data_nef_c15476_2jvd 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 2HEP 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 1 MET start . . 2 A 2 ILE middle . . 3 A 3 SER middle . . 4 A 4 ASN middle . . 5 A 5 ALA middle . . 6 A 6 LYS middle . . 7 A 7 ILE middle . . 8 A 8 ALA middle . . 9 A 9 ARG middle . . 10 A 10 ILE middle . . 11 A 11 ASN middle . . 12 A 12 GLU middle . . 13 A 13 LEU middle . . 14 A 14 ALA middle . . 15 A 15 ALA middle . . 16 A 16 LYS middle . . 17 A 17 ALA middle . . 18 A 18 LYS middle . . 19 A 19 ALA middle . . 20 A 20 GLY middle . false 21 A 21 VAL middle . . 22 A 22 ILE middle . . 23 A 23 THR middle . . 24 A 24 GLU middle . . 25 A 25 GLU middle . . 26 A 26 GLU middle . . 27 A 27 LYS middle . . 28 A 28 ALA middle . . 29 A 29 GLU middle . . 30 A 30 GLN middle . . 31 A 31 GLN middle . . 32 A 32 LYS middle . . 33 A 33 LEU middle . . 34 A 34 ARG middle . . 35 A 35 GLN middle . . 36 A 36 GLU middle . . 37 A 37 TYR middle . . 38 A 38 LEU middle . . 39 A 39 LYS middle . . 40 A 40 GLY middle . false 41 A 41 PHE middle . . 42 A 42 ARG middle . . 43 A 43 SER middle . . 44 A 44 SER middle . . 45 A 45 MET middle . . 46 A 46 LYS middle . . 47 A 47 LEU middle . . 48 A 48 GLU middle . . 49 A 49 HIS middle . . 50 A 50 HIS middle . . 51 A 51 HIS middle . . 52 A 52 HIS middle . . 53 A 53 HIS middle . . 54 A 54 HIS 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 1 MET HA H 1 4.052 0.02 A 1 MET HBx H 1 2.093 0.02 A 1 MET HBy H 1 2.093 0.02 A 1 MET HGx H 1 2.644 0.02 A 1 MET HGy H 1 2.644 0.02 A 1 MET CA C 13 55.026 0.2 A 1 MET CB C 13 33.405 0.2 A 1 MET CG C 13 31.122 0.2 A 2 ILE HA H 1 4.350 0.02 A 2 ILE HB H 1 1.918 0.02 A 2 ILE HD1% H 1 0.866 0.02 A 2 ILE HG1y H 1 1.571 0.02 A 2 ILE HG1x H 1 1.347 0.02 A 2 ILE HG2% H 1 0.975 0.02 A 2 ILE C C 13 174.508 0.2 A 2 ILE CA C 13 61.095 0.2 A 2 ILE CB C 13 39.193 0.2 A 2 ILE CD1 C 13 13.882 0.2 A 2 ILE CG1 C 13 27.221 0.2 A 2 ILE CG2 C 13 17.466 0.2 A 3 SER H H 1 8.112 0.02 A 3 SER HA H 1 4.414 0.02 A 3 SER HBy H 1 4.219 0.02 A 3 SER HBx H 1 3.973 0.02 A 3 SER C C 13 174.652 0.2 A 3 SER CA C 13 57.714 0.2 A 3 SER CB C 13 64.725 0.2 A 3 SER N N 