data_nef_c30162_5t42 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 PDB 5T42 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 630 GLY start . false 2 A 631 SER middle . . 3 A 632 ASP middle . . 4 A 633 LYS middle . . 5 A 634 THR middle . . 6 A 635 LEU middle . . 7 A 636 PRO middle . false 8 A 637 ASP middle . . 9 A 638 GLN middle . . 10 A 639 GLY middle . false 11 A 640 ASP middle . . 12 A 641 ASN middle . . 13 A 642 ASP middle . . 14 A 643 ASN middle . . 15 A 644 TRP middle . . 16 A 645 TRP middle . . 17 A 646 THR middle . . 18 A 647 GLY middle . false 19 A 648 TRP middle . . 20 A 649 ARG middle . . 21 A 650 GLN middle . . 22 A 651 TRP middle . . 23 A 652 ILE middle . . 24 A 653 PRO middle . false 25 A 654 ALA middle . . 26 A 655 GLY middle . false 27 A 656 ILE middle . . 28 A 657 GLY middle . false 29 A 658 VAL middle . . 30 A 659 THR middle . . 31 A 660 GLY middle . false 32 A 661 VAL middle . . 33 A 662 VAL middle . . 34 A 663 ILE middle . . 35 A 664 ALA middle . . 36 A 665 VAL middle . . 37 A 666 ILE middle . . 38 A 667 ALA middle . . 39 A 668 LEU middle . . 40 A 669 PHE middle . . 41 A 670 ALA middle . . 42 A 671 ILE middle . . 43 A 672 ALA middle . . 44 A 673 LYS middle . . 45 A 674 PHE middle . . 46 A 675 VAL middle . . 47 A 676 PHE end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_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 630 GLY H1 H 1 8.299 0.023 A 630 GLY HA2 H 1 3.770 0.023 A 630 GLY HA3 H 1 3.770 0.023 A 630 GLY CA C 13 44.025 0.160 A 630 GLY N N 15 109.635 0.109 A 631 SER H H 1 8.576 0.023 A 631 SER HA H 1 3.708 0.023 A 631 SER C C 13 174.026 0.125 A 631 SER CA C 13 58.187 0.160 A 631 SER CB C 13 63.805 0.138 A 631 SER N N 15 115.897 0.109 A 632 ASP H H 1 8.363 0.023 A 632 ASP HA H 1 4.444 0.023 A 632 ASP HB2 H 1 2.505 0.023 A 632 ASP HB3 H 1 2.505 0.023 A 632 ASP C C 13 176.080 0.125 A 632 ASP CA C 13 53.768 0.160 A 632 ASP CB C 13 40.370 0.138 A 632 ASP N N 15 122.257 0.109 A 633 LYS H H 1 8.163 0.023 A 633 LYS HA H 1 4.223 0.023 A 633 LYS HB2 H 1 1.593 0.023 A 633 LYS HB3 H 1 1.686 0.023 A 633 LYS HD2 H 1 1.527 0.023 A 633 LYS HD3 H 1 1.527 0.023 A 633 LYS HE2 H 1 2.840 0.023 A 633 LYS HE3 H 1 2.840 0.023 A 633 LYS HG2 H 1 1.282 0.023 A 633 LYS HG3 H 1 1.282 0.023 A 633 LYS C C 13 176.479 0.125 A 633 LYS CA C 13 56.040 0.160 A 633 LYS CB C 13 32.793 0.138 A 633 LYS CD C 13 28.889 . A 633 LYS CE C 13 41.917 . A 633 LYS CG C 13 24.500 . A 633 LYS N N 15 121.504 0.109 A 634 THR H H 1 8.102 0.023 A 634 THR HA H 1 4.103 0.023 A 634 THR HB H 1 4.026 0.023 A 634 THR HG2% H 1 1.037 0.023 A 634 THR C C 13 174.163 0.125 A 634 THR CA C 13 62.098 0.160 A 634 THR CB C 13 69.689 0.138 A 634 THR CG2 C 13 21.720 . A 634 THR N N 15 115.462 0.109 A 635 LEU H H 1 8.023 0.023 A 635 LEU HA H 1 4.502 0.023 A 635 LEU HB2 H 1 1.445 0.023 A 635 LEU HB3 H 1 1.481 0.023 A 635 LEU HD1% H 1 0.786 0.023 A 635 LEU HD2% H 1 0.750 0.023 A 635 LEU C C 13 175.089 0.125 A 635 LEU CA C 13 52.878 0.160 A 635 LEU CB C 13 41.741 0.138 A 635 LEU N N 15 125.558 0.109 A 636 PRO HA H 1 4.256 0.023 A 636 PRO HB2 H 1 2.127 0.023 A 636 PRO HB3 H 1 2.127 0.023 A 636 PRO HD2 H 1 3.494 0.023 A 636 PRO HD3 H 1 3.668 0.023 A 636 PRO HG2 H 1 1.750 0.023 A 636 PRO HG3 H 1 1.850 0.023 A 636 PRO C C 13 176.557 0.125 A 636 PRO CA C 13 63.206 0.160 A 636 PRO CB C 13 31.898 0.138 A 636 PRO CD C 13 50.500 . A 636 PRO CG C 13 27.255 . A 637 ASP H H 1 8.245 0.023 A 637 ASP HA H 1 4.387 0.023 A 637 ASP HB2 H 1 2.558 0.023 A 637 ASP HB3 H 1 2.558 0.023 A 637 ASP C C 13 176.226 0.125 A 637 ASP CA C 13 53.866 0.160 A 637 ASP CB C 13 40.965 0.138 A 637 ASP N N 15 119.909 0.109 A 638 GLN H H 1 8.198 0.023 A 638 GLN HA H 1 4.185 0.023 A 638 GLN HB2 H 1 1.846 0.023 A 638 GLN HB3 H 1 2.035 0.023 A 638 GLN HG2 H 1 2.216 0.023 A 638 GLN HG3 H 1 2.216 0.023 A 638 GLN C C 13 176.382 0.125 A 638 GLN CA C 13 55.857 0.160 A 638 GLN CB C 13 29.343 0.138 A 638 GLN CG C 13 33.895 . A 638 GLN N N 15 120.549 0.109 A 639 GLY H H 1 8.333 0.023 A 639 GLY HA2 H 1 3.802 0.023 A 639 GLY HA3 H 1 3.802 0.023 A 639 GLY C C 13 173.859 0.125 A 639 GLY CA C 13 45.370 0.160 A 639 GLY N N 15 109.653 0.109 A 640 ASP H H 1 8.113 0.023 A 640 ASP HA H 1 4.518 0.023 A 640 ASP HB2 H 1 2.516 0.023 A 640 ASP HB3 H 1 2.516 0.023 A 640 ASP C C 13 176.109 0.125 A 640 ASP CA C 13 54.154 0.160 A 640 ASP CB C 13 41.056 0.138 A 640 ASP N N 15 120.160 0.109 A 641 ASN H H 1 8.275 0.023 A 641 ASN HA H 1 4.545 0.023 A 641 ASN HB2 H 1 2.658 0.023 A 641 ASN HB3 H 1 2.658 0.023 A 641 ASN C C 13 174.886 0.125 A 641 ASN CA C 13 53.983 0.160 A 641 ASN CB C 13 39.139 0.138 A 641 ASN N N 15 118.739 0.109 A 642 ASP H H 1 8.143 0.023 A 642 ASP HA H 1 4.467 0.023 A 642 ASP HB2 H 1 2.482 0.023 A 642 ASP HB3 H 1 2.525 0.023 A 642 ASP C C 13 175.751 0.125 A 642 ASP CA C 13 54.309 0.160 A 642 ASP CB C 13 40.861 0.138 A 642 ASP N N 15 120.062 0.109 A 643 ASN H H 1 8.008 0.023 A 643 ASN HA H 1 4.387 0.023 A 643 ASN HB2 H 1 1.868 0.023 A 643 ASN HB3 H 1 2.096 0.023 A 643 ASN C C 13 176.329 0.125 A 643 ASN CA C 13 53.161 0.160 A 643 ASN CB C 13 38.897 0.138 A 643 ASN N N 15 118.292 0.109 A 644 TRP H H 1 8.125 0.023 A 644 TRP HA H 1 4.181 0.023 A 644 TRP HB2 H 1 3.068 0.023 A 644 TRP HB3 H 1 3.259 0.023 A 644 TRP HD1 H 1 6.739 0.023 A 644 TRP HE1 H 1 10.467 0.023 A 644 TRP HE3 H 1 7.226 0.023 A 644 TRP HH2 H 1 6.957 0.023 A 644 TRP HZ2 H 1 7.299 0.023 A 644 TRP HZ3 H 1 6.674 0.023 A 644 TRP C C 13 176.503 0.125 A 644 TRP CA C 13 59.376 0.160 A 644 TRP CB C 13 28.821 0.138 A 644 TRP CD1 C 13 126.951 . A 644 TRP CE3 C 13 120.192 . A 644 TRP CH2 C 13 123.991 . A 644 TRP CZ2 C 13 114.446 . A 644 TRP CZ3 C 13 118.331 . A 644 TRP N N 15 121.589 0.109 A 644 TRP NE1 N 15 131.137 0.109 A 645 TRP H H 1 6.830 0.023 A 645 TRP HA H 1 4.260 0.023 A 645 TRP HB2 H 1 2.208 0.023 A 645 TRP HB3 H 1 2.977 0.023 A 645 TRP HD1 H 1 7.421 0.023 A 645 TRP HE1 H 1 10.091 0.023 A 645 TRP HH2 H 1 