data_nef_c19512_2me1 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 2PV6 BMRB 15605 BMRB 19513 BMRB 19514 BMRB 19515 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 657 GLU start . . 2 A 658 GLN middle . . 3 A 659 GLU middle . . 4 A 660 LEU middle . . 5 A 661 LEU middle . . 6 A 662 GLU middle . . 7 A 663 LEU middle . . 8 A 664 ASP middle . . 9 A 665 LYS middle . . 10 A 666 TRP middle . . 11 A 667 ALA middle . . 12 A 668 SER middle . . 13 A 669 LEU middle . . 14 A 670 TRP middle . . 15 A 671 ALA middle . . 16 A 672 TRP middle . . 17 A 673 PHE middle . . 18 A 674 ALA middle . . 19 A 675 ILE middle . . 20 A 676 THR middle . . 21 A 677 ASN middle . . 22 A 678 TRP middle . . 23 A 679 LEU middle . . 24 A 680 TRP middle . . 25 A 681 TYR middle . . 26 A 682 ILE middle . . 27 A 683 LYS end . . 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 657 GLU HA H 1 4.043 0.000 A 657 GLU HBy H 1 2.132 0.000 A 657 GLU HBx H 1 2.063 0.000 A 657 GLU HG2 H 1 2.382 0.000 A 657 GLU HG3 H 1 2.382 0.000 A 657 GLU CA C 13 56.090 0.000 A 657 GLU CB C 13 30.523 0.000 A 657 GLU CG C 13 36.054 0.000 A 658 GLN HA H 1 4.323 0.000 A 658 GLN HBy H 1 2.120 0.000 A 658 GLN HBx H 1 2.052 0.000 A 658 GLN HE2y H 1 7.595 0.000 A 658 GLN HE2x H 1 6.826 0.000 A 658 GLN HG2 H 1 2.355 0.000 A 658 GLN HG3 H 1 2.355 0.000 A 658 GLN C C 13 175.454 0.000 A 658 GLN CA C 13 56.398 0.000 A 658 GLN CB C 13 29.275 0.000 A 658 GLN CG C 13 33.907 0.000 A 658 GLN NE2 N 15 111.980 0.000 A 659 GLU H H 1 8.705 0.000 A 659 GLU HA H 1 4.282 0.000 A 659 GLU HBy H 1 2.044 0.000 A 659 GLU HBx H 1 1.945 0.000 A 659 GLU HG2 H 1 2.279 0.000 A 659 GLU HG3 H 1 2.279 0.000 A 659 GLU C C 13 176.491 0.000 A 659 GLU CA C 13 57.090 0.000 A 659 GLU CB C 13 30.180 0.000 A 659 GLU CG C 13 36.405 0.000 A 659 GLU N N 15 122.875 0.000 A 660 LEU H H 1 8.446 0.000 A 660 LEU HA H 1 4.303 0.000 A 660 LEU HBy H 1 1.699 0.000 A 660 LEU HBx H 1 1.599 0.000 A 660 LEU HDx% H 1 0.947 0.000 A 660 LEU HDy% H 1 0.885 0.000 A 660 LEU HG H 1 1.661 0.000 A 660 LEU C C 13 176.867 0.000 A 660 LEU CA C 13 55.876 0.000 A 660 LEU CB C 13 42.573 0.000 A 660 LEU CD1 C 13 25.066 0.000 A 660 LEU CD2 C 13 24.001 0.000 A 660 LEU CG C 13 27.126 0.000 A 660 LEU N N 15 122.615 0.000 A 661 LEU H H 1 8.083 0.000 A 661 LEU HA H 1 4.386 0.000 A 661 LEU HBy H 1 1.639 0.000 A 661 LEU HBx H 1 1.580 0.000 A 661 LEU HDx% H 1 0.880 0.000 A 661 LEU HDy% H 1 0.837 0.000 A 661 LEU HG H 1 1.617 0.000 A 661 LEU C C 13 176.745 0.000 A 661 LEU CA C 13 54.982 0.000 A 661 LEU CB C 13 42.712 0.000 A 661 LEU CD1 C 13 25.155 0.000 A 661 LEU CD2 C 13 24.057 0.000 A 661 LEU CG C 13 27.181 0.000 A 661 LEU N N 15 120.426 0.000 A 662 GLU H H 1 8.290 0.000 A 662 GLU HA H 1 4.365 0.000 A 662 GLU HBy H 1 2.116 0.000 A 662 GLU HBx H 1 1.988 0.000 A 662 GLU HGy H 1 2.284 0.000 A 662 GLU HGx H 1 2.235 0.000 A 662 GLU C C 13 176.785 0.000 A 662 GLU CA C 13 56.426 0.000 A 662 GLU CB C 13 29.979 0.000 A 662 GLU CG C 13 36.464 0.000 A 662 GLU N N 15 121.380 0.000 A 663 LEU H H 1 8.295 0.000 A 663 LEU HA H 1 4.176 0.000 A 663 LEU HBy H 1 1.723 0.000 A 663 LEU HBx H 1 1.625 0.000 A 663 LEU HDx% H 1 0.922 0.000 A 663 LEU HDy% H 1 0.850 0.000 A 663 LEU HG H 1 1.708 0.000 A 663 LEU C C 13 177.682 0.000 A 663 LEU CA C 13 56.932 0.000 A 663 LEU CB C 13 42.377 0.000 A 663 LEU CD1 C 13 25.172 0.000 A 663 LEU CD2 C 13 24.002 0.000 A 663 LEU CG C 13 27.136 0.000 A 663 LEU N N 15 122.863 0.000 A 664 ASP H H 1 8.524 0.000 A 664 ASP HA H 1 4.469 0.000 A 664 ASP HB2 H 1 2.733 0.000 A 664 ASP HB3 H 1 2.733 0.000 A 664 ASP C C 13 177.764 0.000 A 664 ASP CA C 13 55.797 0.000 A 664 ASP CB C 13 40.721 0.000 A 664 ASP N N 15 118.481 0.000 A 665 LYS H H 1 8.029 0.000 A 665 LYS HA H 1 4.101 0.000 A 665 LYS HBy H 1 1.743 0.000 A 665 LYS HBx H 1 1.667 0.000 A 665 LYS HD2 H 1 1.550 0.000 A 665 LYS HD3 H 1 1.550 0.000 A 665 LYS HE2 H 1 2.837 0.000 A 665 LYS HE3 H 1 2.837 0.000 A 665 LYS HGy H 1 1.237 0.000 A 665 LYS HGx H 1 1.181 0.000 A 665 LYS C C 13 177.845 0.000 A 665 LYS CA C 13 58.259 0.000 A 665 LYS CB C 13 32.295 0.000 A 665 LYS CD C 13 29.053 0.000 A 665 LYS CE C 13 42.010 0.000 A 665 LYS CG C 13 24.791 0.000 A 665 LYS N N 15 120.499 0.000 A 666 TRP H H 1 7.927 0.000 A 666 TRP HA H 1 4.530 0.000 A 666 TRP HBy H 1 3.423 0.000 A 666 TRP HBx H 1 3.254 0.000 A 666 TRP HD1 H 1 7.389 0.000 A 666 TRP HE1 H 1 10.593 0.000 A 666 TRP HE3 H 1 7.510 