15 119.280 0.2 A 4 ASN H H 1 8.832 0.02 A 4 ASN HA H 1 4.511 0.02 A 4 ASN HBx H 1 2.841 0.02 A 4 ASN HBy H 1 2.841 0.02 A 4 ASN HD21 H 1 7.725 0.02 A 4 ASN HD22 H 1 7.000 0.02 A 4 ASN C C 13 177.606 0.2 A 4 ASN CA C 13 55.617 0.2 A 4 ASN CB C 13 37.972 0.2 A 4 ASN CG C 13 176.271 0.2 A 4 ASN N N 15 120.760 0.2 A 4 ASN ND2 N 15 112.906 0.2 A 5 ALA H H 1 8.504 0.02 A 5 ALA HA H 1 4.191 0.02 A 5 ALA HB% H 1 1.437 0.02 A 5 ALA C C 13 180.504 0.2 A 5 ALA CA C 13 54.896 0.2 A 5 ALA CB C 13 18.468 0.2 A 5 ALA N N 15 123.401 0.2 A 6 LYS H H 1 7.844 0.02 A 6 LYS HA H 1 4.119 0.02 A 6 LYS HBy H 1 2.000 0.02 A 6 LYS HBx H 1 1.717 0.02 A 6 LYS HDy H 1 1.731 0.02 A 6 LYS HDx H 1 1.678 0.02 A 6 LYS HEy H 1 2.983 0.02 A 6 LYS HEx H 1 2.959 0.02 A 6 LYS HGy H 1 1.522 0.02 A 6 LYS HGx H 1 1.388 0.02 A 6 LYS C C 13 178.320 0.2 A 6 LYS CA C 13 59.550 0.2 A 6 LYS CB C 13 32.639 0.2 A 6 LYS CD C 13 29.350 0.2 A 6 LYS CE C 13 42.192 0.2 A 6 LYS CG C 13 26.773 0.2 A 6 LYS N N 15 119.908 0.2 A 7 ILE H H 1 7.887 0.02 A 7 ILE HA H 1 3.615 0.02 A 7 ILE HB H 1 1.928 0.02 A 7 ILE HD1% H 1 0.863 0.02 A 7 ILE HG1y H 1 1.655 0.02 A 7 ILE HG1x H 1 1.102 0.02 A 7 ILE HG2% H 1 0.896 0.02 A 7 ILE C C 13 177.784 0.2 A 7 ILE CA C 13 64.351 0.2 A 7 ILE CB C 13 37.623 0.2 A 7 ILE CD1 C 13 12.617 0.2 A 7 ILE CG1 C 13 28.999 0.2 A 7 ILE CG2 C 13 17.205 0.2 A 7 ILE N N 15 120.487 0.2 A 8 ALA H H 1 8.062 0.02 A 8 ALA HA H 1 4.160 0.02 A 8 ALA HB% H 1 1.478 0.02 A 8 ALA C C 13 180.625 0.2 A 8 ALA CA C 13 55.102 0.2 A 8 ALA CB C 13 17.517 0.2 A 8 ALA N N 15 121.576 0.2 A 9 ARG H H 1 7.769 0.02 A 9 ARG HA H 1 4.226 0.02 A 9 ARG HBy H 1 2.243 0.02 A 9 ARG HBx H 1 1.969 0.02 A 9 ARG HDy H 1 3.458 0.02 A 9 ARG HDx H 1 2.994 0.02 A 9 ARG HE H 1 8.007 0.02 A 9 ARG HGy H 1 1.841 0.02 A 9 ARG HGx H 1 1.460 0.02 A 9 ARG C C 13 178.076 0.2 A 9 ARG CA C 13 57.517 0.2 A 9 ARG CB C 13 29.638 0.2 A 9 ARG CD C 13 43.191 0.2 A 9 ARG CG C 13 26.130 0.2 A 9 ARG N N 15 120.694 0.2 A 9 ARG NE N 15 85.585 0.2 A 10 ILE H H 1 8.462 0.02 A 10 ILE HA H 1 3.576 0.02 A 10 ILE HB H 1 2.041 0.02 A 10 ILE HD1% H 1 0.682 0.02 A 10 ILE HG1y H 1 1.905 0.02 A 10 ILE HG1x H 1 0.917 0.02 