6.864 0.023 A 645 TRP HZ2 H 1 7.282 0.023 A 645 TRP C C 13 176.611 0.125 A 645 TRP CA C 13 57.665 0.160 A 645 TRP CB C 13 28.252 0.138 A 645 TRP CD1 C 13 127.380 . A 645 TRP CH2 C 13 123.697 . A 645 TRP CZ2 C 13 114.450 . A 645 TRP N N 15 116.388 0.109 A 645 TRP NE1 N 15 129.730 0.109 A 646 THR H H 1 7.299 0.023 A 646 THR HA H 1 4.208 0.023 A 646 THR HB H 1 3.954 0.023 A 646 THR HG2% H 1 0.985 0.023 A 646 THR C C 13 176.080 0.125 A 646 THR CA C 13 65.139 0.160 A 646 THR CB C 13 68.898 0.138 A 646 THR CG2 C 13 21.402 . A 646 THR N N 15 114.323 0.109 A 647 GLY H H 1 8.272 0.023 A 647 GLY HA2 H 1 3.709 0.023 A 647 GLY HA3 H 1 3.879 0.023 A 647 GLY C C 13 175.406 0.125 A 647 GLY CA C 13 45.977 0.160 A 647 GLY N N 15 110.508 0.109 A 648 TRP H H 1 7.478 0.023 A 648 TRP HA H 1 3.806 0.023 A 648 TRP HB2 H 1 3.155 0.023 A 648 TRP HB3 H 1 3.155 0.023 A 648 TRP HD1 H 1 7.421 0.023 A 648 TRP HE1 H 1 10.746 0.023 A 648 TRP HE3 H 1 7.002 0.023 A 648 TRP HZ2 H 1 7.337 0.023 A 648 TRP C C 13 176.956 0.125 A 648 TRP CA C 13 59.300 0.160 A 648 TRP CB C 13 28.274 0.138 A 648 TRP CD1 C 13 127.987 . A 648 TRP CE3 C 13 128.403 . A 648 TRP CZ2 C 13 114.446 . A 648 TRP N N 15 120.335 0.109 A 648 TRP NE1 N 15 131.662 0.109 A 649 ARG H H 1 7.325 0.023 A 649 ARG HA H 1 3.382 0.023 A 649 ARG HB2 H 1 1.075 0.023 A 649 ARG HB3 H 1 1.336 0.023 A 649 ARG HD2 H 1 2.738 0.023 A 649 ARG HD3 H 1 2.738 0.023 A 649 ARG HG2 H 1 0.458 0.023 A 649 ARG HG3 H 1 0.561 0.023 A 649 ARG C C 13 178.063 0.125 A 649 ARG CA C 13 59.207 0.160 A 649 ARG CB C 13 29.151 0.138 A 649 ARG CD C 13 43.264 . A 649 ARG CG C 13 27.159 . A 649 ARG N N 15 119.033 0.109 A 650 GLN H H 1 7.666 0.023 A 650 GLN HA H 1 3.916 0.023 A 650 GLN HB2 H 1 1.804 0.023 A 650 GLN HB3 H 1 1.804 0.023 A 650 GLN HG2 H 1 2.011 0.023 A 650 GLN HG3 H 1 2.011 0.023 A 650 GLN C C 13 176.223 0.125 A 650 GLN CA C 13 56.953 0.160 A 650 GLN CB C 13 28.385 0.138 A 650 GLN CG C 13 33.787 . A 650 GLN N N 15 114.465 0.109 A 651 TRP H H 1 7.681 0.023 A 651 TRP HA H 1 4.320 0.023 A 651 TRP HB2 H 1 3.194 0.023 A 651 TRP HB3 H 1 3.435 0.023 A 651 TRP HD1 H 1 7.130 0.023 A 651 TRP HE1 H 1 10.306 0.023 A 651 TRP HE3 H 1 7.200 0.023 A 651 TRP HH2 H 1 7.087 0.023 A 651 TRP HZ2 H 1 7.401 0.023 A 651 TRP C C 13 174.795 0.125 A 651 TRP CA C 13 57.621 0.160 A 651 TRP CB C 13 29.626 0.138 A 651 TRP CD1 C 13 126.296 . A 651 TRP CE3 C 13 120.655 . A 651 TRP CH2 C 13 123.990 . A 651 TRP CZ2 C 13 114.446 . A 651 TRP N N 15 118.593 0.109 A 651 TRP NE1 N 15 129.502 0.109 A 652 ILE H H 1 7.071 0.023 A 652 ILE C C 13 174.368 0.125 A 652 ILE N N 15 117.360 0.109 A 653 PRO HA H 1 4.321 0.023 A 653 PRO HB2 H 1 2.234 0.023 A 653 PRO HB3 H 1 2.234 0.023 A 653 PRO HG2 H 1 1.837 0.023 A 653 PRO HG3 H 1 1.837 0.023 A 653 PRO C C 13 176.081 0.125 A 653 PRO CA C 13 63.018 0.160 A 653 PRO CB C 13 31.662 0.138 A 654 ALA H H 1 8.396 0.023 A 654 ALA HA H 1 4.072 0.023 A 654 ALA HB% H 1 1.281 0.023 A 654 ALA C C 13 177.007 0.125 A 654 ALA CA C 13 53.095 0.160 A 654 ALA CB C 13 18.869 0.138 A 654 ALA N N 15 123.364 0.109 A 655 GLY H H 1 8.477 0.023 A 655 GLY HA2 H 1 3.790 0.023 A 655 GLY HA3 H 1 3.790 0.023 A 655 GLY C C 13 176.242 0.125 A 655 GLY CA C 13 45.783 0.160 A 655 GLY N N 15 106.208 0.109 A 656 ILE H H 1 7.505 0.023 A 656 ILE HA H 1 4.069 0.023 A 656 ILE HB H 1 1.765 0.023 A 656 ILE HG12 H 1 1.197 0.023 A 656 ILE HG13 H 1 1.458 0.023 A 656 ILE HG2% H 1 0.823 0.023 A 656 ILE C C 13 175.091 0.125 A 656 ILE CA C 13 61.743 0.160 A 656 ILE CB C 13 38.806 0.138 A 656 ILE CD1 C 13 13.365 . A 656 ILE CG1 C 13 27.412 . A 656 ILE CG2 C 13 17.625 . A 656 ILE N N 15 117.365 0.109 A 657 GLY H H 1 8.250 0.023 A 657 GLY HA2 H 1 3.830 0.023 A 657 GLY HA3 H 1 4.034 0.023 A 657 GLY C C 13 173.432 0.125 A 657 GLY CA C 13 45.053 0.160 A 657 GLY N N 15 110.490 0.109 A 658 VAL H H 1 8.610 0.023 A 658 VAL HA H 1 3.459 0.023 A 658 VAL HB H 1 1.997 0.023 A 658 VAL HG1% H 1 0.965 0.023 A 658 VAL HG2% H 1 0.837 0.023 A 658 VAL C C 13 177.064 0.125 A 658 VAL CA C 13 66.494 0.160 A 658 VAL CB C 13 31.552 0.138 A 658 VAL CG1 C 13 22.639 . A 658 VAL CG2 C 13 21.558 . A 658 VAL N N 15 119.521 0.109 A 659 THR H H 1 8.314 0.023 A 659 THR HA H 1 4.039 0.023 A 659 THR HB H 1 3.990 0.023 A 659 THR HG2% H 1 1.034 0.023 A 659 THR C C 13 176.476 0.125 A 659 THR CA C 13 67.348 0.160 A 659 THR CG2 C 13 21.895 . A 659 THR N N 15 115.155 0.109 A 660 GLY H H 1 7.991 0.023 A 660 GLY HA2 H 1 3.529 0.023 A 660 GLY HA3 H 1 3.529 0.023 A 660 GLY C C 13 174.296 0.125 A 660 GLY CA C 13 47.464 0.160 A 660 GLY N N 15 106.921 0.109 A 661 VAL H H 1 7.598 0.023 A 661 VAL HA H 1 3.402 0.023 A 661 VAL HB H 1 2.123 0.023 A 661 VAL HG1% H 1 0.767 0.023 A 661 VAL HG2% H 1 0.767 0.023 A 661 VAL C C 13 176.698 0.125 A 661 VAL CA C 13 67.112 0.160 A 661 VAL CB C 13 31.484 0.138 A 661 VAL CG1 C 13 23.565 . A 661 VAL CG2 C 13 21.514 . A 661 VAL N N 15 119.675 0.109 A 662 VAL H H 1 8.053 0.023 A 662 VAL HA H 1 3.285 0.023 A 662 VAL HB H 1 2.130 0.023 A 662 VAL HG1% H 1 0.755 0.023 A 662 VAL HG2% H 1 0.755 0.023 A 662 VAL C C 13 177.277 0.125 A 662 VAL CA C 13 67.393 0.160 A 662 VAL CB C 13 31.072 0.138 A 662 VAL CG1 C 13 23.490 . A 662 VAL CG2 C 13 21.509 . A 662 VAL N N 15 118.364 0.109 A 663 ILE H H 1 8.000 0.023 A 663 ILE HA H 1 3.410 0.023 A 663 ILE HB H 1 1.794 0.023 A 663 ILE HG2% H 1 0.723 0.023 A 663 ILE C C 13 176.539 0.125 A 663 ILE CA C 13 65.383 0.160 A 663 ILE CB C 13 37.284 0.138 A 663 ILE CD1 C 13 13.189 . A 663 ILE CG1 C 13 29.449 . A 663 ILE CG2 C 13 17.393 . A 663 ILE N N 15 117.189 0.109 A 664 ALA H H 1 8.040 0.023 A 664 ALA HA H 1 3.780 0.023 A 664 ALA HB% H 1 1.328 0.023 A 664 ALA C C 13 178.530 0.125 A 664 ALA CA C 13 55.680 0.160 A 664 ALA CB C 13 17.982 0.138 A 664 ALA N N 15 120.591 0.109 A 665 VAL H H 1 8.169 0.023 A 665 VAL HA H 1 3.401 0.023 A 665 VAL HB H 1 2.094 0.023 A 665 VAL HG1% H 1 0.878 0.023 A 665 VAL HG2% H 1 0.730 0.023 A 665 VAL C C 13 