0.000 A 666 TRP HH2 H 1 7.068 0.000 A 666 TRP HZ2 H 1 7.463 0.000 A 666 TRP HZ3 H 1 6.929 0.000 A 666 TRP C C 13 177.158 0.000 A 666 TRP CA C 13 58.936 0.000 A 666 TRP CB C 13 29.208 0.000 A 666 TRP CD1 C 13 127.533 0.000 A 666 TRP CE3 C 13 120.594 0.000 A 666 TRP CH2 C 13 123.810 0.000 A 666 TRP CZ2 C 13 114.592 0.000 A 666 TRP CZ3 C 13 121.282 0.000 A 666 TRP N N 15 119.813 0.000 A 666 TRP NE1 N 15 129.867 0.000 A 667 ALA H H 1 8.166 0.000 A 667 ALA HA H 1 4.130 0.000 A 667 ALA HB% H 1 1.516 0.000 A 667 ALA C C 13 180.006 0.000 A 667 ALA CA C 13 55.167 0.000 A 667 ALA CB C 13 18.602 0.000 A 667 ALA N N 15 121.451 0.000 A 668 SER H H 1 8.145 0.000 A 668 SER HA H 1 4.308 0.000 A 668 SER HBy H 1 3.990 0.000 A 668 SER HBx H 1 3.905 0.000 A 668 SER C C 13 176.031 0.000 A 668 SER CA C 13 61.301 0.000 A 668 SER CB C 13 63.049 0.000 A 668 SER N N 15 113.231 0.000 A 669 LEU H H 1 7.856 0.000 A 669 LEU HA H 1 4.174 0.000 A 669 LEU HBy H 1 1.762 0.000 A 669 LEU HBx H 1 1.683 0.000 A 669 LEU HDx% H 1 0.846 0.000 A 669 LEU HDy% H 1 0.789 0.000 A 669 LEU HG H 1 1.588 0.000 A 669 LEU C C 13 178.390 0.000 A 669 LEU CA C 13 57.880 0.000 A 669 LEU CB C 13 41.912 0.000 A 669 LEU CD1 C 13 24.996 0.000 A 669 LEU CD2 C 13 24.644 0.000 A 669 LEU CG C 13 27.181 0.000 A 669 LEU N N 15 122.954 0.000 A 670 TRP H H 1 8.058 0.000 A 670 TRP HA H 1 4.558 0.000 A 670 TRP HBy H 1 3.435 0.000 A 670 TRP HBx H 1 3.300 0.000 A 670 TRP HD1 H 1 7.230 0.000 A 670 TRP HE1 H 1 10.276 0.000 A 670 TRP HE3 H 1 7.554 0.000 A 670 TRP HH2 H 1 7.054 0.000 A 670 TRP HZ2 H 1 7.446 0.000 A 670 TRP HZ3 H 1 6.878 0.000 A 670 TRP C C 13 177.987 0.000 A 670 TRP CA C 13 60.048 0.000 A 670 TRP CB C 13 29.500 0.000 A 670 TRP CD1 C 13 127.701 0.000 A 670 TRP CE3 C 13 120.690 0.000 A 670 TRP CH2 C 13 123.848 0.000 A 670 TRP CZ2 C 13 114.583 0.000 A 670 TRP CZ3 C 13 121.282 0.000 A 670 TRP N N 15 118.401 0.000 A 670 TRP NE1 N 15 129.298 0.000 A 671 ALA H H 1 8.022 0.000 A 671 ALA HA H 1 4.091 0.000 A 671 ALA HB% H 1 1.493 0.000 A 671 ALA C C 13 179.353 0.000 A 671 ALA CA C 13 54.865 0.000 A 671 ALA CB C 13 18.397 0.000 A 671 ALA N N 15 120.051 0.000 A 672 TRP H H 1 7.933 0.000 A 672 TRP HA H 1 4.331 0.000 A 672 TRP HBy H 1 3.385 0.000 A 672 TRP HBx H 1 3.305 0.000 A 672 TRP HD1 H 1 7.169 0.000 A 672 TRP HE1 H 1 10.342 0.000 A 672 TRP HE3 H 1 7.335 0.000 A 672 TRP HH2 H 1 7.059 0.000 A 672 TRP HZ2 H 1 7.426 0.000 A 672 TRP HZ3 H 1 6.873 0.000 A 672 TRP C C 13 177.849 0.000 A 672 TRP CA C 13 60.326 0.000 A 672 TRP CB C 13 29.265 0.000 A 672 TRP CD1 C 13 126.789 0.000 A 672 TRP CE3 C 13 120.401 0.000 A 672 TRP CH2 C 13 123.819 0.000 A 672 TRP CZ2 C 13 114.568 0.000 A 672 TRP CZ3 C 13 121.290 0.000 A 672 TRP N N 15 118.053 0.000 A 672 TRP NE1 N 15 129.726 0.000 A 673 PHE H H 1 8.156 0.000 A 673 PHE HA H 1 4.117 0.000 A 673 PHE HBy H 1 3.157 0.000 A 673 PHE HBx H 1 3.090 0.000 A 673 PHE HD1 H 1 7.204 0.000 A 673 PHE HD2 H 1 7.204 0.000 A 673 PHE HE1 H 1 7.200 0.000 A 673 PHE HE2 H 1 7.200 0.000 A 673 PHE HZ H 1 7.143 0.000 A 673 PHE C C 13 176.493 0.000 A 673 PHE CA C 13 60.158 0.000 A 673 PHE CB C 13 39.143 0.000 A 673 PHE CD1 C 13 131.742 0.000 A 673 PHE CE1 C 13 130.957 0.000 A 673 PHE CZ C 13 129.204 0.000 A 673 PHE N N 15 118.403 0.000 A 674 ALA H H 1 7.894 0.000 A 674 ALA HA H 1 4.081 0.000 A 674 ALA HB% H 1 1.319 0.000 A 674 ALA C C 13 178.757 0.000 A 674 ALA CA C 13 54.073 0.000 A 674 ALA CB C 13 18.369 0.000 A 674 ALA N N 15 120.989 0.000 A 675 ILE H H 1 7.817 0.000 A 675 ILE HA H 1 3.903 0.000 A 675 ILE HB H 1 1.829 0.000 A 675 ILE HD1% H 1 0.822 0.000 A 675 ILE HG1y H 1 1.504 0.000 A 675 ILE HG1x H 1 1.198 0.000 A 675 ILE HG2% H 1 0.846 0.000 A 675 ILE C C 13 176.905 0.000 A 675 ILE CA C 13 63.030 0.000 A 675 ILE CB C 13 38.441 0.000 A 675 ILE CD1 C 13 13.768 0.000 A 675 ILE CG1 C 13 28.348 0.000 A 675 ILE CG2 C 13 17.836 0.000 A 675 ILE N N 15 116.059 0.000 A 676 THR H H 1 7.714 0.000 A 676 THR HA H 1 3.879 0.000 A 676 THR HB H 1 3.844 0.000 A 676 THR HG2% H 1 0.807 0.000 A 676 THR C C 13 175.302 0.000 A 676 THR CA C 13 64.650 0.000 A 676 THR CB C 13 69.044 0.000 A 676 THR CG2 C 13 21.492 0.000 A 676 THR N N 15 113.208 0.000 A 677 ASN H H 1 7.976 0.000 A 677 ASN HA H 1 4.552 0.000 A 677 ASN HB2 H 1 2.603 0.000 A 677 ASN HB3 H 1 2.603 0.000 A 677 ASN HD2y H 1 7.239 0.000 A 677 ASN HD2x H 1 6.633 0.000 A 677 ASN C C 13 175.961 0.000 A 677 ASN CA