A 10 ILE HG2% H 1 0.794 0.02 A 10 ILE C C 13 179.221 0.2 A 10 ILE CA C 13 66.414 0.2 A 10 ILE CB C 13 37.872 0.2 A 10 ILE CD1 C 13 13.401 0.2 A 10 ILE CG1 C 13 31.233 0.2 A 10 ILE CG2 C 13 16.531 0.2 A 10 ILE N N 15 121.475 0.2 A 11 ASN H H 1 8.161 0.02 A 11 ASN HA H 1 4.485 0.02 A 11 ASN HBy H 1 2.900 0.02 A 11 ASN HBx H 1 2.811 0.02 A 11 ASN HD21 H 1 7.558 0.02 A 11 ASN HD22 H 1 6.881 0.02 A 11 ASN C C 13 178.124 0.2 A 11 ASN CA C 13 55.961 0.2 A 11 ASN CB C 13 37.642 0.2 A 11 ASN CG C 13 175.418 0.2 A 11 ASN N N 15 119.357 0.2 A 11 ASN ND2 N 15 112.248 0.2 A 12 GLU H H 1 8.528 0.02 A 12 GLU HA H 1 4.111 0.02 A 12 GLU HBy H 1 2.264 0.02 A 12 GLU HBx H 1 2.185 0.02 A 12 GLU HGy H 1 2.388 0.02 A 12 GLU HGx H 1 2.010 0.02 A 12 GLU C C 13 179.650 0.2 A 12 GLU CA C 13 59.252 0.2 A 12 GLU CB C 13 30.026 0.2 A 12 GLU CG C 13 36.091 0.2 A 12 GLU N N 15 124.689 0.2 A 13 LEU H H 1 8.669 0.02 A 13 LEU HA H 1 3.948 0.02 A 13 LEU HBy H 1 1.939 0.02 A 13 LEU HBx H 1 1.199 0.02 A 13 LEU HD1% H 1 0.778 0.02 A 13 LEU HD2% H 1 0.749 0.02 A 13 LEU HG H 1 1.772 0.02 A 13 LEU C C 13 178.491 0.2 A 13 LEU CA C 13 57.835 0.2 A 13 LEU CB C 13 41.160 0.2 A 13 LEU CD1 C 13 25.584 0.2 A 13 LEU CD2 C 13 21.656 0.2 A 13 LEU CG C 13 26.709 0.2 A 13 LEU N N 15 119.467 0.2 A 14 ALA H H 1 8.326 0.02 A 14 ALA HA H 1 4.076 0.02 A 14 ALA HB% H 1 1.525 0.02 A 14 ALA C C 13 180.903 0.2 A 14 ALA CA C 13 55.100 0.2 A 14 ALA CB C 13 17.838 0.2 A 14 ALA N N 15 122.290 0.2 A 15 ALA H H 1 7.794 0.02 A 15 ALA HA H 1 4.176 0.02 A 15 ALA HB% H 1 1.545 0.02 A 15 ALA C C 13 181.255 0.2 A 15 ALA CA C 13 55.196 0.2 A 15 ALA CB C 13 17.568 0.2 A 15 ALA N N 15 121.829 0.2 A 16 LYS H H 1 7.977 0.02 A 16 LYS HA H 1 4.026 0.02 A 16 LYS HBy H 1 1.896 0.02 A 16 LYS HBx H 1 1.514 0.02 A 16 LYS HDy H 1 1.663 0.02 A 16 LYS HDx H 1 1.548 0.02 A 16 LYS HEy H 1 2.936 0.02 A 16 LYS HEx H 1 2.859 0.02 A 16 LYS HGy H 1 1.775 0.02 A 16 LYS HGx H 1 1.320 0.02 A 16 LYS C C 13 179.086 0.2 A 16 LYS CA C 13 59.878 0.2 A 16 LYS CB C 13 32.727 0.2 A 16 LYS CD C 13 29.898 0.2 A 16 LYS CE C 13 42.030 0.2 A 16 LYS CG C 13 26.123 0.2 A 16 LYS N N 15 120.084 0.2 A 17 ALA H H 1 8.527 