177.362 0.125 A 665 VAL CA C 13 67.157 0.160 A 665 VAL CB C 13 31.385 0.138 A 665 VAL CG1 C 13 23.378 . A 665 VAL CG2 C 13 21.792 . A 665 VAL N N 15 116.031 0.109 A 666 ILE H H 1 8.049 0.023 A 666 ILE HA H 1 3.455 0.023 A 666 ILE HB H 1 1.835 0.023 A 666 ILE HG2% H 1 0.727 0.023 A 666 ILE C C 13 177.372 0.125 A 666 ILE CA C 13 65.903 0.160 A 666 ILE CB C 13 37.699 0.138 A 666 ILE CD1 C 13 13.101 . A 666 ILE CG1 C 13 28.910 . A 666 ILE CG2 C 13 16.947 . A 666 ILE N N 15 118.813 0.109 A 667 ALA H H 1 8.563 0.023 A 667 ALA HA H 1 3.803 0.023 A 667 ALA HB% H 1 1.296 0.023 A 667 ALA C C 13 178.923 0.125 A 667 ALA CA C 13 55.748 0.160 A 667 ALA CB C 13 17.794 0.138 A 667 ALA N N 15 120.622 0.109 A 668 LEU H H 1 8.321 0.023 A 668 LEU HA H 1 3.837 0.023 A 668 LEU HB2 H 1 1.767 0.023 A 668 LEU HB3 H 1 1.834 0.023 A 668 LEU HD1% H 1 0.678 0.023 A 668 LEU HD2% H 1 0.678 0.023 A 668 LEU HG H 1 1.311 0.023 A 668 LEU C C 13 178.480 0.125 A 668 LEU CA C 13 58.297 0.160 A 668 LEU CB C 13 41.565 0.138 A 668 LEU CD1 C 13 24.810 . A 668 LEU CG C 13 26.696 . A 668 LEU N N 15 116.931 0.109 A 669 PHE H H 1 8.317 0.023 A 669 PHE HA H 1 3.965 0.023 A 669 PHE HB2 H 1 3.059 0.023 A 669 PHE HB3 H 1 3.059 0.023 A 669 PHE HD1 H 1 7.152 0.023 A 669 PHE C C 13 176.820 0.125 A 669 PHE CA C 13 61.630 0.160 A 669 PHE CB C 13 38.945 0.138 A 669 PHE CD1 C 13 131.905 . A 669 PHE N N 15 118.496 0.109 A 670 ALA H H 1 8.546 0.023 A 670 ALA HA H 1 3.792 0.023 A 670 ALA HB% H 1 1.431 0.023 A 670 ALA C C 13 179.261 0.125 A 670 ALA CA C 13 55.624 0.160 A 670 ALA CB C 13 18.217 0.138 A 670 ALA N N 15 120.299 0.109 A 671 ILE H H 1 8.475 0.023 A 671 ILE HA H 1 3.504 0.023 A 671 ILE HB H 1 1.877 0.023 A 671 ILE HG2% H 1 0.742 0.023 A 671 ILE C C 13 177.917 0.125 A 671 ILE CA C 13 65.549 0.160 A 671 ILE CB C 13 38.275 0.138 A 671 ILE CD1 C 13 13.420 . A 671 ILE CG1 C 13 30.035 . A 671 ILE CG2 C 13 17.844 . A 671 ILE N N 15 117.113 0.109 A 672 ALA H H 1 8.319 0.023 A 672 ALA HA H 1 3.806 0.023 A 672 ALA HB% H 1 1.325 0.023 A 672 ALA C C 13 178.417 0.125 A 672 ALA CA C 13 55.460 0.160 A 672 ALA CB C 13 18.331 0.138 A 672 ALA N N 15 121.366 0.109 A 673 LYS H H 1 7.837 0.023 A 673 LYS HA H 1 3.853 0.023 A 673 LYS HB2 H 1 1.236 0.023 A 673 LYS HB3 H 1 1.390 0.023 A 673 LYS HD2 H 1 1.293 0.023 A 673 LYS HD3 H 1 1.293 0.023 A 673 LYS HG2 H 1 0.765 0.023 A 673 LYS HG3 H 1 0.888 0.023 A 673 LYS C C 13 177.553 0.125 A 673 LYS CA C 13 56.925 0.160 A 673 LYS CB C 13 31.908 0.138 A 673 LYS CD C 13 28.258 . A 673 LYS CG C 13 24.299 . A 673 LYS N N 15 113.541 0.109 A 674 PHE H H 1 8.017 0.023 A 674 PHE HA H 1 4.472 0.023 A 674 PHE HB2 H 1 2.888 0.023 A 674 PHE HB3 H 1 3.075 0.023 A 674 PHE HD1 H 1 7.313 0.023 A 674 PHE HD2 H 1 7.048 0.023 A 674 PHE HE1 H 1 7.140 0.023 A 674 PHE HZ H 1 6.928 0.023 A 674 PHE C C 13 176.197 0.125 A 674 PHE CA C 13 59.660 0.160 A 674 PHE CB C 13 40.652 0.138 A 674 PHE CD1 C 13 132.018 . A 674 PHE CD2 C 13 130.881 . A 674 PHE N N 15 114.585 0.109 A 675 VAL H H 1 7.904 0.023 A 675 VAL HA H 1 3.846 0.023 A 675 VAL HB H 1 1.956 0.023 A 675 VAL HG1% H 1 0.727 0.023 A 675 VAL HG2% H 1 0.424 0.023 A 675 VAL C C 13 174.797 0.125 A 675 VAL CA C 13 63.900 0.160 A 675 VAL CB C 13 32.676 0.138 A 675 VAL CG1 C 13 21.862 . A 675 VAL N N 15 115.704 0.109 A 676 PHE H H 1 7.345 0.023 A 676 PHE HA H 1 4.310 0.023 A 676 PHE HB2 H 1 2.884 0.023 A 676 PHE HB3 H 1 3.148 0.023 A 676 PHE HD1 H 1 7.243 0.023 A 676 PHE HE1 H 1 7.059 0.023 A 676 PHE C C 13 178.780 0.125 A 676 PHE CA C 13 58.993 0.160 A 676 PHE CB C 13 40.426 0.138 A 676 PHE CD1 C 13 131.990 . A 676 PHE N N 15 121.992 0.109 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 671 ILE HA A 675 VAL H 1.0 0.0 4.56 2 2 A 671 ILE HA A 674 PHE H 1.0 0.0 4.28 3 3 A 655 GLY H A 656 ILE H 1.0 0.0 4.09 4 4 A 655 GLY H A 654 ALA HA 1.0 0.0 3.44 5 5 A 655 GLY H A 653 PRO HB2 1.0 0.0 5.29 6 5 A 655 GLY H A 653 PRO HB3 1.0 0.0 5.29 7 6 A 655 GLY H A 656 ILE HB 1.0 0.0 4.50 8 7 A 655 GLY H A 654 ALA HB% 1.0 0.0 3.56 9 8 A 655 GLY H A 656 ILE HG2% 1.0 0.0 4.80 10 9 A 655 GLY H A 651 TRP HA 1.0 0.0 4.72 11 10 A 657 GLY H A 660 GLY H 1.0 0.0 4.86 12 11 A 660 GLY H A 659 THR HB 1.0 0.0 4.63 13 12 A 656 ILE HB A 660 GLY H 1.0 0.0 5.21 14 13 A 639 GLY H A 640 ASP HA 1.0 0.0 4.71 15 14 A 639 GLY H A 638 GLN HA 1.0 0.0 3.25 16 15 A 639 GLY H A 639 GLY HA2 1.0 0.0 2.87 17 15 A 639 GLY H A 639 GLY HA3 1.0 0.0 2.87 18 16 A 639 GLY H A 640 ASP HB2 1.0 0.0 4.46 19 16 A 639 GLY H A 640 ASP HB3 1.0 0.0 4.46 20 17 A 639 GLY H A 638 GLN HG2 1.0 0.0 5.08 21 17 A 639 GLY H A 638 GLN HG3 1.0 0.0 5.08 22 18 A 639 GLY H A 638 GLN HB2 1.0 0.0 4.62 23 19 A 639 GLY H A 638 GLN HB3 1.0 0.0 4.62 24 20 A 656 ILE H A 657 GLY H 1.0 0.0 4.30 25 21 A 657 GLY H A 658 VAL HA 1.0 0.0 5.06 26 22 A 657 GLY H A 656 ILE HG12 1.0 0.0 5.01 27 23 A 657 GLY H A 656 ILE HG13 1.0 0.0 5.01 28 24 A 646 THR HG2% A 647 GLY H 1.0 0.0 4.16 29 25 A 657 GLY H A 658 VAL H 1.0 0.0 3.90 30 26 A 672 ALA H A 673 LYS H 1.0 0.0 3.98 31 27 A 673 LYS H A 674 PHE HA 1.0 0.0 5.50 32 28 A 673 LYS H A 674 PHE HB2 1.0 0.0 5.37 33 29 A 673 LYS H A 674 PHE HB3 1.0 0.0 5.37 34 30 A 673 LYS H A 671 ILE HB 1.0 0.0 5.09 35 31 A 647 GLY H A 646 THR H 1.0 0.0 4.18 36 32 A 646 THR H A 646 THR HB 1.0 0.0 3.63 37 33 A 646 THR H A 645 TRP HB2 1.0 0.0 4.91 38 34 A 646 THR H A 645 TRP HB3 1.0 0.0 4.91 39 35 A 646 THR HG2% A 646 THR H 1.0 0.0 3.80 40 36 A 650 GLN H A 652 ILE H 1.0 0.0 4.65 41 37 A 651 TRP HA A 650 GLN H 1.0 0.0 5.43 42 38 A 650 GLN H A 649 ARG HD2 1.0 0.0 5.50 43 38 A 650 GLN H A 649 ARG HD3 1.0 0.0 5.50 44 39 A 650 GLN H A 650 GLN HG2 1.0 0.0 4.08 45 39 A 650 GLN H A 650 GLN HG3 1.0 0.0 4.08 46 40 A 650 GLN H A 649 ARG HB2 1.0 0.0 4.91 47 41 A 650 GLN H A 649 ARG HB3 1.0 0.0 4.91 48 42 A 674 PHE H A 672 ALA H 1.0 0.0 5.07 49 43 A 674 PHE H A 674 PHE HB2 1.0 0.0 4.15 50 44 A 674 PHE H A 674 PHE HB3 1.0 0.0 4.15 51 45 A 674 PHE H A 671 ILE HB 1.0 0.0 4.99 52 46 