C 13 54.780 0.000 A 677 ASN CB C 13 38.428 0.000 A 677 ASN N N 15 119.245 0.000 A 677 ASN ND2 N 15 111.865 0.000 A 678 TRP H H 1 7.801 0.000 A 678 TRP HA H 1 4.580 0.000 A 678 TRP HBy H 1 3.340 0.000 A 678 TRP HBx H 1 3.274 0.000 A 678 TRP HD1 H 1 7.220 0.000 A 678 TRP HE1 H 1 10.303 0.000 A 678 TRP HE3 H 1 7.454 0.000 A 678 TRP HH2 H 1 7.058 0.000 A 678 TRP HZ2 H 1 7.379 0.000 A 678 TRP HZ3 H 1 6.930 0.000 A 678 TRP C C 13 176.863 0.000 A 678 TRP CA C 13 58.992 0.000 A 678 TRP CB C 13 29.686 0.000 A 678 TRP CD1 C 13 126.813 0.000 A 678 TRP CE3 C 13 120.401 0.000 A 678 TRP CH2 C 13 123.863 0.000 A 678 TRP CZ2 C 13 114.425 0.000 A 678 TRP CZ3 C 13 121.230 0.000 A 678 TRP N N 15 119.308 0.000 A 678 TRP NE1 N 15 129.488 0.000 A 679 LEU H H 1 7.769 0.000 A 679 LEU HA H 1 3.968 0.000 A 679 LEU HBy H 1 1.515 0.000 A 679 LEU HBx H 1 1.329 0.000 A 679 LEU HDx% H 1 0.811 0.000 A 679 LEU HDy% H 1 0.726 0.000 A 679 LEU HG H 1 1.523 0.000 A 679 LEU C C 13 177.391 0.000 A 679 LEU CA C 13 56.758 0.000 A 679 LEU CB C 13 41.751 0.000 A 679 LEU CD1 C 13 25.293 0.000 A 679 LEU CD2 C 13 23.828 0.000 A 679 LEU CG C 13 26.904 0.000 A 679 LEU N N 15 117.827 0.000 A 680 TRP H H 1 7.531 0.000 A 680 TRP HA H 1 4.343 0.000 A 680 TRP HBy H 1 3.196 0.000 A 680 TRP HBx H 1 3.123 0.000 A 680 TRP HD1 H 1 7.026 0.000 A 680 TRP HE1 H 1 10.198 0.000 A 680 TRP HE3 H 1 7.335 0.000 A 680 TRP HH2 H 1 7.154 0.000 A 680 TRP HZ2 H 1 7.440 0.000 A 680 TRP HZ3 H 1 7.025 0.000 A 680 TRP C C 13 176.337 0.000 A 680 TRP CA C 13 58.707 0.000 A 680 TRP CB C 13 29.231 0.000 A 680 TRP CD1 C 13 127.125 0.000 A 680 TRP CE3 C 13 120.873 0.000 A 680 TRP CH2 C 13 124.307 0.000 A 680 TRP CZ2 C 13 114.696 0.000 A 680 TRP CZ3 C 13 121.859 0.000 A 680 TRP N N 15 117.076 0.000 A 680 TRP NE1 N 15 129.614 0.000 A 681 TYR H H 1 7.460 0.000 A 681 TYR HA H 1 4.209 0.000 A 681 TYR HBy H 1 3.009 0.000 A 681 TYR HBx H 1 2.867 0.000 A 681 TYR HD1 H 1 7.104 0.000 A 681 TYR HD2 H 1 7.104 0.000 A 681 TYR HE1 H 1 6.831 0.000 A 681 TYR HE2 H 1 6.831 0.000 A 681 TYR C C 13 175.629 0.000 A 681 TYR CA C 13 59.465 0.000 A 681 TYR CB C 13 39.070 0.000 A 681 TYR CD2 C 13 133.155 0.000 A 681 TYR CE2 C 13 118.351 0.000 A 681 TYR N N 15 116.306 0.000 A 682 ILE H H 1 7.495 0.000 A 682 ILE HA H 1 4.158 0.000 A 682 ILE HB H 1 1.962 0.000 A 682 ILE HD1% H 1 0.858 0.000 A 682 ILE HG1y H 1 1.461 0.000 A 682 ILE HG1x H 1 1.224 0.000 A 682 ILE HG2% H 1 0.899 0.000 A 682 ILE C C 13 174.365 0.000 A 682 ILE CA C 13 61.279 0.000 A 682 ILE CB C 13 38.796 0.000 A 682 ILE CD1 C 13 13.730 0.000 A 682 ILE CG1 C 13 27.288 0.000 A 682 ILE CG2 C 13 18.124 0.000 A 682 ILE N N 15 115.813 0.000 A 683 LYS H H 1 7.408 0.000 A 683 LYS HA H 1 4.097 0.000 A 683 LYS HBy H 1 1.755 0.000 A 683 LYS HBx H 1 1.674 0.000 A 683 LYS HD2 H 1 1.615 0.000 A 683 LYS HD3 H 1 1.615 0.000 A 683 LYS HE2 H 1 2.904 0.000 A 683 LYS HE3 H 1 2.904 0.000 A 683 LYS HG2 H 1 1.371 0.000 A 683 LYS HG3 H 1 1.371 0.000 A 683 LYS C C 13 180.730 0.000 A 683 LYS CA C 13 57.752 0.000 A 683 LYS CB C 13 33.869 0.000 A 683 LYS CD C 13 29.272 0.000 A 683 LYS CE C 13 42.120 0.000 A 683 LYS CG C 13 24.718 0.000 A 683 LYS N N 15 127.205 0.000 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 660 LEU HA A 660 LEU HBx 1.0 0.0 2.99 2 2 A 662 GLU HA A 662 GLU HBy 1.0 0.0 3.02 3 3 A 667 ALA HA A 670 TRP HBy 1.0 0.0 3.73 4 4 A 668 SER HA A 668 SER HBx 1.0 0.0 2.68 5 5 A 668 SER HA A 668 SER HBy 1.0 0.0 2.68 6 6 A 675 ILE HA A 675 ILE HB 1.0 0.0 2.90 7 7 A 679 LEU HA A 679 LEU HBy 1.0 0.0 2.74 8 8 A 675 ILE HB A 672 TRP HA 1.0 0.0 4.04 9 9 A 662 GLU HA A 662 GLU HGy 1.0 0.0 3.24 10 10 A 662 GLU HA A 662 GLU HGx 1.0 0.0 3.24 11 11 A 666 TRP HD1 A 665 LYS HBy 1.0 0.0 5.50 12 12 A 666 TRP HD1 A 665 LYS HBx 1.0 0.0 5.50 13 13 A 665 LYS HA A 665 LYS HGy 1.0 0.0 3.36 14 14 A 666 TRP HA A 666 TRP HE3 1.0 0.0 3.48 15 15 A 666 TRP HD1 A 663 LEU HA 1.0 0.0 4.07 16 16 A 666 TRP HE3 A 666 TRP HBy 1.0 0.0 4.14 17 17 A 666 TRP HE3 A 666 TRP HBx 1.0 0.0 4.14 18 18 A 667 ALA HA A 666 TRP HE3 1.0 0.0 5.50 19 19 A 669 LEU HA A 672 TRP HD1 1.0 0.0 5.50 20 20 A 669 LEU HA A 672 TRP HE3 1.0 0.0 5.50 21 21 A 666 TRP HE3 A 669 LEU HBx 1.0 0.0 5.50 22 22 A 667 ALA HA A 670 TRP HD1 1.0 0.0 5.13 23 23 A 672 TRP HA A 672 TRP HD1 1.0 0.0 5.38 24 24 A 672 TRP HE3 A 673 PHE HA 1.0 0.0 5.50 25 25 A 672 TRP HA A 672 TRP HE3 1.0 0.0 3.61 26 26 A 672 TRP HE3 A 672 TRP HBy 1.0 