0.02 A 17 ALA HA H 1 4.026 0.02 A 17 ALA HB% H 1 1.573 0.02 A 17 ALA C C 13 181.147 0.2 A 17 ALA CA C 13 54.993 0.2 A 17 ALA CB C 13 17.858 0.2 A 17 ALA N N 15 123.164 0.2 A 18 LYS H H 1 8.125 0.02 A 18 LYS HA H 1 4.053 0.02 A 18 LYS HBy H 1 1.943 0.02 A 18 LYS HBx H 1 1.930 0.02 A 18 LYS HDx H 1 1.701 0.02 A 18 LYS HDy H 1 1.701 0.02 A 18 LYS HEx H 1 2.979 0.02 A 18 LYS HEy H 1 2.979 0.02 A 18 LYS HGy H 1 1.557 0.02 A 18 LYS HGx H 1 1.476 0.02 A 18 LYS C C 13 177.994 0.2 A 18 LYS CA C 13 58.961 0.2 A 18 LYS CB C 13 32.400 0.2 A 18 LYS CD C 13 29.364 0.2 A 18 LYS CE C 13 42.185 0.2 A 18 LYS CG C 13 25.038 0.2 A 18 LYS N N 15 120.927 0.2 A 19 ALA H H 1 7.659 0.02 A 19 ALA HA H 1 4.355 0.02 A 19 ALA HB% H 1 1.544 0.02 A 19 ALA C C 13 177.769 0.2 A 19 ALA CA C 13 52.453 0.2 A 19 ALA CB C 13 19.483 0.2 A 19 ALA N N 15 118.300 0.2 A 20 GLY H H 1 7.758 0.02 A 20 GLY HAy H 1 4.180 0.02 A 20 GLY HAx H 1 3.947 0.02 A 20 GLY C C 13 175.031 0.2 A 20 GLY CA C 13 45.907 0.2 A 20 GLY N N 15 105.949 0.2 A 21 VAL H H 1 7.678 0.02 A 21 VAL HA H 1 4.608 0.02 A 21 VAL HB H 1 2.424 0.02 A 21 VAL HG1% H 1 0.858 0.02 A 21 VAL HG2% H 1 0.859 0.02 A 21 VAL C C 13 175.837 0.2 A 21 VAL CA C 13 60.158 0.2 A 21 VAL CB C 13 32.525 0.2 A 21 VAL CG1 C 13 20.969 0.2 A 21 VAL CG2 C 13 18.785 0.2 A 21 VAL N N 15 109.739 0.2 A 22 ILE H H 1 6.842 0.02 A 22 ILE HA H 1 4.347 0.02 A 22 ILE HB H 1 1.287 0.02 A 22 ILE HD1% H 1 0.809 0.02 A 22 ILE HG1y H 1 1.799 0.02 A 22 ILE HG1x H 1 1.628 0.02 A 22 ILE HG2% H 1 0.870 0.02 A 22 ILE C C 13 174.145 0.2 A 22 ILE CA C 13 61.285 0.2 A 22 ILE CB C 13 40.142 0.2 A 22 ILE CD1 C 13 13.758 0.2 A 22 ILE CG1 C 13 30.502 0.2 A 22 ILE CG2 C 13 15.723 0.2 A 22 ILE N N 15 124.020 0.2 A 23 THR H H 1 9.104 0.02 A 23 THR HA H 1 4.597 0.02 A 23 THR HB H 1 4.798 0.02 A 23 THR HG2% H 1 1.323 0.02 A 23 THR C C 13 175.820 0.2 A 23 THR CA C 13 61.139 0.2 A 23 THR CB C 13 71.396 0.2 A 23 THR CG2 C 13 21.650 0.2 A 23 THR N N 15 120.184 0.2 A 24 GLU H H 1 9.011 0.02 A 24 GLU HA H 1 3.965 0.02 A 24 GLU HBy H 1 2.100 0.02 A 24 GLU HBx H 1 2.069 0.02 A 24 GLU HGy H 1 2.421 0.02 A 24 GLU HGx H 1 2.402 0.02 A 24 GLU C C 13 180.012 