 854 LEU N B 854 LEU CA B 854 LEU C B 855 LYS N 1.0 -55.00 -35.00 PSI 179 179 B 854 LEU C B 855 LYS N B 855 LYS CA B 855 LYS C 1.0 -128.32 -58.74 PHI 180 180 B 855 LYS N B 855 LYS CA B 855 LYS C B 856 ASN N 1.0 -58.04 33.10 PSI 181 181 B 855 LYS C B 856 ASN N B 856 ASN CA B 856 ASN C 1.0 -176.80 -93.92 PHI 182 182 B 856 ASN N B 856 ASN CA B 856 ASN C B 857 THR N 1.0 129.23 166.69 PSI 183 183 B 856 ASN C B 857 THR N B 857 THR CA B 857 THR C 1.0 -173.37 -79.79 PHI 184 184 B 857 THR N B 857 THR CA B 857 THR C B 858 PRO N 1.0 65.07 187.03 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 587 VAL N A 587 VAL H 1.0 . . . 2 2 A 588 ARG N A 588 ARG H 1.0 . . . 3 3 A 589 LYS N A 589 LYS H 1.0 . . . 4 4 A 590 GLY N A 590 GLY H 1.0 . . . 5 5 A 591 TRP N A 591 TRP H 1.0 . . . 6 6 A 591 TRP NE1 A 591 TRP HE1 1.0 . . . 7 7 A 592 HIS N A 592 HIS H 1.0 . . . 8 8 A 593 GLU N A 593 GLU H 1.0 . . . 9 9 A 594 HIS N A 594 HIS H 1.0 . . . 10 10 A 595 VAL N A 595 VAL H 1.0 . . . 11 11 A 596 THR N A 596 THR H 1.0 . . . 12 12 A 597 GLN N A 597 GLN H 1.0 . . . 13 13 A 598 ASP N A 598 ASP H 1.0 . . . 14 14 A 599 LEU N A 599 LEU H 1.0 . . . 15 15 A 600 ARG N A 600 ARG H 1.0 . . . 16 16 A 601 SER N A 601 SER H 1.0 . . . 17 17 A 602 HIS N A 602 HIS H 1.0 . . . 18 18 A 603 LEU N A 603 LEU H 1.0 . . . 19 19 A 604 VAL N A 604 VAL H 1.0 . . . 20 20 A 605 HIS N A 605 HIS H 1.0 . . . 21 21 A 608 VAL N A 608 VAL H 1.0 . . . 22 22 A 609 GLN N A 609 GLN H 1.0 . . . 23 23 A 610 ALA N A 610 ALA H 1.0 . . . 24 24 A 611 ILE N A 611 ILE H 1.0 . . . 25 25 A 612 PHE N A 612 PHE H 1.0 . . . 26 26 A 614 THR N A 614 THR H 1.0 . . . 27 27 A 616 ASP N A 616 ASP H 1.0 . . . 28 28 A 618 ALA N A 618 ALA H 1.0 . . . 29 29 A 619 ALA N A 619 ALA H 1.0 . . . 30 30 A 620 LEU N A 620 LEU H 1.0 . . . 31 31 A 621 LYS N A 621 LYS H 1.0 . . . 32 32 A 622 ASP N A 622 ASP H 1.0 . . . 33 33 A 623 ARG N A 623 ARG H 1.0 . . . 34 34 A 624 ARG N A 624 ARG H 1.0 . . . 35 35 A 626 GLU N A 626 GLU H 1.0 . . . 36 36 A 627 ASN N A 627 ASN H 1.0 . . . 37 37 A 628 LEU N A 628 LEU H 1.0 . . . 38 38 A 629 VAL N A 629 VAL H 1.0 . . . 39 39 A 630 ALA N A 630 ALA H 1.0 . . . 40 40 A 631 TYR N A 631 TYR H 1.0 . . . 41 41 A 632 ALA N A 632 ALA H 1.0 . . . 42 42 A 633 LYS N A 633 LYS H 1.0 . . . 43 43 A 634 LYS N A 634 LYS H 1.0 . . . 44 44 A 635 VAL N A 635 VAL H 1.0 . . . 45 45 A 636 GLU N A 636 GLU H 1.0 . . . 46 46 A 637 GLY N A 637 GLY H 1.0 . . . 47 47 A 638 ASP N A 638 ASP H 1.0 . . . 48 48 A 639 MET N A 639 MET H 1.0 . . . 49 49 A 640 TYR N A 640 TYR H 1.0 . . . 50 50 A 641 GLU N A 641 GLU H 1.0 . . . 51 51 A 642 SER N A 642 SER H 1.0 . . . 52 52 A 643 ALA N A 643 ALA H 1.0 . . . 53 53 A 644 ASN N A 644 ASN H 1.0 . . . 54 54 A 646 ARG N A 646 ARG H 1.0 . . . 55 55 A 647 ASP N A 647 ASP H 1.0 . . . 56 56 A 648 GLU N A 648 GLU H 1.0 . . . 57 57 A 649 TYR N A 649 TYR H 1.0 . . . 58 58 A 650 TYR N A 650 TYR H 1.0 . . . 59 59 A 651 HIS N A 651 HIS H 1.0 . . . 60 60 A 652 LEU N A 652 LEU H 1.0 . . . 61 61 A 653 LEU N A 653 LEU H 1.0 . . . 62 62 A 654 ALA N A 654 ALA H 1.0 . . . 63 63 A 655 GLU N A 655 GLU H 1.0 . . . 64 64 A 656 LYS N A 656 LYS H 1.0 . . . 65 65 A 657 ILE N A 657 ILE H 1.0 . . . 66 66 A 659 LYS N A 659 LYS H 1.0 . . . 67 67 A 660 ILE N A 660 ILE H 1.0 . . . 68 68 A 661 GLN N A 661 GLN H 1.0 . . . 69 69 A 662 LYS N A 662 LYS H 1.0 . . . 70 70 A 663 GLU N A 663 GLU H 1.0 . . . 71 71 A 664 LEU N A 664 LEU H 1.0 . . . 72 72 A 665 GLU N A 665 GLU H 1.0 . . . 73 73 A 666 GLU N A 666 GLU H 1.0 . . . 74 74 A 667 LYS N A 667 LYS H 1.0 . . . 75 75 A 668 ARG N A 668 ARG H 1.0 . . . 76 76 A 669 ARG N A 669 ARG H 1.0 . . . 77 77 A 670 SER N A 670 SER H 1.0 . . . 78 78 A 671 ARG N A 671 ARG H 1.0 . . . 79 79 A 672 LEU N A 672 LEU H 1.0 . . . stop_ save_