0.0 4.11 27 27 A 672 TRP HE3 A 672 TRP HBx 1.0 0.0 4.11 28 28 A 673 PHE HD% A 674 ALA HA 1.0 0.0 7.63 29 29 A 675 ILE HA A 675 ILE HG1x 1.0 0.0 3.95 30 30 A 678 TRP HE3 A 678 TRP HBy 1.0 0.0 4.07 31 31 A 678 TRP HE3 A 678 TRP HBx 1.0 0.0 4.07 32 32 A 679 LEU HA A 678 TRP HE3 1.0 0.0 3.64 33 33 A 680 TRP HA A 680 TRP HD1 1.0 0.0 5.50 34 34 A 680 TRP HD1 A 680 TRP HBx 1.0 0.0 3.73 35 35 A 680 TRP HE3 A 681 TYR HA 1.0 0.0 5.50 36 36 A 682 ILE HA A 682 ILE HG1x 1.0 0.0 3.79 37 37 A 666 TRP HE3 A 669 LEU HBy 1.0 0.0 5.50 38 38 A 661 LEU HA A 661 LEU HDy% 1.0 0.0 4.94 39 39 A 663 LEU HA A 663 LEU HDx% 1.0 0.0 4.32 40 40 A 664 ASP HA A 667 ALA HB% 1.0 0.0 4.84 41 41 A 666 TRP HE3 A 669 LEU HDx% 1.0 0.0 4.97 42 42 A 672 TRP HZ3 A 675 ILE HG2% 1.0 0.0 5.74 43 43 A 666 TRP HE3 A 669 LEU HDy% 1.0 0.0 4.97 44 44 A 668 SER HA A 671 ALA HB% 1.0 0.0 3.88 45 45 A 678 TRP HE3 A 679 LEU HDx% 1.0 0.0 5.37 46 46 A 678 TRP HE3 A 679 LEU HDy% 1.0 0.0 5.37 47 47 A 681 TYR HD% A 682 ILE HG2% 1.0 0.0 8.65 48 48 A 672 TRP HE3 A 675 ILE HD1% 1.0 0.0 5.71 49 49 A 672 TRP HZ3 A 675 ILE HD1% 1.0 0.0 5.81 50 50 A 672 TRP HD1 A 669 LEU HDx% 1.0 0.0 6.52 51 51 A 672 TRP HD1 A 669 LEU HDy% 1.0 0.0 6.52 52 52 A 672 TRP HA A 675 ILE HG2% 1.0 0.0 6.12 53 53 A 658 GLN HBy A 659 GLU H 1.0 0.0 4.79 54 54 A 659 GLU H A 658 GLN HBx 1.0 0.0 4.79 55 55 A 661 LEU H A 659 GLU HBy 1.0 0.0 5.50 56 56 A 661 LEU H A 659 GLU HBx 1.0 0.0 5.50 57 57 A 659 GLU H A 660 LEU H 1.0 0.0 4.17 58 58 A 660 LEU HA A 662 GLU H 1.0 0.0 4.94 59 59 A 660 LEU H A 660 LEU HBy 1.0 0.0 3.76 60 60 A 661 LEU H A 660 LEU HBy 1.0 0.0 4.26 61 61 A 660 LEU H A 660 LEU HBx 1.0 0.0 3.76 62 62 A 661 LEU H A 660 LEU HBx 1.0 0.0 4.26 63 63 A 661 LEU H A 660 LEU H 1.0 0.0 3.70 64 64 A 661 LEU H A 661 LEU HBy 1.0 0.0 3.55 65 65 A 662 GLU H A 661 LEU HBy 1.0 0.0 4.48 66 66 A 661 LEU H A 661 LEU HBx 1.0 0.0 3.55 67 67 A 662 GLU H A 661 LEU HBx 1.0 0.0 4.48 68 68 A 661 LEU H A 662 GLU H 1.0 0.0 4.17 69 69 A 662 GLU HA A 664 ASP H 1.0 0.0 5.16 70 70 A 663 LEU H A 662 GLU HBy 1.0 0.0 4.38 71 71 A 663 LEU H A 662 GLU HBx 1.0 0.0 4.38 72 72 A 663 LEU HA A 664 ASP H 1.0 0.0 3.42 73 73 A 663 LEU HA A 665 LYS H 1.0 0.0 5.50 74 74 A 663 LEU HA A 666 TRP H 1.0 0.0 4.76 75 75 A 664 ASP H A 663 LEU H 1.0 0.0 3.70 76 76 A 664 ASP H A 665 LYS H 1.0 0.0 3.92 77 77 A 667 ALA H A 664 ASP HB2 1.0 0.0 6.38 78 77 A 664 ASP HB3 A 667 ALA H 1.0 0.0 6.38 79 78 A 665 LYS HA A 668 SER H 1.0 0.0 5.28 80 79 A 666 TRP H A 667 ALA H 1.0 0.0 3.30 81 80 A 666 TRP HA A 669 LEU H 1.0 0.0 4.42 82 81 A 666 TRP H A 666 TRP HBy 1.0 0.0 3.58 83 82 A 667 ALA H A 666 TRP HBy 1.0 0.0 4.01 84 83 A 666 TRP H A 666 TRP HBx 1.0 0.0 3.58 85 84 A 667 ALA HA A 670 TRP H 1.0 0.0 4.57 86 85 A 668 SER H A 669 LEU H 1.0 0.0 3.52 87 86 A 668 SER HA A 670 TRP H 1.0 0.0 5.13 88 87 A 668 SER HA A 671 ALA H 1.0 0.0 4.42 89 88 A 669 LEU H A 668 SER HBy 1.0 0.0 4.42 90 89 A 669 LEU H A 668 SER HBx 1.0 0.0 4.42 91 90 A 669 LEU H A 670 TRP H 1.0 0.0 3.48 92 91 A 669 LEU HA A 672 TRP H 1.0 0.0 4.57 93 92 A 669 LEU H A 669 LEU HBy 1.0 0.0 3.27 94 93 A 670 TRP H A 669 LEU HBy 1.0 0.0 3.61 95 94 A 670 TRP H A 669 LEU HBx 1.0 0.0 3.61 96 95 A 670 TRP HA A 673 PHE H 1.0 0.0 5.50 97 96 A 670 TRP H A 670 TRP HBy 1.0 0.0 3.52 98 97 A 670 TRP H A 670 TRP HBx 1.0 0.0 3.52 99 98 A 671 ALA H A 670 TRP HBx 1.0 0.0 4.04 100 99 A 672 TRP H A 673 PHE H 1.0 0.0 3.73 101 100 A 672 TRP HBx A 673 PHE H 1.0 0.0 4.23 102 101 A 673 PHE H A 674 ALA H 1.0 0.0 3.98 103 102 A 673 PHE H A 673 PHE HBx 1.0 0.0 3.45 104 103 A 675 ILE HA A 678 TRP H 1.0 0.0 5.41 105 104 A 675 ILE HB A 676 THR H 1.0 0.0 4.04 106 105 A 676 THR H A 677 ASN H 1.0 0.0 3.98 107 106 A 676 THR HA A 679 LEU H 1.0 0.0 5.50 108 107 A 677 ASN H A 676 THR HB 1.0 0.0 4.32 109 108 A 678 TRP H A 677 ASN H 1.0 0.0 3.76 110 109 A 678 TRP H A 678 TRP HBy 1.0 0.0 3.55 111 110 A 679 LEU H A 678 TRP HBy 1.0 0.0 4.48 112 111 A 679 LEU H A 678 TRP HBx 1.0 0.0 4.48 113 112 A 679 LEU H A 680 TRP H 1.0 0.0 3.52 114 113 A 680 TRP H A 679 LEU HBy 1.0 0.0 4.32 115 114 A 680 TRP HA A 683 LYS H 1.0 0.0 5.50 116 115 A 681 TYR H A 680 TRP HBy 1.0 0.0 4.32 117 116 A 680 TRP H A 680 TRP HBx 1.0 0.0 3.58 118 117 A 681 TYR H A 680 TRP HBx 1.0 0.0 4.32 119 118 A 681 TYR H A 681 TYR HBy 1.0 0.0 3.30 120 119 A 682 ILE H A 681 TYR HBy 1.0 0.0 4.63 121 120 A 681 TYR H A 681 TYR HBx 1.0 0.0 3.30 122 121 A 682 ILE H A 681 TYR HBx 