0.2 A 24 GLU CA C 13 60.049 0.2 A 24 GLU CB C 13 29.095 0.2 A 24 GLU CG C 13 36.489 0.2 A 24 GLU N N 15 120.289 0.2 A 25 GLU H H 1 8.917 0.02 A 25 GLU HA H 1 4.116 0.02 A 25 GLU HBy H 1 2.040 0.02 A 25 GLU HBx H 1 1.973 0.02 A 25 GLU HGy H 1 2.414 0.02 A 25 GLU HGx H 1 2.318 0.02 A 25 GLU C C 13 180.164 0.2 A 25 GLU CA C 13 60.042 0.2 A 25 GLU CB C 13 29.131 0.2 A 25 GLU CG C 13 36.837 0.2 A 25 GLU N N 15 120.676 0.2 A 26 GLU H H 1 7.837 0.02 A 26 GLU HA H 1 4.074 0.02 A 26 GLU HBy H 1 2.460 0.02 A 26 GLU HBx H 1 1.745 0.02 A 26 GLU HGy H 1 2.354 0.02 A 26 GLU HGx H 1 2.073 0.02 A 26 GLU C C 13 179.093 0.2 A 26 GLU CA C 13 58.684 0.2 A 26 GLU CB C 13 30.606 0.2 A 26 GLU CG C 13 37.538 0.2 A 26 GLU N N 15 121.997 0.2 A 27 LYS H H 1 8.659 0.02 A 27 LYS HA H 1 3.964 0.02 A 27 LYS HBy H 1 1.951 0.02 A 27 LYS HBx H 1 1.903 0.02 A 27 LYS HDx H 1 1.664 0.02 A 27 LYS HDy H 1 1.664 0.02 A 27 LYS HEy H 1 2.876 0.02 A 27 LYS HEx H 1 2.800 0.02 A 27 LYS HGy H 1 1.664 0.02 A 27 LYS HGx H 1 1.397 0.02 A 27 LYS C C 13 179.776 0.2 A 27 LYS CA C 13 60.129 0.2 A 27 LYS CB C 13 32.537 0.2 A 27 LYS CD C 13 29.901 0.2 A 27 LYS CE C 13 42.002 0.2 A 27 LYS CG C 13 26.074 0.2 A 27 LYS N N 15 121.367 0.2 A 28 ALA H H 1 7.648 0.02 A 28 ALA HA H 1 4.216 0.02 A 28 ALA HB% H 1 1.534 0.02 A 28 ALA C C 13 180.525 0.2 A 28 ALA CA C 13 55.014 0.2 A 28 ALA CB C 13 17.610 0.2 A 28 ALA N N 15 122.685 0.2 A 29 GLU H H 1 7.915 0.02 A 29 GLU HA H 1 3.971 0.02 A 29 GLU HBy H 1 2.258 0.02 A 29 GLU HBx H 1 2.047 0.02 A 29 GLU HGy H 1 2.385 0.02 A 29 GLU HGx H 1 2.041 0.02 A 29 GLU C C 13 178.193 0.2 A 29 GLU CA C 13 59.269 0.2 A 29 GLU CB C 13 29.467 0.2 A 29 GLU CG C 13 35.082 0.2 A 29 GLU N N 15 122.691 0.2 A 30 GLN H H 1 8.891 0.02 A 30 GLN HA H 1 3.805 0.02 A 30 GLN HBy H 1 2.398 0.02 A 30 GLN HBx H 1 2.092 0.02 A 30 GLN HE21 H 1 7.659 0.02 A 30 GLN HE22 H 1 6.157 0.02 A 30 GLN HGy H 1 2.358 0.02 A 30 GLN HGx H 1 2.185 0.02 A 30 GLN C C 13 177.828 0.2 A 30 GLN CA C 13 59.703 0.2 A 30 GLN CB C 13 29.404 0.2 A 30 GLN CD C 13 178.653 0.2 A 30 GLN CG C 13 33.681 0.2 A 30 GLN N N 15 119.325 0.2 A 30 GLN NE2 N 15 108.422 0.2 A 31 GLN H H 1 7.874 0.02 