A 659 THR H A 659 THR HG2% 1.0 0.0 4.22 53 47 A 659 THR H A 658 VAL HB 1.0 0.0 4.38 54 48 A 659 THR HB A 659 THR H 1.0 0.0 4.11 55 49 A 660 GLY H A 659 THR H 1.0 0.0 4.28 56 50 A 658 VAL H A 659 THR H 1.0 0.0 4.28 57 51 A 634 THR H A 635 LEU HA 1.0 0.0 4.03 58 52 A 634 THR H A 634 THR HB 1.0 0.0 3.73 59 53 A 634 THR H A 633 LYS HB2 1.0 0.0 4.90 60 54 A 634 THR H A 634 THR HG2% 1.0 0.0 4.17 61 55 A 675 VAL H A 676 PHE H 1.0 0.0 3.67 62 56 A 675 VAL H A 674 PHE HB3 1.0 0.0 4.18 63 57 A 675 VAL H A 672 ALA HB% 1.0 0.0 4.72 64 58 A 675 VAL H A 675 VAL HG1% 1.0 0.0 4.03 65 59 A 675 VAL H A 675 VAL HG2% 1.0 0.0 4.03 66 60 A 665 VAL H A 665 VAL HG2% 1.0 0.0 3.58 67 61 A 665 VAL H A 665 VAL HG1% 1.0 0.0 3.58 68 62 A 665 VAL H A 664 ALA HB% 1.0 0.0 3.65 69 63 A 665 VAL H A 666 ILE HB 1.0 0.0 4.22 70 64 A 665 VAL H A 665 VAL HB 1.0 0.0 3.70 71 65 A 665 VAL H A 667 ALA H 1.0 0.0 4.86 72 66 A 646 THR H A 645 TRP H 1.0 0.0 4.07 73 67 A 646 THR HB A 645 TRP H 1.0 0.0 5.50 74 68 A 645 TRP H A 644 TRP HB2 1.0 0.0 5.45 75 69 A 646 THR HG2% A 645 TRP H 1.0 0.0 5.50 76 70 A 652 ILE H A 651 TRP H 1.0 0.0 3.74 77 71 A 652 ILE H A 651 TRP HB3 1.0 0.0 5.08 78 72 A 652 ILE H A 653 PRO HG2 1.0 0.0 3.95 79 72 A 652 ILE H A 653 PRO HG3 1.0 0.0 3.95 80 73 A 656 ILE HB A 652 ILE H 1.0 0.0 4.42 81 74 A 656 ILE HG2% A 652 ILE H 1.0 0.0 3.93 82 75 A 650 GLN H A 649 ARG H 1.0 0.0 4.17 83 76 A 649 ARG H A 645 TRP HA 1.0 0.0 5.50 84 77 A 649 ARG H A 650 GLN HA 1.0 0.0 4.72 85 78 A 649 ARG H A 648 TRP HB2 1.0 0.0 5.12 86 78 A 649 ARG H A 648 TRP HB3 1.0 0.0 5.12 87 79 A 649 ARG H A 649 ARG HD2 1.0 0.0 4.81 88 79 A 649 ARG HD3 A 649 ARG H 1.0 0.0 4.81 89 80 A 649 ARG H A 650 GLN HB2 1.0 0.0 5.46 90 80 A 649 ARG H A 650 GLN HB3 1.0 0.0 5.46 91 81 A 649 ARG H A 649 ARG HG3 1.0 0.0 4.62 92 82 A 649 ARG H A 649 ARG HG2 1.0 0.0 4.62 93 83 A 676 PHE H A 675 VAL HB 1.0 0.0 4.39 94 84 A 648 TRP H A 648 TRP HB2 1.0 0.0 4.18 95 84 A 648 TRP HB3 A 648 TRP H 1.0 0.0 4.18 96 85 A 660 GLY H A 661 VAL H 1.0 0.0 3.76 97 86 A 661 VAL H A 661 VAL HB 1.0 0.0 3.75 98 87 A 661 VAL H A 663 ILE HB 1.0 0.0 5.09 99 88 A 664 ALA HB% A 661 VAL H 1.0 0.0 4.93 100 89 A 661 VAL H A 661 VAL HG1% 1.0 0.0 3.80 101 89 A 661 VAL H A 661 VAL HG2% 1.0 0.0 3.80 102 90 A 651 TRP H A 650 GLN HB2 1.0 0.0 4.10 103 90 A 651 TRP H A 650 GLN HB3 1.0 0.0 4.10 104 91 A 651 TRP H A 650 GLN HG2 1.0 0.0 4.76 105 91 A 650 GLN HG3 A 651 TRP H 1.0 0.0 4.76 106 92 A 651 TRP H A 651 TRP HB3 1.0 0.0 3.96 107 93 A 651 TRP H A 651 TRP HB2 1.0 0.0 3.96 108 94 A 656 ILE H A 656 ILE HG2% 1.0 0.0 4.74 109 95 A 656 ILE H A 656 ILE HG13 1.0 0.0 5.31 110 96 A 656 ILE H A 656 ILE HG12 1.0 0.0 5.31 111 97 A 634 THR HA A 635 LEU H 1.0 0.0 3.04 112 98 A 654 ALA H A 653 PRO HB2 1.0 0.0 4.61 113 98 A 653 PRO HB3 A 654 ALA H 1.0 0.0 4.61 114 99 A 654 ALA H A 653 PRO HG2 1.0 0.0 4.40 115 99 A 653 PRO HG3 A 654 ALA H 1.0 0.0 4.40 116 100 A 654 ALA HB% A 654 ALA H 1.0 0.0 3.18 117 101 A 632 ASP H A 632 ASP HB2 1.0 0.0 4.00 118 101 A 632 ASP H A 632 ASP HB3 1.0 0.0 4.00 119 102 A 669 PHE H A 670 ALA H 1.0 0.0 3.43 120 103 A 667 ALA H A 666 ILE H 1.0 0.0 3.69 121 104 A 670 ALA H A 669 PHE HB2 1.0 0.0 3.59 122 104 A 670 ALA H A 669 PHE HB3 1.0 0.0 3.59 123 105 A 666 ILE HB A 667 ALA H 1.0 0.0 3.66 124 106 A 667 ALA H A 666 ILE HG2% 1.0 0.0 3.49 125 107 A 670 ALA H A 670 ALA HB% 1.0 0.0 3.21 126 108 A 670 ALA H A 666 ILE HA 1.0 0.0 4.10 127 109 A 667 ALA H A 667 ALA HB% 1.0 0.0 3.34 128 110 A 670 ALA H A 666 ILE HG2% 1.0 0.0 3.75 129 111 A 672 ALA H A 671 ILE HG2% 1.0 0.0 3.72 130 112 A 672 ALA H A 671 ILE HB 1.0 0.0 3.80 131 113 A 660 GLY H A 658 VAL H 1.0 0.0 5.07 132 114 A 670 ALA HB% A 671 ILE H 1.0 0.0 3.75 133 115 A 671 ILE H A 668 LEU HD1% 1.0 0.0 3.49 134 115 A 671 ILE H A 668 LEU HD2% 1.0 0.0 3.49 135 116 A 672 ALA H A 671 ILE H 1.0 0.0 3.73 136 117 A 673 LYS H A 671 ILE H 1.0 0.0 5.14 137 118 A 665 VAL HA A 668 LEU H 1.0 0.0 4.34 138 119 A 668 LEU H A 669 PHE HB2 1.0 0.0 4.59 139 119 A 669 PHE HB3 A 668 LEU H 1.0 0.0 4.59 140 120 A 667 ALA HB% A 668 LEU H 1.0 0.0 3.36 141 121 A 668 LEU H A 668 LEU HD1% 1.0 0.0 3.55 142 121 A 668 LEU HD2% A 668 LEU H 1.0 0.0 3.55 143 122 A 666 ILE H A 668 LEU H 1.0 0.0 4.63 144 123 A 667 ALA H A 668 LEU H 1.0 0.0 3.88 145 124 A 664 ALA HB% A 663 ILE H 1.0 0.0 4.73 146 125 A 663 ILE HB A 663 ILE H 1.0 0.0 3.76 147 126 A 663 ILE H A 662 VAL HB 1.0 0.0 3.72 148 127 A 669 PHE H A 666 ILE HA 1.0 0.0 4.19 149 128 A 669 PHE H A 668 LEU HG 1.0 0.0 3.77 150 129 A 669 PHE H A 668 LEU HD1% 1.0 0.0 3.78 151 129 A 669 PHE H A 668 LEU HD2% 1.0 0.0 3.78 152 130 A 641 ASN H A 641 ASN HB2 1.0 0.0 3.01 153 130 A 641 ASN H A 641 ASN HB3 1.0 0.0 3.01 154 131 A 641 ASN H A 641 ASN HA 1.0 0.0 2.87 155 132 A 666 ILE H A 667 ALA HB% 1.0 0.0 4.24 156 133 A 666 ILE HB A 666 ILE H 1.0 0.0 3.54 157 134 A 661 VAL HB A 662 VAL H 1.0 0.0 3.46 158 135 A 661 VAL H A 662 VAL H 1.0 0.0 4.07 159 136 A 658 VAL HA A 662 VAL H 1.0 0.0 3.98 160 137 A 643 ASN H A 643 ASN HB3 1.0 0.0 3.60 161 138 A 666 ILE H A 664 ALA HA 1.0 0.0 4.66 162 139 A 665 VAL H A 666 ILE H 1.0 0.0 4.05 163 140 A 665 VAL HB A 666 ILE H 1.0 0.0 4.33 164 141 A 666 ILE H A 666 ILE HG2% 1.0 0.0 3.65 165 142 A 637 ASP H A 637 ASP HB2 1.0 0.0 3.17 166 142 A 637 ASP H A 637 ASP HB3 1.0 0.0 3.17 167 143 A 637 ASP H A 636 PRO HG3 1.0 0.0 4.58 168 144 A 637 ASP H A 636 PRO HB2 1.0 0.0 4.39 169 144 A 637 ASP H A 636 PRO HB3 1.0 0.0 4.39 170 145 A 640 ASP H A 639 GLY HA2 1.0 0.0 2.77 171 145 A 639 GLY HA3 A 640 ASP H 1.0 0.0 2.77 172 146 A 646 THR HG2% A 642 ASP H 1.0 0.0 5.06 173 147 A 637 ASP HA A 638 GLN H 1.0 0.0 2.90 174 148 A 638 GLN H A 637 ASP HB2 1.0 0.0 3.88 175 148 A 637 ASP HB3 A 638 GLN H 1.0 0.0 3.88 176 149 A 638 GLN H A 638 GLN HG2 1.0 0.0 3.91 177 149 A 638 GLN HG3 A 638 GLN H 1.0 0.0 3.91 178 150 A 663 ILE HB A 664 ALA H 1.0 0.0 3.84 179 151 A 664 ALA HB% A 664 ALA H 1.0 0.0 3.27 180 152 A 664 ALA H A 663 ILE HG2% 1.0 