1.0 0.0 4.63 123 122 A 682 ILE HA A 683 LYS H 1.0 0.0 3.21 124 123 A 666 TRP H A 664 ASP HB2 1.0 0.0 6.38 125 123 A 666 TRP H A 664 ASP HB3 1.0 0.0 6.38 126 124 A 680 TRP H A 677 ASN HA 1.0 0.0 5.38 127 125 A 681 TYR H A 678 TRP HA 1.0 0.0 5.50 128 126 A 659 GLU H A 658 GLN HG2 1.0 0.0 6.38 129 126 A 659 GLU H A 658 GLN HG3 1.0 0.0 6.38 130 127 A 660 LEU H A 659 GLU HG2 1.0 0.0 6.35 131 127 A 660 LEU H A 659 GLU HG3 1.0 0.0 6.35 132 128 A 661 LEU H A 659 GLU HG2 1.0 0.0 6.38 133 128 A 661 LEU H A 659 GLU HG3 1.0 0.0 6.38 134 129 A 660 LEU H A 660 LEU HG 1.0 0.0 3.24 135 130 A 665 LYS H A 665 LYS HGy 1.0 0.0 3.70 136 131 A 666 TRP H A 665 LYS HGy 1.0 0.0 5.50 137 132 A 665 LYS H A 665 LYS HGx 1.0 0.0 3.70 138 133 A 666 TRP HD1 A 666 TRP H 1.0 0.0 3.48 139 134 A 669 LEU H A 669 LEU HG 1.0 0.0 3.24 140 135 A 670 TRP HD1 A 670 TRP H 1.0 0.0 4.63 141 136 A 675 ILE H A 675 ILE HG1y 1.0 0.0 3.05 142 137 A 675 ILE H A 675 ILE HG1x 1.0 0.0 3.05 143 138 A 678 TRP HE3 A 678 TRP H 1.0 0.0 4.76 144 139 A 680 TRP HD1 A 680 TRP H 1.0 0.0 4.01 145 140 A 682 ILE H A 682 ILE HG1y 1.0 0.0 2.77 146 141 A 666 TRP H A 665 LYS HGx 1.0 0.0 5.50 147 142 A 672 TRP HD1 A 672 TRP H 1.0 0.0 4.63 148 143 A 678 TRP H A 678 TRP HE1 1.0 0.0 5.50 149 144 A 666 TRP HE1 A 660 LEU HBx 1.0 0.0 5.50 150 145 A 661 LEU HA A 666 TRP HE1 1.0 0.0 4.66 151 146 A 666 TRP HE1 A 660 LEU HBy 1.0 0.0 5.50 152 147 A 660 LEU H A 660 LEU HDx% 1.0 0.0 5.09 153 148 A 660 LEU H A 660 LEU HDy% 1.0 0.0 5.09 154 149 A 661 LEU H A 661 LEU HDx% 1.0 0.0 5.31 155 150 A 661 LEU H A 661 LEU HDy% 1.0 0.0 5.31 156 151 A 662 GLU H A 661 LEU HDy% 1.0 0.0 5.74 157 152 A 663 LEU H A 663 LEU HDx% 1.0 0.0 5.03 158 153 A 663 LEU H A 663 LEU HDy% 1.0 0.0 5.03 159 154 A 667 ALA HB% A 664 ASP H 1.0 0.0 5.25 160 155 A 667 ALA HB% A 666 TRP H 1.0 0.0 5.28 161 156 A 667 ALA HB% A 668 SER H 1.0 0.0 3.48 162 157 A 667 ALA HB% A 669 LEU H 1.0 0.0 4.97 163 158 A 667 ALA HB% A 670 TRP H 1.0 0.0 5.96 164 159 A 669 LEU H A 669 LEU HDx% 1.0 0.0 5.00 165 160 A 670 TRP H A 669 LEU HDx% 1.0 0.0 6.24 166 161 A 669 LEU H A 669 LEU HDy% 1.0 0.0 5.00 167 162 A 670 TRP H A 669 LEU HDy% 1.0 0.0 6.24 168 163 A 675 ILE H A 674 ALA HB% 1.0 0.0 4.04 169 164 A 675 ILE HG2% A 676 THR H 1.0 0.0 4.84 170 165 A 679 LEU H A 679 LEU HDx% 1.0 0.0 4.94 171 166 A 679 LEU H A 679 LEU HDy% 1.0 0.0 4.94 172 167 A 682 ILE H A 682 ILE HD1% 1.0 0.0 5.75 173 168 A 662 GLU H A 661 LEU HDx% 1.0 0.0 5.74 174 169 A 678 TRP H A 676 THR HG2% 1.0 0.0 5.59 175 170 A 659 GLU H A 658 GLN HA 1.0 0.0 3.30 176 171 A 660 LEU H A 659 GLU HA 1.0 0.0 3.05 177 172 A 660 LEU H A 659 GLU HBy 1.0 0.0 4.38 178 173 A 660 LEU H A 659 GLU HBx 1.0 0.0 4.38 179 174 A 660 LEU HA A 660 LEU HBy 1.0 0.0 2.99 180 175 A 660 LEU HA A 661 LEU H 1.0 0.0 3.05 181 176 A 661 LEU HA A 662 GLU H 1.0 0.0 3.08 182 177 A 662 GLU HA A 663 LEU H 1.0 0.0 2.86 183 178 A 662 GLU H A 662 GLU HBy 1.0 0.0 3.58 184 179 A 662 GLU H A 662 GLU HBx 1.0 0.0 3.58 185 180 A 662 GLU HA A 662 GLU HBx 1.0 0.0 3.02 186 181 A 663 LEU H A 663 LEU HBy 1.0 0.0 3.48 187 182 A 663 LEU H A 663 LEU HBx 1.0 0.0 3.48 188 183 A 664 ASP H A 663 LEU HBy 1.0 0.0 4.07 189 184 A 664 ASP H A 663 LEU HBx 1.0 0.0 4.07 190 185 A 665 LYS H A 665 LYS HBy 1.0 0.0 3.83 191 186 A 665 LYS H A 665 LYS HBx 1.0 0.0 3.83 192 187 A 664 ASP HA A 666 TRP H 1.0 0.0 4.69 193 188 A 666 TRP H A 665 LYS HBy 1.0 0.0 4.11 194 189 A 666 TRP H A 665 LYS HBx 1.0 0.0 4.11 195 190 A 664 ASP HA A 667 ALA H 1.0 0.0 5.00 196 191 A 667 ALA H A 666 TRP HBx 1.0 0.0 4.01 197 192 A 667 ALA HA A 670 TRP HBx 1.0 0.0 3.73 198 193 A 668 SER H A 668 SER HBy 1.0 0.0 3.64 199 194 A 668 SER H A 668 SER HBx 1.0 0.0 3.64 200 195 A 669 LEU H A 669 LEU HBx 1.0 0.0 3.27 201 196 A 669 LEU HA A 672 TRP HBy 1.0 0.0 3.73 202 197 A 669 LEU HA A 672 TRP HBx 1.0 0.0 3.73 203 198 A 671 ALA H A 670 TRP HBy 1.0 0.0 4.04 204 199 A 672 TRP HBy A 672 TRP H 1.0 0.0 3.48 205 200 A 672 TRP HBx A 672 TRP H 1.0 0.0 3.48 206 201 A 672 TRP HBy A 673 PHE H 1.0 0.0 4.23 207 202 A 673 PHE H A 673 PHE HBy 1.0 0.0 3.45 208 203 A 674 ALA H A 673 PHE HBy 1.0 0.0 4.29 209 204 A 674 ALA H A 673 PHE HBx 1.0 0.0 4.29 210 205 A 675 ILE HB A 675 ILE H 1.0 0.0 3.30 211 206 A 676 THR H A 676 THR HB 1.0 0.0 3.67 212 207 A 678 TRP H A 678 TRP HBx 1.0 0.0 3.55 213 208 A 679 LEU H A 679 LEU HBy 1.0 0.0 3.52 214 209 A 679 LEU H A 679 LEU HBx 1.0 0.0 3.52 215 210 A 679 LEU