A 31 GLN HA H 1 4.085 0.02 A 31 GLN HBy H 1 2.216 0.02 A 31 GLN HBx H 1 2.192 0.02 A 31 GLN HE21 H 1 7.489 0.02 A 31 GLN HE22 H 1 6.891 0.02 A 31 GLN HGy H 1 2.511 0.02 A 31 GLN HGx H 1 2.484 0.02 A 31 GLN C C 13 178.371 0.2 A 31 GLN CA C 13 58.842 0.2 A 31 GLN CB C 13 28.283 0.2 A 31 GLN CD C 13 180.088 0.2 A 31 GLN CG C 13 33.406 0.2 A 31 GLN N N 15 118.010 0.2 A 31 GLN NE2 N 15 111.900 0.2 A 32 LYS H H 1 7.739 0.02 A 32 LYS HA H 1 4.096 0.02 A 32 LYS HBy H 1 2.028 0.02 A 32 LYS HBx H 1 1.997 0.02 A 32 LYS HDx H 1 1.694 0.02 A 32 LYS HDy H 1 1.694 0.02 A 32 LYS HEx H 1 2.979 0.02 A 32 LYS HEy H 1 2.979 0.02 A 32 LYS HGy H 1 1.608 0.02 A 32 LYS HGx H 1 1.440 0.02 A 32 LYS C C 13 179.952 0.2 A 32 LYS CA C 13 59.708 0.2 A 32 LYS CB C 13 32.403 0.2 A 32 LYS CD C 13 29.333 0.2 A 32 LYS CE C 13 42.185 0.2 A 32 LYS CG C 13 25.051 0.2 A 32 LYS N N 15 120.842 0.2 A 33 LEU H H 1 8.617 0.02 A 33 LEU HA H 1 4.153 0.02 A 33 LEU HBy H 1 1.918 0.02 A 33 LEU HBx H 1 1.353 0.02 A 33 LEU HD1% H 1 0.922 0.02 A 33 LEU HD2% H 1 0.964 0.02 A 33 LEU HG H 1 1.904 0.02 A 33 LEU C C 13 179.446 0.2 A 33 LEU CA C 13 57.774 0.2 A 33 LEU CB C 13 42.585 0.2 A 33 LEU CD1 C 13 26.394 0.2 A 33 LEU CD2 C 13 22.690 0.2 A 33 LEU CG C 13 27.026 0.2 A 33 LEU N N 15 120.088 0.2 A 34 ARG H H 1 8.413 0.02 A 34 ARG HA H 1 4.009 0.02 A 34 ARG HBy H 1 1.961 0.02 A 34 ARG HBx H 1 1.939 0.02 A 34 ARG HDy H 1 3.202 0.02 A 34 ARG HDx H 1 3.147 0.02 A 34 ARG HGy H 1 1.826 0.02 A 34 ARG HGx H 1 1.607 0.02 A 34 ARG C C 13 178.614 0.2 A 34 ARG CA C 13 59.839 0.2 A 34 ARG CB C 13 29.772 0.2 A 34 ARG CD C 13 43.454 0.2 A 34 ARG CG C 13 27.894 0.2 A 34 ARG N N 15 119.206 0.2 A 35 GLN H H 1 7.850 0.02 A 35 GLN HA H 1 4.085 0.02 A 35 GLN HBy H 1 2.279 0.02 A 35 GLN HBx H 1 2.190 0.02 A 35 GLN HE21 H 1 7.492 0.02 A 35 GLN HE22 H 1 6.897 0.02 A 35 GLN HGy H 1 2.574 0.02 A 35 GLN HGx H 1 2.488 0.02 A 35 GLN C C 13 178.621 0.2 A 35 GLN CA C 13 58.771 0.2 A 35 GLN CB C 13 28.331 0.2 A 35 GLN CD C 13 180.198 0.2 A 35 GLN CG C 13 34.090 0.2 A 35 GLN N N 15 117.434 0.2 A 35 GLN NE2 N 15 111.993 0.2 A 36 GLU H H 1 7.939 0.02 A 36 GLU HA H 1 4.015 0.02 A 36 GLU HBy H 1 2.172 