0.0 3.65 181 153 A 667 ALA H A 664 ALA H 1.0 0.0 5.27 182 154 A 633 LYS H A 633 LYS HG2 1.0 0.0 4.35 183 154 A 633 LYS H A 633 LYS HG3 1.0 0.0 4.35 184 155 A 633 LYS H A 632 ASP HA 1.0 0.0 3.31 185 156 A 645 TRP H A 644 TRP H 1.0 0.0 4.27 186 157 A 644 TRP H A 643 ASN HA 1.0 0.0 3.56 187 158 A 644 TRP H A 643 ASN HB2 1.0 0.0 4.54 188 159 A 644 TRP H A 643 ASN HB3 1.0 0.0 4.54 189 160 A 640 ASP H A 636 PRO HA 1.0 0.0 4.63 190 161 A 644 TRP H A 644 TRP HE1 1.0 0.0 5.50 191 162 A 651 TRP H A 651 TRP HE1 1.0 0.0 4.68 192 163 A 644 TRP HE1 A 636 PRO HB2 1.0 0.0 5.06 193 163 A 636 PRO HB3 A 644 TRP HE1 1.0 0.0 5.06 194 164 A 651 TRP HE1 A 650 GLN HG2 1.0 0.0 5.33 195 164 A 650 GLN HG3 A 651 TRP HE1 1.0 0.0 5.33 196 165 A 651 TRP HE1 A 650 GLN HB2 1.0 0.0 4.82 197 165 A 650 GLN HB3 A 651 TRP HE1 1.0 0.0 4.82 198 166 A 634 THR HG2% A 635 LEU H 1.0 0.0 4.67 199 167 A 646 THR H A 644 TRP H 1.0 0.0 4.15 200 168 A 658 VAL H A 661 VAL H 1.0 0.0 5.50 201 169 A 646 THR H A 643 ASN H 1.0 0.0 5.25 202 170 A 647 GLY H A 645 TRP H 1.0 0.0 5.50 203 171 A 644 TRP H A 648 TRP HE1 1.0 0.0 5.04 204 172 A 652 ILE H A 650 GLN HA 1.0 0.0 5.38 205 173 A 662 VAL H A 662 VAL HG1% 1.0 0.0 3.44 206 173 A 662 VAL H A 662 VAL HG2% 1.0 0.0 3.44 207 174 A 674 PHE H A 676 PHE H 1.0 0.0 4.55 208 175 A 646 THR HG2% A 648 TRP H 1.0 0.0 5.50 209 176 A 647 GLY H A 648 TRP H 1.0 0.0 4.11 210 177 A 666 ILE H A 669 PHE HB2 1.0 0.0 5.19 211 177 A 666 ILE H A 669 PHE HB3 1.0 0.0 5.19 212 178 A 656 ILE HG2% A 651 TRP H 1.0 0.0 4.61 213 179 A 652 ILE H A 649 ARG H 1.0 0.0 5.50 214 180 A 675 VAL H A 672 ALA H 1.0 0.0 5.35 215 181 A 646 THR HB A 644 TRP HE1 1.0 0.0 5.38 216 182 A 645 TRP HA A 645 TRP HE1 1.0 0.0 5.50 217 183 A 647 GLY H A 643 ASN H 1.0 0.0 5.40 218 184 A 639 GLY H A 642 ASP HA 1.0 0.0 4.61 219 185 A 663 ILE HG2% A 663 ILE HA 1.0 0.0 3.31 220 186 A 664 ALA HA A 663 ILE HG2% 1.0 0.0 3.62 221 187 A 664 ALA HB% A 663 ILE HG2% 1.0 0.0 3.47 222 188 A 656 ILE HG2% A 660 GLY HA2 1.0 0.0 3.80 223 188 A 656 ILE HG2% A 660 GLY HA3 1.0 0.0 3.80 224 189 A 670 ALA HB% A 667 ALA HA 1.0 0.0 3.11 225 190 A 663 ILE H A 663 ILE HG2% 1.0 0.0 3.47 226 191 A 675 VAL HA A 675 VAL HG2% 1.0 0.0 3.91 227 192 A 637 ASP H A 636 PRO HA 1.0 0.0 3.53 228 193 A 649 ARG HA A 650 GLN HB2 1.0 0.0 5.18 229 193 A 650 GLN HB3 A 649 ARG HA 1.0 0.0 5.18 230 194 A 649 ARG HA A 649 ARG HD2 1.0 0.0 5.50 231 194 A 649 ARG HD3 A 649 ARG HA 1.0 0.0 5.50 232 195 A 668 LEU HG A 669 PHE HB2 1.0 0.0 4.24 233 195 A 669 PHE HB3 A 668 LEU HG 1.0 0.0 4.24 234 196 A 666 ILE HA A 669 PHE HB2 1.0 0.0 4.05 235 196 A 669 PHE HB3 A 666 ILE HA 1.0 0.0 4.05 236 197 A 669 PHE H A 669 PHE HB2 1.0 0.0 3.20 237 197 A 669 PHE H A 669 PHE HB3 1.0 0.0 3.20 238 198 A 647 GLY H A 646 THR HB 1.0 0.0 4.72 239 199 A 646 THR HB A 650 GLN HG2 1.0 0.0 5.34 240 199 A 646 THR HB A 650 GLN HG3 1.0 0.0 5.34 241 200 A 670 ALA HB% A 669 PHE HB2 1.0 0.0 4.37 242 200 A 669 PHE HB3 A 670 ALA HB% 1.0 0.0 4.37 243 201 A 672 ALA H A 672 ALA HB% 1.0 0.0 3.24 244 202 A 633 LYS H A 632 ASP HB2 1.0 0.0 3.75 245 202 A 632 ASP HB3 A 633 LYS H 1.0 0.0 3.75 246 203 A 633 LYS H A 637 ASP HB2 1.0 0.0 3.60 247 203 A 637 ASP HB3 A 633 LYS H 1.0 0.0 3.60 248 204 A 664 ALA HB% A 662 VAL HA 1.0 0.0 5.50 249 205 A 661 VAL H A 662 VAL HA 1.0 0.0 5.50 250 206 A 663 ILE HB A 662 VAL HA 1.0 0.0 5.48 251 207 A 664 ALA HB% A 665 VAL HA 1.0 0.0 4.01 252 208 A 656 ILE HG2% A 656 ILE HA 1.0 0.0 3.52 253 209 A 668 LEU HG A 669 PHE HA 1.0 0.0 3.93 254 210 A 671 ILE HB A 671 ILE H 1.0 0.0 3.41 255 211 A 642 ASP H A 641 ASN HB2 1.0 0.0 4.26 256 211 A 641 ASN HB3 A 642 ASP H 1.0 0.0 4.26 257 212 A 631 SER HA A 632 ASP HB2 1.0 0.0 5.28 258 212 A 632 ASP HB3 A 631 SER HA 1.0 0.0 5.28 259 213 A 638 GLN HA A 638 GLN HG2 1.0 0.0 4.09 260 213 A 638 GLN HA A 638 GLN HG3 1.0 0.0 4.09 261 214 A 675 VAL H A 675 VAL HB 1.0 0.0 3.58 262 215 A 650 GLN H A 650 GLN HB2 1.0 0.0 3.58 263 215 A 650 GLN H A 650 GLN HB3 1.0 0.0 3.58 264 216 A 632 ASP H A 633 LYS HG2 1.0 0.0 4.90 265 216 A 632 ASP H A 633 LYS HG3 1.0 0.0 4.90 266 217 A 660 GLY H A 659 THR HG2% 1.0 0.0 3.82 267 218 A 659 THR HG2% A 660 GLY HA2 1.0 0.0 3.48 268 218 A 659 THR HG2% A 660 GLY HA3 1.0 0.0 3.48 269 219 A 659 THR HG2% A 659 THR HA 1.0 0.0 4.08 270 220 A 658 VAL HA A 658 VAL HG2% 1.0 0.0 3.42 271 221 A 671 ILE HA A 671 ILE HG2% 1.0 0.0 3.41 272 222 A 663 ILE HA A 662 VAL HG1% 1.0 0.0 3.49 273 222 A 662 VAL HG2% A 663 ILE HA 1.0 0.0 3.49 274 223 A 667 ALA HB% A 663 ILE HA 1.0 0.0 4.52 275 224 A 646 THR HA A 650 GLN HB2 1.0 0.0 4.61 276 224 A 650 GLN HB3 A 646 THR HA 1.0 0.0 4.61 277 225 A 668 LEU HG A 668 LEU HA 1.0 0.0 3.50 278 226 A 668 LEU HA A 668 LEU HD1% 1.0 0.0 3.46 279 226 A 668 LEU HD2% A 668 LEU HA 1.0 0.0 3.46 280 227 A 667 ALA H A 664 ALA HA 1.0 0.0 3.72 281 228 A 671 ILE HB A 672 ALA HA 1.0 0.0 4.31 282 229 A 635 LEU HA A 636 PRO HD2 1.0 0.0 4.05 283 230 A 663 ILE HB A 660 GLY HA2 1.0 0.0 4.95 284 230 A 663 ILE HB A 660 GLY HA3 1.0 0.0 4.95 285 231 A 660 GLY HA2 A 661 VAL HG1% 1.0 0.0 4.68 286 231 A 660 GLY HA3 A 661 VAL HG1% 1.0 0.0 4.68 287 231 A 661 VAL HG2% A 660 GLY HA2 1.0 0.0 4.68 288 231 A 661 VAL HG2% A 660 GLY HA3 1.0 0.0 4.68 289 232 A 657 GLY H A 660 GLY HA2 1.0 0.0 5.50 290 232 A 657 GLY H A 660 GLY HA3 1.0 0.0 5.50 291 233 A 654 ALA HB% A 655 GLY HA2 1.0 0.0 4.66 292 233 A 654 ALA HB% A 655 GLY HA3 1.0 0.0 4.66 293 234 A 633 LYS HG2 A 637 ASP HB2 1.0 0.0 3.59 294 234 A 633 LYS HG3 A 637 ASP HB2 1.0 0.0 3.59 295 234 A 637 ASP HB3 A 633 LYS HG2 1.0 0.0 3.59 296 234 A 637 ASP HB3 A 633 LYS HG3 1.0 0.0 3.59 297 235 A 656 ILE HB A 660 GLY HA2 1.0 0.0 4.69 298 235 A 656 ILE HB A 660 GLY HA3 1.0 0.0 4.69 299 236 A 656 ILE HB A 657 GLY H 1.0 0.0 4.28 300 237 A 666 ILE HG2% A 666 ILE HA 1.0 0.0 3.31 301 238 A 671 ILE HG2% A 671 ILE H 1.0 0.0 3.74 302 239 A 666 ILE HB A 662 VAL HG1% 1.0 0.0 3.30 303 239 A 666 ILE HB A 662 VAL HG2% 1.0 0.0 3.30 304 240 A 666 ILE HB A 