HA A 679 LEU HBx 1.0 0.0 2.74 216 211 A 680 TRP H A 679 LEU HBx 1.0 0.0 4.32 217 212 A 680 TRP H A 680 TRP HBy 1.0 0.0 3.58 218 213 A 679 LEU HA A 682 ILE H 1.0 0.0 4.79 219 214 A 682 ILE H A 682 ILE HB 1.0 0.0 3.42 220 215 A 683 LYS H A 682 ILE HB 1.0 0.0 4.11 221 216 A 683 LYS H A 683 LYS HBy 1.0 0.0 3.70 222 217 A 683 LYS H A 683 LYS HBx 1.0 0.0 3.70 223 218 A 663 LEU HA A 666 TRP HBy 1.0 0.0 4.88 224 219 A 663 LEU HA A 666 TRP HBx 1.0 0.0 4.88 225 220 A 659 GLU H A 659 GLU HG2 1.0 0.0 5.20 226 220 A 659 GLU H A 659 GLU HG3 1.0 0.0 5.20 227 221 A 660 LEU HA A 660 LEU HG 1.0 0.0 3.61 228 222 A 661 LEU H A 661 LEU HG 1.0 0.0 3.05 229 223 A 661 LEU HA A 661 LEU HG 1.0 0.0 3.39 230 224 A 662 GLU H A 662 GLU HGy 1.0 0.0 3.67 231 225 A 662 GLU H A 662 GLU HGx 1.0 0.0 3.67 232 226 A 663 LEU H A 663 LEU HG 1.0 0.0 2.65 233 227 A 663 LEU HA A 663 LEU HG 1.0 0.0 2.90 234 228 A 665 LYS HA A 665 LYS HGx 1.0 0.0 3.36 235 229 A 665 LYS HA A 665 LYS HD2 1.0 0.0 4.83 236 229 A 665 LYS HA A 665 LYS HD3 1.0 0.0 4.83 237 230 A 666 TRP HD1 A 666 TRP HA 1.0 0.0 5.50 238 231 A 673 PHE HD% A 670 TRP HA 1.0 0.0 6.42 239 232 A 675 ILE HA A 675 ILE HG1y 1.0 0.0 3.95 240 233 A 678 TRP H A 678 TRP HD1 1.0 0.0 3.48 241 234 A 679 LEU H A 679 LEU HG 1.0 0.0 2.80 242 235 A 680 TRP HD1 A 680 TRP HBy 1.0 0.0 3.73 243 236 A 682 ILE H A 682 ILE HG1x 1.0 0.0 2.77 244 237 A 682 ILE HA A 682 ILE HG1y 1.0 0.0 3.79 245 238 A 683 LYS H A 683 LYS HG2 1.0 0.0 4.77 246 238 A 683 LYS H A 683 LYS HG3 1.0 0.0 4.77 247 239 A 683 LYS HA A 683 LYS HD2 1.0 0.0 6.20 248 239 A 683 LYS HA A 683 LYS HD3 1.0 0.0 6.20 249 240 A 660 LEU HA A 660 LEU HDx% 1.0 0.0 4.72 250 241 A 660 LEU HA A 660 LEU HDy% 1.0 0.0 4.72 251 242 A 661 LEU HA A 661 LEU HDx% 1.0 0.0 4.94 252 243 A 663 LEU HA A 663 LEU HDy% 1.0 0.0 4.32 253 244 A 667 ALA HB% A 667 ALA H 1.0 0.0 3.45 254 245 A 667 ALA HB% A 664 ASP HB2 1.0 0.0 6.87 255 245 A 667 ALA HB% A 664 ASP HB3 1.0 0.0 6.87 256 246 A 669 LEU HA A 669 LEU HDx% 1.0 0.0 3.88 257 247 A 669 LEU HA A 669 LEU HDy% 1.0 0.0 3.88 258 248 A 671 ALA HB% A 671 ALA H 1.0 0.0 3.45 259 249 A 671 ALA HB% A 672 TRP H 1.0 0.0 3.48 260 250 A 674 ALA H A 674 ALA HB% 1.0 0.0 3.45 261 251 A 675 ILE HG2% A 675 ILE H 1.0 0.0 4.26 262 252 A 675 ILE HD1% A 675 ILE H 1.0 0.0 5.53 263 253 A 675 ILE HA A 675 ILE HD1% 1.0 0.0 4.57 264 254 A 675 ILE HA A 675 ILE HG2% 1.0 0.0 3.73 265 255 A 675 ILE HG2% A 675 ILE HG1x 1.0 0.0 3.67 266 256 A 675 ILE HG2% A 675 ILE HG1y 1.0 0.0 3.67 267 257 A 675 ILE HB A 675 ILE HD1% 1.0 0.0 3.76 268 258 A 676 THR H A 676 THR HG2% 1.0 0.0 3.82 269 259 A 679 LEU HA A 682 ILE HD1% 1.0 0.0 4.66 270 260 A 679 LEU HA A 679 LEU HDx% 1.0 0.0 4.13 271 261 A 679 LEU HA A 679 LEU HDy% 1.0 0.0 4.13 272 262 A 682 ILE HG2% A 682 ILE H 1.0 0.0 4.32 273 263 A 682 ILE HA A 682 ILE HG2% 1.0 0.0 3.64 274 264 A 682 ILE HA A 682 ILE HD1% 1.0 0.0 4.91 275 265 A 682 ILE HG2% A 683 LYS H 1.0 0.0 4.44 276 266 A 676 THR HA A 676 THR HG2% 1.0 0.0 3.45 277 267 A 672 TRP HA A 675 ILE HD1% 1.0 0.0 4.54 278 268 A 659 GLU H A 659 GLU HBx 1.0 0.0 3.82 279 268 A 659 GLU H A 659 GLU HBy 1.0 0.0 3.82 280 269 A 660 LEU H A 659 GLU HBx 1.0 0.0 4.17 281 269 A 660 LEU H A 659 GLU HBy 1.0 0.0 4.17 282 270 A 661 LEU H A 659 GLU HBx 1.0 0.0 5.08 283 270 A 661 LEU H A 659 GLU HBy 1.0 0.0 5.08 284 271 A 660 LEU H A 660 LEU HBx 1.0 0.0 3.46 285 271 A 660 LEU H A 660 LEU HBy 1.0 0.0 3.46 286 272 A 660 LEU H A 660 LEU HDx% 1.0 0.0 4.69 287 272 A 660 LEU H A 660 LEU HDy% 1.0 0.0 4.69 288 273 A 660 LEU HA A 660 LEU HDx% 1.0 0.0 3.99 289 273 A 660 LEU HA A 660 LEU HDy% 1.0 0.0 3.99 290 274 A 661 LEU H A 660 LEU HBx 1.0 0.0 4.11 291 274 A 661 LEU H A 660 LEU HBy 1.0 0.0 4.11 292 275 A 662 GLU H A 660 LEU HBx 1.0 0.0 5.73 293 275 A 662 GLU H A 660 LEU HBy 1.0 0.0 5.73 294 276 A 661 LEU H A 660 LEU HDx% 1.0 0.0 7.48 295 276 A 661 LEU H A 660 LEU HDy% 1.0 0.0 7.48 296 277 A 661 LEU H A 661 LEU HBx 1.0 0.0 3.37 297 277 A 661 LEU H A 661 LEU HBy 1.0 0.0 3.37 298 278 A 661 LEU HA A 661 LEU HDx% 1.0 0.0 4.04 299 278 A 661 LEU HA A 661 LEU HDy% 1.0 0.0 4.04 300 279 A 662 GLU H A 661 LEU HBx 1.0 0.0 4.14 301 279 A 662 GLU H A 661 LEU HBy 1.0 0.0 4.14 302 280 A 666 TRP HD1 A 661 LEU HBx 1.0 0.0 6.38 303 280 A 666 TRP HD1 A 661 LEU HBy 1.0 0.0 6.38 304 281 A 666 TRP HE1 A 661 LEU HBx 1.0 0.0 6.38 305 281 A 666 TRP HE1 A 661 LEU HBy 1.0 0.0 6.38 306 282 A 662 GLU H A 661 LEU HDx% 