0.02 A 36 GLU HBx H 1 2.100 0.02 A 36 GLU HGy H 1 2.449 0.02 A 36 GLU HGx H 1 2.186 0.02 A 36 GLU C C 13 178.975 0.2 A 36 GLU CA C 13 59.271 0.2 A 36 GLU CB C 13 29.750 0.2 A 36 GLU CG C 13 36.473 0.2 A 36 GLU N N 15 119.554 0.2 A 37 TYR H H 1 8.578 0.02 A 37 TYR HA H 1 4.164 0.02 A 37 TYR HBy H 1 3.252 0.02 A 37 TYR HBx H 1 3.027 0.02 A 37 TYR HDx H 1 7.026 0.02 A 37 TYR HDy H 1 7.026 0.02 A 37 TYR HEx H 1 6.763 0.02 A 37 TYR HEy H 1 6.763 0.02 A 37 TYR C C 13 177.550 0.2 A 37 TYR CA C 13 60.590 0.2 A 37 TYR CB C 13 38.709 0.2 A 37 TYR CDx C 13 132.917 0.2 A 37 TYR CDy C 13 132.917 0.2 A 37 TYR CEx C 13 118.294 0.2 A 37 TYR CEy C 13 118.294 0.2 A 37 TYR N N 15 120.782 0.2 A 38 LEU H H 1 8.229 0.02 A 38 LEU HA H 1 4.072 0.02 A 38 LEU HBy H 1 1.868 0.02 A 38 LEU HBx H 1 1.585 0.02 A 38 LEU HD1% H 1 0.922 0.02 A 38 LEU HD2% H 1 0.888 0.02 A 38 LEU HG H 1 1.868 0.02 A 38 LEU C C 13 178.983 0.2 A 38 LEU CA C 13 57.053 0.2 A 38 LEU CB C 13 42.020 0.2 A 38 LEU CD1 C 13 25.277 0.2 A 38 LEU CD2 C 13 22.928 0.2 A 38 LEU CG C 13 27.095 0.2 A 38 LEU N N 15 119.275 0.2 A 39 LYS H H 1 7.790 0.02 A 39 LYS HA H 1 4.152 0.02 A 39 LYS HBx H 1 1.886 0.02 A 39 LYS HBy H 1 1.886 0.02 A 39 LYS HDx H 1 1.689 0.02 A 39 LYS HDy H 1 1.689 0.02 A 39 LYS HEx H 1 2.975 0.02 A 39 LYS HEy H 1 2.984 0.02 A 39 LYS HGy H 1 1.574 0.02 A 39 LYS HGx H 1 1.454 0.02 A 39 LYS C C 13 178.123 0.2 A 39 LYS CA C 13 58.197 0.2 A 39 LYS CB C 13 32.466 0.2 A 39 LYS CD C 13 29.213 0.2 A 39 LYS CE C 13 42.174 0.2 A 39 LYS CG C 13 25.057 0.2 A 39 LYS N N 15 118.917 0.2 A 40 GLY H H 1 7.885 0.02 A 40 GLY HAy H 1 3.970 0.02 A 40 GLY HAx H 1 3.768 0.02 A 40 GLY C C 13 174.349 0.2 A 40 GLY CA C 13 45.758 0.2 A 40 GLY N N 15 106.796 0.2 A 41 PHE H H 1 7.859 0.02 A 41 PHE HA H 1 4.455 0.02 A 41 PHE HBy H 1 3.047 0.02 A 41 PHE HBx H 1 2.891 0.02 A 41 PHE HDx H 1 7.169 0.02 A 41 PHE HDy H 1 7.169 0.02 A 41 PHE HEx H 1 7.186 0.02 A 41 PHE HEy H 1 7.186 0.02 A 41 PHE HZ H 1 7.238 0.02 A 41 PHE C C 13 176.028 0.2 A 41 PHE CA C 13 58.735 0.2 A 41 PHE CB C 13 39.408 0.2 A 41 PHE CDx C 13 131.872 0.2 A 41 PHE CDy C 13 131.872 0.2 A 41 PHE CEx C 13 131.422 0.2 A 41 PHE