667 ALA HB% 1.0 0.0 4.18 305 241 A 634 THR H A 632 ASP HB2 1.0 0.0 3.82 306 241 A 634 THR H A 632 ASP HB3 1.0 0.0 3.82 307 242 A 671 ILE HG2% A 672 ALA HA 1.0 0.0 3.74 308 243 A 634 THR H A 637 ASP HA 1.0 0.0 3.83 309 244 A 656 ILE H A 654 ALA HA 1.0 0.0 5.08 310 245 A 654 ALA HA A 653 PRO HG2 1.0 0.0 4.92 311 245 A 654 ALA HA A 653 PRO HG3 1.0 0.0 4.92 312 246 A 634 THR HB A 636 PRO HD2 1.0 0.0 4.73 313 247 A 634 THR HB A 636 PRO HD3 1.0 0.0 4.73 314 248 A 635 LEU HA A 636 PRO HD3 1.0 0.0 4.05 315 249 A 653 PRO HG3 A 655 GLY HA2 1.0 0.0 5.25 316 249 A 653 PRO HG2 A 655 GLY HA2 1.0 0.0 5.25 317 249 A 655 GLY HA3 A 653 PRO HG2 1.0 0.0 5.25 318 249 A 653 PRO HG3 A 655 GLY HA3 1.0 0.0 5.25 319 250 A 645 TRP H A 649 ARG HD2 1.0 0.0 4.40 320 250 A 649 ARG HD3 A 645 TRP H 1.0 0.0 4.40 321 251 A 637 ASP HA A 633 LYS HE2 1.0 0.0 4.84 322 251 A 637 ASP HA A 633 LYS HE3 1.0 0.0 4.84 323 252 A 632 ASP HA A 637 ASP HB2 1.0 0.0 3.45 324 252 A 637 ASP HB3 A 632 ASP HA 1.0 0.0 3.45 325 253 A 675 VAL H A 674 PHE HB2 1.0 0.0 4.18 326 254 A 643 ASN H A 643 ASN HB2 1.0 0.0 3.60 327 255 A 671 ILE HB A 672 ALA HB% 1.0 0.0 4.27 328 256 A 663 ILE HB A 659 THR HA 1.0 0.0 4.42 329 257 A 650 GLN HA A 650 GLN HG2 1.0 0.0 3.93 330 257 A 650 GLN HG3 A 650 GLN HA 1.0 0.0 3.93 331 258 A 634 THR H A 633 LYS HB3 1.0 0.0 4.90 332 259 A 658 VAL H A 658 VAL HB 1.0 0.0 3.57 333 260 A 661 VAL H A 662 VAL HB 1.0 0.0 4.29 334 261 A 672 ALA H A 673 LYS HD2 1.0 0.0 5.27 335 261 A 672 ALA H A 673 LYS HD3 1.0 0.0 5.27 336 262 A 645 TRP H A 644 TRP HB3 1.0 0.0 5.45 337 263 A 644 TRP H A 644 TRP HB3 1.0 0.0 4.04 338 264 A 644 TRP H A 644 TRP HB2 1.0 0.0 4.04 339 265 A 673 LYS HA A 673 LYS HD2 1.0 0.0 4.21 340 265 A 673 LYS HD3 A 673 LYS HA 1.0 0.0 4.21 341 266 A 637 ASP H A 636 PRO HG2 1.0 0.0 4.58 342 267 A 634 THR HA A 633 LYS HG2 1.0 0.0 4.65 343 267 A 634 THR HA A 633 LYS HG3 1.0 0.0 4.65 344 268 A 658 VAL HA A 658 VAL HG1% 1.0 0.0 3.42 345 269 A 675 VAL HA A 675 VAL HG1% 1.0 0.0 3.91 346 270 A 666 ILE HB A 670 ALA HB% 1.0 0.0 3.92 347 271 A 646 THR HB A 646 THR HA 1.0 0.0 2.91 348 272 A 651 TRP HA A 650 GLN HB2 1.0 0.0 4.69 349 272 A 651 TRP HA A 650 GLN HB3 1.0 0.0 4.69 350 273 A 634 THR H A 630 GLY HA2 1.0 0.0 4.43 351 273 A 634 THR H A 630 GLY HA3 1.0 0.0 4.43 352 274 A 659 THR HA A 660 GLY HA2 1.0 0.0 4.48 353 274 A 660 GLY HA3 A 659 THR HA 1.0 0.0 4.48 354 275 A 671 ILE HA A 672 ALA HB% 1.0 0.0 4.78 355 276 A 635 LEU HA A 637 ASP H 1.0 0.0 3.75 356 277 A 659 THR HG2% A 663 ILE HG2% 1.0 0.0 3.38 357 278 A 656 ILE HG2% A 649 ARG HA 1.0 0.0 4.65 358 279 A 638 GLN HA A 633 LYS HD2 1.0 0.0 4.27 359 279 A 638 GLN HA A 633 LYS HD3 1.0 0.0 4.27 360 280 A 652 ILE H A 651 TRP HB2 1.0 0.0 5.08 361 281 A 657 GLY H A 658 VAL HB 1.0 0.0 4.40 362 282 A 652 ILE H A 650 GLN HB2 1.0 0.0 5.26 363 282 A 652 ILE H A 650 GLN HB3 1.0 0.0 5.26 364 283 A 671 ILE HB A 676 PHE HE1 1.0 0.0 4.52 365 284 A 674 PHE HA A 674 PHE HD1 1.0 0.0 4.05 366 285 A 675 VAL HA A 674 PHE HD1 1.0 0.0 4.43 367 286 A 672 ALA HB% A 676 PHE HD1 1.0 0.0 4.60 368 287 A 675 VAL HB A 676 PHE HD1 1.0 0.0 4.65 369 288 A 673 LYS HA A 676 PHE HD1 1.0 0.0 4.21 370 289 A 676 PHE HD1 A 676 PHE HA 1.0 0.0 3.87 371 290 A 651 TRP H A 651 TRP HD1 1.0 0.0 3.88 372 291 A 651 TRP HA A 651 TRP HD1 1.0 0.0 4.20 373 292 A 643 ASN HA A 648 TRP HD1 1.0 0.0 4.92 374 293 A 645 TRP HA A 645 TRP HD1 1.0 0.0 4.75 375 294 A 674 PHE HD2 A 673 LYS HD2 1.0 0.0 4.55 376 294 A 673 LYS HD3 A 674 PHE HD2 1.0 0.0 4.55 377 295 A 633 LYS H A 633 LYS HB3 1.0 0.0 3.55 378 295 A 633 LYS H A 633 LYS HB2 1.0 0.0 3.55 379 296 A 634 THR H A 633 LYS HB3 1.0 0.0 4.29 380 296 A 634 THR H A 633 LYS HB2 1.0 0.0 4.29 381 297 A 633 LYS HD3 A 636 PRO HG2 1.0 0.0 3.78 382 297 A 636 PRO HG3 A 633 LYS HD2 1.0 0.0 3.78 383 297 A 633 LYS HD3 A 636 PRO HG3 1.0 0.0 3.78 384 297 A 633 LYS HD2 A 636 PRO HG2 1.0 0.0 3.78 385 298 A 634 THR H A 636 PRO HD3 1.0 0.0 5.35 386 298 A 634 THR H A 636 PRO HD2 1.0 0.0 5.35 387 299 A 634 THR HB A 636 PRO HD3 1.0 0.0 4.00 388 299 A 634 THR HB A 636 PRO HD2 1.0 0.0 4.00 389 300 A 635 LEU H A 635 LEU HB2 1.0 0.0 2.98 390 300 A 635 LEU H A 635 LEU HB3 1.0 0.0 2.98 391 301 A 635 LEU H A 635 LEU HD1% 1.0 0.0 4.72 392 301 A 635 LEU H A 635 LEU HD2% 1.0 0.0 4.72 393 302 A 635 LEU HA A 635 LEU HD1% 1.0 0.0 4.27 394 302 A 635 LEU HA A 635 LEU HD2% 1.0 0.0 4.27 395 303 A 635 LEU HA A 636 PRO HD3 1.0 0.0 3.48 396 303 A 635 LEU HA A 636 PRO HD2 1.0 0.0 3.48 397 304 A 635 LEU HB2 A 636 PRO HD3 1.0 0.0 4.11 398 304 A 636 PRO HD2 A 635 LEU HB2 1.0 0.0 4.11 399 304 A 636 PRO HD2 A 635 LEU HB3 1.0 0.0 4.11 400 304 A 635 LEU HB3 A 636 PRO HD3 1.0 0.0 4.11 401 305 A 637 ASP H A 635 LEU HB2 1.0 0.0 4.60 402 305 A 637 ASP H A 635 LEU HB3 1.0 0.0 4.60 403 306 A 635 LEU HD2% A 636 PRO HB2 1.0 0.0 3.27 404 306 A 635 LEU HD1% A 636 PRO HB2 1.0 0.0 3.27 405 306 A 636 PRO HB3 A 635 LEU HD1% 1.0 0.0 3.27 406 306 A 636 PRO HB3 A 635 LEU HD2% 1.0 0.0 3.27 407 307 A 635 LEU HD2% A 636 PRO HD3 1.0 0.0 4.52 408 307 A 635 LEU HD1% A 636 PRO HD3 1.0 0.0 4.52 409 307 A 636 PRO HD2 A 635 LEU HD1% 1.0 0.0 4.52 410 307 A 636 PRO HD2 A 635 LEU HD2% 1.0 0.0 4.52 411 308 A 635 LEU HD1% A 637 ASP HB2 1.0 0.0 3.99 412 308 A 635 LEU HD2% A 637 ASP HB2 1.0 0.0 3.99 413 308 A 637 ASP HB3 A 635 LEU HD1% 1.0 0.0 3.99 414 308 A 637 ASP HB3 A 635 LEU HD2% 1.0 0.0 3.99 415 309 A 637 ASP H A 636 PRO HG2 1.0 0.0 3.78 416 309 A 637 ASP H A 636 PRO HG3 1.0 0.0 3.78 417 310 A 644 TRP HE1 A 636 PRO HG2 1.0 0.0 4.91 418 310 A 644 TRP HE1 A 636 PRO HG3 1.0 0.0 4.91 419 311 A 637 ASP H A 636 PRO HD3 1.0 0.0 4.96 420 311 A 637 ASP H A 636 PRO HD2 1.0 0.0 4.96 421 312 A 637 ASP HA A 638 GLN HB3 1.0 0.0 4.30 422 312 A 637 ASP HA A 638 GLN HB2 1.0 0.0 4.30 423 313 A 638 GLN H A 638 GLN HB3 1.0 0.0 3.22 424 313 A 638 GLN H A 638 GLN HB2 1.0 0.0 3.22 425 314 A 642 ASP H A 638 GLN HB3 1.0 0.0 4.87 426 314 A 642 ASP H A 638 GLN HB2 1.0 0.0 4.87 427 315 A 642 ASP