1.0 0.0 5.18 307 282 A 662 GLU H A 661 LEU HDy% 1.0 0.0 5.18 308 283 A 666 TRP HE1 A 661 LEU HDx% 1.0 0.0 7.57 309 283 A 666 TRP HE1 A 661 LEU HDy% 1.0 0.0 7.57 310 284 A 662 GLU H A 662 GLU HBx 1.0 0.0 3.33 311 284 A 662 GLU H A 662 GLU HBy 1.0 0.0 3.33 312 285 A 662 GLU H A 662 GLU HGy 1.0 0.0 3.41 313 285 A 662 GLU H A 662 GLU HGx 1.0 0.0 3.41 314 286 A 662 GLU HA A 662 GLU HGy 1.0 0.0 3.05 315 286 A 662 GLU HA A 662 GLU HGx 1.0 0.0 3.05 316 287 A 663 LEU H A 662 GLU HBx 1.0 0.0 4.17 317 287 A 663 LEU H A 662 GLU HBy 1.0 0.0 4.17 318 288 A 665 LYS H A 662 GLU HBx 1.0 0.0 6.10 319 288 A 665 LYS H A 662 GLU HBy 1.0 0.0 6.10 320 289 A 663 LEU H A 662 GLU HGy 1.0 0.0 5.79 321 289 A 663 LEU H A 662 GLU HGx 1.0 0.0 5.79 322 290 A 663 LEU H A 663 LEU HBx 1.0 0.0 3.20 323 290 A 663 LEU H A 663 LEU HBy 1.0 0.0 3.20 324 291 A 663 LEU H A 663 LEU HDx% 1.0 0.0 4.60 325 291 A 663 LEU H A 663 LEU HDy% 1.0 0.0 4.60 326 292 A 663 LEU HA A 663 LEU HDx% 1.0 0.0 3.71 327 292 A 663 LEU HA A 663 LEU HDy% 1.0 0.0 3.71 328 293 A 663 LEU HA A 666 TRP HBx 1.0 0.0 4.39 329 293 A 663 LEU HA A 666 TRP HBy 1.0 0.0 4.39 330 294 A 664 ASP H A 663 LEU HDx% 1.0 0.0 6.83 331 294 A 664 ASP H A 663 LEU HDy% 1.0 0.0 6.83 332 295 A 665 LYS H A 665 LYS HBy 1.0 0.0 3.63 333 295 A 665 LYS H A 665 LYS HBx 1.0 0.0 3.63 334 296 A 665 LYS H A 665 LYS HGy 1.0 0.0 3.41 335 296 A 665 LYS H A 665 LYS HGx 1.0 0.0 3.41 336 297 A 665 LYS HA A 665 LYS HGy 1.0 0.0 3.18 337 297 A 665 LYS HA A 665 LYS HGx 1.0 0.0 3.18 338 298 A 666 TRP H A 665 LYS HBy 1.0 0.0 3.93 339 298 A 666 TRP H A 665 LYS HBx 1.0 0.0 3.93 340 299 A 666 TRP H A 665 LYS HGy 1.0 0.0 5.10 341 299 A 666 TRP H A 665 LYS HGx 1.0 0.0 5.10 342 300 A 666 TRP H A 666 TRP HBx 1.0 0.0 3.33 343 300 A 666 TRP H A 666 TRP HBy 1.0 0.0 3.33 344 301 A 666 TRP HA A 669 LEU HBx 1.0 0.0 5.76 345 301 A 666 TRP HA A 669 LEU HBy 1.0 0.0 5.76 346 302 A 666 TRP HA A 669 LEU HDx% 1.0 0.0 6.74 347 302 A 666 TRP HA A 669 LEU HDy% 1.0 0.0 6.74 348 303 A 667 ALA H A 666 TRP HBx 1.0 0.0 3.84 349 303 A 667 ALA H A 666 TRP HBy 1.0 0.0 3.84 350 304 A 666 TRP HZ3 A 669 LEU HDx% 1.0 0.0 6.49 351 304 A 669 LEU HDy% A 666 TRP HZ3 1.0 0.0 6.49 352 305 A 668 SER H A 668 SER HBy 1.0 0.0 3.47 353 305 A 668 SER H A 668 SER HBx 1.0 0.0 3.47 354 306 A 669 LEU H A 668 SER HBy 1.0 0.0 4.08 355 306 A 669 LEU H A 668 SER HBx 1.0 0.0 4.08 356 307 A 669 LEU H A 669 LEU HBx 1.0 0.0 2.99 357 307 A 669 LEU H A 669 LEU HBy 1.0 0.0 2.99 358 308 A 670 TRP H A 669 LEU HBx 1.0 0.0 3.42 359 308 A 670 TRP H A 669 LEU HBy 1.0 0.0 3.42 360 309 A 670 TRP H A 669 LEU HDx% 1.0 0.0 5.97 361 309 A 670 TRP H A 669 LEU HDy% 1.0 0.0 5.97 362 310 A 672 TRP HE1 A 669 LEU HDx% 1.0 0.0 7.70 363 310 A 669 LEU HDy% A 672 TRP HE1 1.0 0.0 7.70 364 311 A 673 PHE HD% A 669 LEU HDx% 1.0 0.0 9.42 365 311 A 673 PHE HD% A 669 LEU HDy% 1.0 0.0 9.42 366 312 A 670 TRP H A 670 TRP HBx 1.0 0.0 3.30 367 312 A 670 TRP H A 670 TRP HBy 1.0 0.0 3.30 368 313 A 671 ALA H A 670 TRP HBx 1.0 0.0 3.84 369 313 A 671 ALA H A 670 TRP HBy 1.0 0.0 3.84 370 314 A 675 ILE H A 675 ILE HG1x 1.0 0.0 2.75 371 314 A 675 ILE H A 675 ILE HG1y 1.0 0.0 2.75 372 315 A 675 ILE HA A 675 ILE HG1x 1.0 0.0 3.68 373 315 A 675 ILE HA A 675 ILE HG1y 1.0 0.0 3.68 374 316 A 676 THR HA A 679 LEU HBx 1.0 0.0 4.71 375 316 A 676 THR HA A 679 LEU HBy 1.0 0.0 4.71 376 317 A 677 ASN H A 677 ASN HD2y 1.0 0.0 4.84 377 317 A 677 ASN H A 677 ASN HD2x 1.0 0.0 4.84 378 318 A 677 ASN H A 679 LEU HDx% 1.0 0.0 6.27 379 318 A 677 ASN H A 679 LEU HDy% 1.0 0.0 6.27 380 319 A 678 TRP H A 678 TRP HBx 1.0 0.0 3.31 381 319 A 678 TRP H A 678 TRP HBy 1.0 0.0 3.31 382 320 A 679 LEU H A 678 TRP HBx 1.0 0.0 4.31 383 320 A 679 LEU H A 678 TRP HBy 1.0 0.0 4.31 384 321 A 678 TRP HE3 A 679 LEU HBx 1.0 0.0 6.38 385 321 A 678 TRP HE3 A 679 LEU HBy 1.0 0.0 6.38 386 322 A 678 TRP HE3 A 679 LEU HDx% 1.0 0.0 4.98 387 322 A 678 TRP HE3 A 679 LEU HDy% 1.0 0.0 4.98 388 323 A 678 TRP HZ3 A 679 LEU HDx% 1.0 0.0 7.14 389 323 A 679 LEU HDy% A 678 TRP HZ3 1.0 0.0 7.14 390 324 A 679 LEU H A 679 LEU HBx 1.0 0.0 3.27 391 324 A 679 LEU H A 679 LEU HBy 1.0 0.0 3.27 392 325 A 679 LEU H A 679 LEU HDx% 1.0 0.0 4.46 393 325 A 679 LEU H A 679 LEU HDy% 1.0 0.0 4.46 394 326 A 679 LEU HA A 679 LEU HDx% 1.0 0.0 3.54 395 326 A 679 LEU HA A 679 LEU HDy% 1.0 0.0 3.54 396 327 A 679 LEU HA A 682 ILE HG1x 1.0 0.0 4.83 397 327 A 679 LEU HA A 682 ILE HG1y 1.0 0.0 4.83 398 328 A 680 TRP H A 679 LEU HBx 1.0 0.0 4.02 399 328 A 680 TRP H A 679 LEU HBy 1.0 0.0 4.02 400 329 A 680 TRP H A 679 LEU HDx% 1.0 0.0 6.80 401 329 A 680 TRP H A 679 LEU HDy% 1.0 0.0 6.80 402 330 A 680 TRP H A 680 TRP HBx 1.0 0.0 3.40 403 330 A 680 TRP H A 680 TRP HBy 1.0 0.0 3.40 404 331 A 680 TRP HD1 A 680 TRP HBx 1.0 0.0 3.44 405 331 A 680 TRP HD1 A 680 TRP HBy 1.0 0.0 3.44 406 332 A 681 TYR H A 681 TYR HBy 1.0 0.0 3.10 407 332 A 681 TYR H A 681 TYR HBx 1.0 0.0 3.10 408 333 A 682 ILE H A 682 ILE HG1x 1.0 0.0 2.51 409 333 A 682 ILE H A 682 ILE HG1y 1.0 0.0 2.51 410 334 A 682 ILE HA A 682 ILE HG1x 1.0 0.0 3.40 411 334 A 682 ILE HA A 682 ILE HG1y 1.0 0.0 3.40 412 335 A 683 LYS H A 682 ILE HG1x 1.0 0.0 5.76 413 335 A 683 LYS H A 682 ILE HG1y 1.0 0.0 5.76 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 658 GLN C A 659 GLU N A 659 GLU CA A 659 GLU C 1.0 -96.9 -56.9 PHI 2 2 A 659 GLU C A 660 LEU N A 660 LEU CA A 660 LEU C 1.0 -100.9 -60.9 PHI 3 3 A 660 LEU N A 660 LEU CA A 660 LEU C A 661 LEU N 1.0 -45.7 14.3 PSI 4 4 A 660 LEU C A 661 LEU N A 661 LEU CA A 661 LEU C 1.0 -102.6 -62.6 PHI 5 5 A 661 LEU C A 662 GLU N A 662 GLU CA A 662 GLU C 1.0 -103.7 -63.7 PHI 6 6 A 662 GLU N A 662 GLU CA A 662 GLU C A 663 LEU N 1.0 103.0 163.0 PSI 7 7 A 662 GLU C A 663 LEU N A 663 LEU CA A 663 LEU C 1.0 -88.9 -48.9 PHI 8 8 A 663 LEU N A 663 LEU CA A 663 LEU C A 664 ASP N 1.0 -68.0 -8.0 PSI 9 9 A 663 LEU C A 664 ASP N A 664 ASP CA A 664 ASP C 1.0 -89.3 -49.3 PHI 10 10 A 664 ASP N A 664 ASP CA A 664 ASP C A 665 LYS N 1.0 -70.3 -10.3 PSI 11 11 A 664 ASP C A 665 LYS N A 665 LYS CA A 665 LYS C 1.0 -93.3 -53.3 PHI 12 12 A 665 LYS N A 665 LYS CA A 665 LYS C A 666 TRP N 1.0 -68.4 -8.4 PSI 13 13 A 665 LYS C A 666 TRP N A 666 TRP CA A 666 TRP C 1.0 -94.2 -54.2 PHI 14 14 A 666 TRP N A 666 TRP CA A 666 TRP C A 667 ALA N 1.0 -73.5 -13.5 PSI 15 15 A 666 TRP C A 667 ALA N A 667 ALA CA A 667 ALA C 1.0 -74.7 -34.7 PHI 16 16 A 667 ALA N A 667 ALA CA A 667 ALA C A 668 SER N 1.0 -66.8 -6.8 PSI 17 17 A 667 ALA C A 668 SER N A 668 SER CA A 668 SER C 1.0 -82.2 -42.2 PHI 18 18 A 668 SER N A 668 SER CA A 668 SER C A 669 LEU N 1.0 -69.1 -9.1 PSI 19 19 A 668 SER C A 669 LEU N A 669 LEU CA A 669 LEU C 1.0 -85.9 -45.9 PHI 20 20 A 669 LEU N A 669 LEU CA A 669 LEU C A 670 TRP N 1.0 -73.3 -13.3 PSI 21 21 A 669 LEU C A 670 TRP N A 670 TRP CA A 670 TRP C 1.0 -79.5 -39.5 PHI 22 22 A 670 TRP N A 670 TRP CA A 670 TRP C A 671 ALA N 1.0 -64.5 -4.5 PSI 23 23 A 670 TRP C A 671 ALA N A 671 ALA CA A 671 ALA C 1.0 -80.9 -40.9 PHI 24 24 A 671 ALA N A 671 ALA CA A 671 ALA C A 672 TRP N 1.0 -65.9 -5.9 PSI 25 25 A 671 ALA C A 672 TRP N A 672 TRP CA A 672 TRP C 1.0 -85.0 -45.0 PHI 26 26 A 672 TRP N A 672 TRP CA A 672 TRP C A 673 PHE N 1.0 -69.7 -9.7 PSI 27 27 A 672 TRP C A 673 PHE N A 673 PHE CA A 673 PHE C 1.0 -81.1 -41.1 PHI 28 28 A 673 PHE N A 673 PHE CA A 673 PHE C A 674 ALA N 1.0 -72.9 -12.9 PSI 29 29 A 673 PHE C A 674 ALA N A 674 ALA CA A 674 ALA C 1.0 -84.2 -44.2 PHI 30 30 A 674 ALA N A 674 ALA CA A 674 ALA C A 675 ILE N 1.0 15.0 225.0 PSI 31 31 A 674 ALA C A 675 ILE N A 675 ILE CA A 675 ILE C 1.0 -87.5 -47.5 PHI 32 32 A 675 ILE N A 675 ILE CA A 675 ILE C A 676 THR N 1.0 -40.0 70.0 PSI 33 33 A 675 ILE C A 676 THR N A 676 THR CA A 676 THR C 1.0 -86.7 -46.7 PHI 34 34 A 676 THR N A 676 THR CA A 676 THR C A 677 ASN N 1.0 35.0 205.0 PSI 35 35 A 676 THR C A 677 ASN N A 677 ASN CA A 677 ASN C 1.0 -94.8 -54.8 PHI 36 36 A 677 ASN N A 677 ASN CA A 677 ASN C A 678 TRP N 1.0 -67.1 -7.1 PSI 37 37 A 677 ASN C A 678 TRP N A 678 TRP CA A 678 TRP C 1.0 -94.7 -54.7 PHI 38 38 A 678 TRP N A 678 TRP CA A 678 TRP C A 679 LEU N 1.0 -68.2 -8.2 PSI 39 39 A 678 TRP C A 679 LEU N A 679 LEU CA A 679 LEU C 1.0 -83.3 -43.3 PHI 40 40 A 679 LEU N A 679 LEU CA A 679 LEU C A 680 TRP N 1.0 -65.6 -5.6 PSI 41 41 A 679 LEU C A 680 TRP N A 680 TRP CA A 680 TRP C 1.0 -87.2 -47.2 PHI 42 42 A 680 TRP N A 680 TRP CA A 680 TRP C A 681 TYR N 1.0 -60.2 -0.2 PSI 43 43 A 680 TRP C A 681 TYR N A 681 TYR CA A 681 TYR C 1.0 -97.6 -57.6 PHI 44 44 A 681 TYR N A 681 TYR CA A 681 TYR C A 682 ILE N 1.0 -55.1 4.9 PSI 45 45 A 681 TYR C A 682 ILE N A 682 ILE CA A 682 ILE C 1.0 -115.8 -75.8 PHI 46 46 A 682 ILE N A 682 ILE CA A 682 ILE C A 683 LYS N 1.0 92.8 152.8 PSI 47 47 A 682 ILE C A 683 LYS N A 683 LYS CA A 683 LYS C 1.0 -106.6 -66.6 PHI stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 save_