HA A 638 GLN HB3 1.0 0.0 4.47 428 315 A 642 ASP HA A 638 GLN HB2 1.0 0.0 4.47 429 316 A 642 ASP H A 642 ASP HB2 1.0 0.0 2.77 430 316 A 642 ASP H A 642 ASP HB3 1.0 0.0 2.77 431 317 A 642 ASP H A 643 ASN HB3 1.0 0.0 4.69 432 317 A 642 ASP H A 643 ASN HB2 1.0 0.0 4.69 433 318 A 643 ASN H A 642 ASP HB2 1.0 0.0 3.55 434 318 A 643 ASN H A 642 ASP HB3 1.0 0.0 3.55 435 319 A 643 ASN H A 643 ASN HB3 1.0 0.0 3.06 436 319 A 643 ASN H A 643 ASN HB2 1.0 0.0 3.06 437 320 A 643 ASN H A 647 GLY HA2 1.0 0.0 4.50 438 320 A 643 ASN H A 647 GLY HA3 1.0 0.0 4.50 439 321 A 644 TRP H A 643 ASN HB3 1.0 0.0 3.94 440 321 A 644 TRP H A 643 ASN HB2 1.0 0.0 3.94 441 322 A 644 TRP HD1 A 643 ASN HB3 1.0 0.0 4.88 442 322 A 643 ASN HB2 A 644 TRP HD1 1.0 0.0 4.88 443 323 A 645 TRP H A 643 ASN HB3 1.0 0.0 5.26 444 323 A 645 TRP H A 643 ASN HB2 1.0 0.0 5.26 445 324 A 646 THR H A 643 ASN HB3 1.0 0.0 4.42 446 324 A 646 THR H A 643 ASN HB2 1.0 0.0 4.42 447 325 A 646 THR HG2% A 643 ASN HB3 1.0 0.0 4.14 448 325 A 646 THR HG2% A 643 ASN HB2 1.0 0.0 4.14 449 326 A 643 ASN HB3 A 647 GLY HA2 1.0 0.0 5.18 450 326 A 643 ASN HB2 A 647 GLY HA2 1.0 0.0 5.18 451 326 A 647 GLY HA3 A 643 ASN HB3 1.0 0.0 5.18 452 326 A 643 ASN HB2 A 647 GLY HA3 1.0 0.0 5.18 453 327 A 644 TRP HE1 A 644 TRP HB3 1.0 0.0 4.53 454 327 A 644 TRP HE1 A 644 TRP HB2 1.0 0.0 4.53 455 328 A 644 TRP HZ3 A 645 TRP HB3 1.0 0.0 4.84 456 328 A 644 TRP HZ3 A 645 TRP HB2 1.0 0.0 4.84 457 329 A 646 THR HG2% A 647 GLY HA2 1.0 0.0 5.34 458 329 A 646 THR HG2% A 647 GLY HA3 1.0 0.0 5.34 459 330 A 648 TRP HD1 A 647 GLY HA2 1.0 0.0 4.43 460 330 A 648 TRP HD1 A 647 GLY HA3 1.0 0.0 4.43 461 331 A 650 GLN H A 647 GLY HA2 1.0 0.0 5.12 462 331 A 650 GLN H A 647 GLY HA3 1.0 0.0 5.12 463 332 A 647 GLY HA3 A 650 GLN HB2 1.0 0.0 5.34 464 332 A 647 GLY HA2 A 650 GLN HB2 1.0 0.0 5.34 465 332 A 650 GLN HB3 A 647 GLY HA2 1.0 0.0 5.34 466 332 A 650 GLN HB3 A 647 GLY HA3 1.0 0.0 5.34 467 333 A 651 TRP HE1 A 647 GLY HA2 1.0 0.0 4.81 468 333 A 651 TRP HE1 A 647 GLY HA3 1.0 0.0 4.81 469 334 A 648 TRP HE3 A 649 ARG HB2 1.0 0.0 4.75 470 334 A 648 TRP HE3 A 649 ARG HB3 1.0 0.0 4.75 471 335 A 648 TRP HE3 A 649 ARG HG3 1.0 0.0 4.83 472 335 A 648 TRP HE3 A 649 ARG HG2 1.0 0.0 4.83 473 336 A 649 ARG H A 649 ARG HG3 1.0 0.0 4.05 474 336 A 649 ARG H A 649 ARG HG2 1.0 0.0 4.05 475 337 A 650 GLN H A 649 ARG HB2 1.0 0.0 4.24 476 337 A 650 GLN H A 649 ARG HB3 1.0 0.0 4.24 477 338 A 651 TRP H A 649 ARG HB2 1.0 0.0 4.75 478 338 A 651 TRP H A 649 ARG HB3 1.0 0.0 4.75 479 339 A 650 GLN H A 649 ARG HG3 1.0 0.0 5.34 480 339 A 650 GLN H A 649 ARG HG2 1.0 0.0 5.34 481 340 A 650 GLN H A 651 TRP HB3 1.0 0.0 5.15 482 340 A 650 GLN H A 651 TRP HB2 1.0 0.0 5.15 483 341 A 651 TRP HE1 A 651 TRP HB3 1.0 0.0 4.52 484 341 A 651 TRP HE1 A 651 TRP HB2 1.0 0.0 4.52 485 342 A 652 ILE H A 651 TRP HB3 1.0 0.0 4.27 486 342 A 652 ILE H A 651 TRP HB2 1.0 0.0 4.27 487 343 A 655 GLY H A 651 TRP HB3 1.0 0.0 4.89 488 343 A 655 GLY H A 651 TRP HB2 1.0 0.0 4.89 489 344 A 652 ILE H A 656 ILE HG13 1.0 0.0 4.43 490 344 A 652 ILE H A 656 ILE HG12 1.0 0.0 4.43 491 345 A 654 ALA H A 658 VAL HG2% 1.0 0.0 5.40 492 345 A 654 ALA H A 658 VAL HG1% 1.0 0.0 5.40 493 346 A 654 ALA HA A 658 VAL HG2% 1.0 0.0 4.89 494 346 A 654 ALA HA A 658 VAL HG1% 1.0 0.0 4.89 495 347 A 656 ILE H A 656 ILE HG13 1.0 0.0 4.62 496 347 A 656 ILE H A 656 ILE HG12 1.0 0.0 4.62 497 348 A 656 ILE H A 657 GLY HA2 1.0 0.0 4.79 498 348 A 656 ILE H A 657 GLY HA3 1.0 0.0 4.79 499 349 A 656 ILE HG2% A 656 ILE HG13 1.0 0.0 3.26 500 349 A 656 ILE HG2% A 656 ILE HG12 1.0 0.0 3.26 501 350 A 656 ILE HG12 A 660 GLY HA2 1.0 0.0 5.34 502 350 A 656 ILE HG13 A 660 GLY HA2 1.0 0.0 5.34 503 350 A 660 GLY HA3 A 656 ILE HG13 1.0 0.0 5.34 504 350 A 660 GLY HA3 A 656 ILE HG12 1.0 0.0 5.34 505 351 A 657 GLY H A 658 VAL HG2% 1.0 0.0 3.98 506 351 A 657 GLY H A 658 VAL HG1% 1.0 0.0 3.98 507 352 A 661 VAL H A 657 GLY HA2 1.0 0.0 5.19 508 352 A 661 VAL H A 657 GLY HA3 1.0 0.0 5.19 509 353 A 658 VAL H A 658 VAL HG2% 1.0 0.0 3.45 510 353 A 658 VAL H A 658 VAL HG1% 1.0 0.0 3.45 511 354 A 658 VAL HA A 658 VAL HG2% 1.0 0.0 2.98 512 354 A 658 VAL HA A 658 VAL HG1% 1.0 0.0 2.98 513 355 A 659 THR H A 658 VAL HG2% 1.0 0.0 4.25 514 355 A 659 THR H A 658 VAL HG1% 1.0 0.0 4.25 515 356 A 659 THR HB A 658 VAL HG2% 1.0 0.0 3.37 516 356 A 659 THR HB A 658 VAL HG1% 1.0 0.0 3.37 517 357 A 660 GLY H A 658 VAL HG2% 1.0 0.0 4.69 518 357 A 660 GLY H A 658 VAL HG1% 1.0 0.0 4.69 519 358 A 662 VAL H A 665 VAL HG2% 1.0 0.0 3.27 520 358 A 662 VAL H A 665 VAL HG1% 1.0 0.0 3.27 521 359 A 662 VAL HA A 665 VAL HG2% 1.0 0.0 3.57 522 359 A 662 VAL HA A 665 VAL HG1% 1.0 0.0 3.57 523 360 A 663 ILE H A 665 VAL HG2% 1.0 0.0 3.87 524 360 A 663 ILE H A 665 VAL HG1% 1.0 0.0 3.87 525 361 A 664 ALA H A 665 VAL HG2% 1.0 0.0 3.99 526 361 A 664 ALA H A 665 VAL HG1% 1.0 0.0 3.99 527 362 A 665 VAL H A 665 VAL HG2% 1.0 0.0 3.08 528 362 A 665 VAL H A 665 VAL HG1% 1.0 0.0 3.08 529 363 A 665 VAL HA A 668 LEU HB2 1.0 0.0 4.02 530 363 A 665 VAL HA A 668 LEU HB3 1.0 0.0 4.02 531 364 A 668 LEU H A 665 VAL HG2% 1.0 0.0 4.69 532 364 A 668 LEU H A 665 VAL HG1% 1.0 0.0 4.69 533 365 A 665 VAL HG1% A 669 PHE HB2 1.0 0.0 4.11 534 365 A 665 VAL HG2% A 669 PHE HB2 1.0 0.0 4.11 535 365 A 669 PHE HB3 A 665 VAL HG2% 1.0 0.0 4.11 536 365 A 669 PHE HB3 A 665 VAL HG1% 1.0 0.0 4.11 537 366 A 666 ILE HA A 668 LEU HB2 1.0 0.0 4.56 538 366 A 666 ILE HA A 668 LEU HB3 1.0 0.0 4.56 539 367 A 668 LEU H A 668 LEU HB2 1.0 0.0 3.26 540 367 A 668 LEU H A 668 LEU HB3 1.0 0.0 3.26 541 368 A 669 PHE H A 668 LEU HB2 1.0 0.0 3.80 542 368 A 669 PHE H A 668 LEU HB3 1.0 0.0 3.80 543 369 A 669 PHE HA A 668 LEU HB2 1.0 0.0 4.58 544 369 A 669 PHE HA A 668 LEU HB3 1.0 0.0 4.58 545 370 A 668 LEU HB3 A 669 PHE HB2 1.0 0.0 4.54 546 370 A 668 LEU HB2 A 669 PHE HB2 1.0 0.0 4.54 547 370 A 669 PHE HB3 A 668 LEU HB2 1.0 0.0 4.54 548 370 A 669 PHE HB3 A 668 LEU HB3 1.0 0.0 4.54 549 371 A 669 PHE HA A 673 LYS HG2 1.0 0.0 4.19 550 371 A 669 PHE HA A 673 LYS HG3 1.0 0.0 4.19 551 372 A 670 ALA HB% A 673 LYS HG2 1.0 0.0 3.66 552 372 A 670 ALA HB% A 673 LYS HG3 1.0 0.0 3.66 553 373 A 671 ILE H A 674 PHE HB2 1.0 0.0 4.95 554 373 A 671 ILE H A 674 PHE HB3 1.0 0.0 4.95 555 374 A 671 ILE HA A 674 PHE HB2 1.0 0.0 4.38 556 374 A 671 ILE HA A 674 PHE HB3 1.0 0.0 4.38 557 375 A 672 ALA H A 673 LYS HB2 1.0 0.0 5.34 558 375 A 672 ALA H A 673 LYS HB3 1.0 0.0 5.34 559 376 A 672 ALA HB% A 673 LYS HG2 1.0 0.0 3.38 560 376 A 672 ALA HB% A 673 LYS HG3 1.0 0.0 3.38 561 377 A 673 LYS H A 673 LYS HB2 1.0 0.0 3.16 562 377 A 673 LYS H A 673 LYS HB3 1.0 0.0 3.16 563 378 A 673 LYS H A 673 LYS HG2 1.0 0.0 3.70 564 378 A 673 LYS H A 673 LYS HG3 1.0 0.0 3.70 565 379 A 673 LYS H A 674 PHE HB2 1.0 0.0 4.69 566 379 A 673 LYS H A 674 PHE HB3 1.0 0.0 4.69 567 380 A 673 LYS HA A 673 LYS HG2 1.0 0.0 3.27 568 380 A 673 LYS HA A 673 LYS HG3 1.0 0.0 3.27 569 381 A 674 PHE H A 673 LYS HB2 1.0 0.0 4.06 570 381 A 674 PHE H A 673 LYS HB3 1.0 0.0 4.06 571 382 A 673 LYS HB3 A 674 PHE HB2 1.0 0.0 4.82 572 382 A 673 LYS HB2 A 674 PHE HB2 1.0 0.0 4.82 573 382 A 674 PHE HB3 A 673 LYS HB2 1.0 0.0 4.82 574 382 A 674 PHE HB3 A 673 LYS HB3 1.0 0.0 4.82 575 383 A 674 PHE H A 673 LYS HG2 1.0 0.0 4.20 576 383 A 674 PHE H A 673 LYS HG3 1.0 0.0 4.20 577 384 A 673 LYS HG2 A 674 PHE HB2 1.0 0.0 4.81 578 384 A 673 LYS HG3 A 674 PHE HB2 1.0 0.0 4.81 579 384 A 674 PHE HB3 A 673 LYS HG2 1.0 0.0 4.81 580 384 A 673 LYS HG3 A 674 PHE HB3 1.0 0.0 4.81 581 385 A 673 LYS HD3 A 674 PHE HB2 1.0 0.0 5.28 582 385 A 673 LYS HD2 A 674 PHE HB2 1.0 0.0 5.28 583 385 A 674 PHE HB3 A 673 LYS HD2 1.0 0.0 5.28 584 385 A 673 LYS HD3 A 674 PHE HB3 1.0 0.0 5.28 585 386 A 674 PHE H A 674 PHE HB2 1.0 0.0 3.62 586 386 A 674 PHE H A 674 PHE HB3 1.0 0.0 3.62 587 387 A 674 PHE H A 675 VAL HG2% 1.0 0.0 5.21 588 387 A 674 PHE H A 675 VAL HG1% 1.0 0.0 5.21 589 388 A 675 VAL HA A 674 PHE HB2 1.0 0.0 4.99 590 388 A 675 VAL HA A 674 PHE HB3 1.0 0.0 4.99 591 389 A 675 VAL HB A 674 PHE HB2 1.0 0.0 5.19 592 389 A 675 VAL HB A 674 PHE HB3 1.0 0.0 5.19 593 390 A 676 PHE H A 674 PHE HB2 1.0 0.0 4.43 594 390 A 676 PHE H A 674 PHE HB3 1.0 0.0 4.43 595 391 A 675 VAL H A 675 VAL HG2% 1.0 0.0 3.24 596 391 A 675 VAL H A 675 VAL HG1% 1.0 0.0 3.24 597 392 A 675 VAL HA A 675 VAL HG2% 1.0 0.0 3.05 598 392 A 675 VAL HA A 675 VAL HG1% 1.0 0.0 3.05 599 393 A 676 PHE HD1 A 675 VAL HG2% 1.0 0.0 4.39 600 393 A 676 PHE HD1 A 675 VAL HG1% 1.0 0.0 4.39 601 394 A 676 PHE H A 676 PHE HB2 1.0 0.0 3.66 602 394 A 676 PHE H A 676 PHE HB3 1.0 0.0 3.66 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 642 ASP C A 643 ASN N A 643 ASN CA A 643 ASN C 1.0 -99.2 -40.6 PHI 2 2 A 643 ASN N A 643 ASN CA A 643 ASN C A 644 TRP N 1.0 -60.2 -16.6 PSI 3 3 A 643 ASN C A 644 TRP N A 644 TRP CA A 644 TRP C 1.0 -88.6 -48.6 PHI 4 4 A 644 TRP N A 644 TRP CA A 644 TRP C A 645 TRP N 1.0 -58.0 -12.2 PSI 5 5 A 647 GLY C A 648 TRP N A 648 TRP CA A 648 TRP C 1.0 -86.1 -46.1 PHI 6 6 A 648 TRP N A 648 TRP CA A 648 TRP C A 649 ARG N 1.0 -61.6 -21.6 PSI 7 7 A 648 TRP C A 649 ARG N A 649 ARG CA A 649 ARG C 1.0 -85.8 -45.8 PHI 8 8 A 649 ARG N A 649 ARG CA A 649 ARG C A 650 GLN N 1.0 -52.2 -12.2 PSI 9 9 A 649 ARG C A 650 GLN N A 650 GLN CA A 650 GLN C 1.0 -99.2 -44.6 PHI 10 10 A 650 GLN N A 650 GLN CA A 650 GLN C A 651 TRP N 1.0 -60.2 18.8 PSI 11 11 A 654 ALA C A 655 GLY N A 655 GLY CA A 655 GLY C 1.0 45.5 103.5 PHI 12 12 A 655 GLY N A 655 GLY CA A 655 GLY C A 656 ILE N 1.0 -1.7 50.1 PSI 13 13 A 655 GLY C A 656 ILE N A 656 ILE CA A 656 ILE C 1.0 -113.7 -73.7 PHI 14 14 A 656 ILE N A 656 ILE CA A 656 ILE C A 657 GLY N 1.0 -39.2 30.6 PSI 15 15 A 657 GLY C A 658 VAL N A 658 VAL CA A 658 VAL C 1.0 -81.8 -41.8 PHI 16 16 A 658 VAL N A 658 VAL CA A 658 VAL C A 659 THR N 1.0 -60.4 -20.4 PSI 17 17 A 659 THR C A 660 GLY N A 660 GLY CA A 660 GLY C 1.0 -81.8 -41.8 PHI 18 18 A 660 GLY N A 660 GLY CA A 660 GLY C A 661 VAL N 1.0 -59.9 -19.9 PSI 19 19 A 660 GLY C A 661 VAL N A 661 VAL CA A 661 VAL C 1.0 -80.9 -38.5 PHI 20 20 A 661 VAL N A 661 VAL CA A 661 VAL C A 662 VAL N 1.0 -66.7 -26.7 PSI 21 21 A 661 VAL C A 662 VAL N A 662 VAL CA A 662 VAL C 1.0 -82.1 -42.1 PHI 22 22 A 662 VAL N A 662 VAL CA A 662 VAL C A 663 ILE N 1.0 -63.2 -23.2 PSI 23 23 A 662 VAL C A 663 ILE N A 663 ILE CA A 663 ILE C 1.0 -82.7 -42.7 PHI 24 24 A 663 ILE N A 663 ILE CA A 663 ILE C A 664 ALA N 1.0 -61.9 -21.9 PSI 25 25 A 663 ILE C A 664 ALA N A 664 ALA CA A 664 ALA C 1.0 -81.3 -41.3 PHI 26 26 A 664 ALA N A 664 ALA CA A 664 ALA C A 665 VAL N 1.0 -60.5 -20.5 PSI 27 27 A 664 ALA C A 665 VAL N A 665 VAL CA A 665 VAL C 1.0 -83.7 -43.7 PHI 28 28 A 665 VAL N A 665 VAL CA A 665 VAL C A 666 ILE N 1.0 -63.3 -23.3 PSI 29 29 A 665 VAL C A 666 ILE N A 666 ILE CA A 666 ILE C 1.0 -84.6 -44.6 PHI 30 30 A 666 ILE N A 666 ILE CA A 666 ILE C A 667 ALA N 1.0 -61.8 -21.8 PSI 31 31 A 666 ILE C A 667 ALA N A 667 ALA CA A 667 ALA C 1.0 -79.0 -39.0 PHI 32 32 A 667 ALA N A 667 ALA CA A 667 ALA C A 668 LEU N 1.0 -62.7 -22.7 PSI 33 33 A 667 ALA C A 668 LEU N A 668 LEU CA A 668 LEU C 1.0 -84.5 -44.5 PHI 34 34 A 668 LEU N A 668 LEU CA A 668 LEU C A 669 PHE N 1.0 -62.6 -22.6 PSI 35 35 A 668 LEU C A 669 PHE N A 669 PHE CA A 669 PHE C 1.0 -84.8 -44.8 PHI 36 36 A 669 PHE N A 669 PHE CA A 669 PHE C A 670 ALA N 1.0 -64.6 -24.6 PSI 37 37 A 669 PHE C A 670 ALA N A 670 ALA CA A 670 ALA C 1.0 -80.8 -40.8 PHI 38 38 A 670 ALA N A 670 ALA CA A 670 ALA C A 671 ILE N 1.0 -62.0 -22.0 PSI 39 39 A 670 ALA C A 671 ILE N A 671 ILE CA A 671 ILE C 1.0 -86.0 -46.0 PHI 40 40 A 671 ILE N A 671 ILE CA A 671 ILE C A 672 ALA N 1.0 -60.6 -20.6 PSI 41 41 A 671 ILE C A 672 ALA N A 672 ALA CA A 672 ALA C 1.0 -83.3 -43.3 PHI 42 42 A 672 ALA N A 672 ALA CA A 672 ALA C A 673 LYS N 1.0 -62.5 -22.5 PSI 43 43 A 672 ALA C A 673 LYS N A 673 LYS CA A 673 LYS C 1.0 -89.6 -44.8 PHI 44 44 A 673 LYS N A 673 LYS CA A 673 LYS C A 674 PHE N 1.0 -58.1 -18.1 PSI stop_ save_