CEy C 13 131.422 0.2 A 41 PHE CZ C 13 129.740 0.2 A 41 PHE N N 15 120.317 0.2 A 42 ARG H H 1 8.044 0.02 A 42 ARG HA H 1 4.269 0.02 A 42 ARG HBy H 1 1.850 0.02 A 42 ARG HBx H 1 1.763 0.02 A 42 ARG HDx H 1 3.171 0.02 A 42 ARG HDy H 1 3.171 0.02 A 42 ARG HGy H 1 1.618 0.02 A 42 ARG HGx H 1 1.589 0.02 A 42 ARG C C 13 176.487 0.2 A 42 ARG CA C 13 56.505 0.2 A 42 ARG CB C 13 30.801 0.2 A 42 ARG CD C 13 43.437 0.2 A 42 ARG CG C 13 27.282 0.2 A 42 ARG N N 15 121.581 0.2 A 43 SER H H 1 8.218 0.02 A 43 SER HA H 1 4.389 0.02 A 43 SER HBy H 1 3.926 0.02 A 43 SER HBx H 1 3.870 0.02 A 43 SER C C 13 174.872 0.2 A 43 SER CA C 13 58.809 0.2 A 43 SER CB C 13 63.615 0.2 A 43 SER N N 15 116.338 0.2 A 44 SER H H 1 8.247 0.02 A 44 SER HA H 1 4.441 0.02 A 44 SER HBy H 1 3.922 0.02 A 44 SER HBx H 1 3.868 0.02 A 44 SER C C 13 174.653 0.2 A 44 SER CA C 13 58.697 0.2 A 44 SER CB C 13 63.743 0.2 A 44 SER N N 15 117.375 0.2 A 45 MET H H 1 8.194 0.02 A 45 MET HA H 1 4.417 0.02 A 45 MET HBy H 1 2.055 0.02 A 45 MET HBx H 1 1.975 0.02 A 45 MET HGy H 1 2.542 0.02 A 45 MET HGx H 1 2.473 0.02 A 45 MET C C 13 176.033 0.2 A 45 MET CA C 13 55.795 0.2 A 45 MET CB C 13 32.840 0.2 A 45 MET CG C 13 32.014 0.2 A 45 MET N N 15 122.021 0.2 A 46 LYS H H 1 8.220 0.02 A 46 LYS HA H 1 4.276 0.02 A 46 LYS HBy H 1 1.801 0.02 A 46 LYS HBx H 1 1.730 0.02 A 46 LYS HDx H 1 1.659 0.02 A 46 LYS HDy H 1 1.659 0.02 A 46 LYS HEx H 1 2.975 0.02 A 46 LYS HEy H 1 2.975 0.02 A 46 LYS HGy H 1 1.428 0.02 A 46 LYS HGx H 1 1.358 0.02 A 46 LYS C C 13 176.299 0.2 A 46 LYS CA C 13 56.399 0.2 A 46 LYS CB C 13 32.834 0.2 A 46 LYS CD C 13 29.089 0.2 A 46 LYS CE C 13 42.169 0.2 A 46 LYS CG C 13 24.800 0.2 A 46 LYS N N 15 122.277 0.2 A 47 LEU H H 1 8.210 0.02 A 47 LEU HA H 1 4.299 0.02 A 47 LEU HBy H 1 1.573 0.02 A 47 LEU HBx H 1 1.483 0.02 A 47 LEU HD1% H 1 0.881 0.02 A 47 LEU HD2% H 1 0.821 0.02 A 47 LEU HG H 1 1.561 0.02 A 47 LEU C C 13 177.189 0.2 A 47 LEU CA C 13 55.134 0.2 A 47 LEU CB C 13 42.301 0.2 A 47 LEU CD1 C 13 24.964 0.2 A 47 LEU CD2 C 13 23.522 0.2 A 47 LEU CG C 13 27.118 0.2 A 47 LEU N N 15 123.549 0.2 A 48 GLU H H 1 8.366 0.02 A 48 GLU HA H 1 4.211 0.02 A 48 GLU HBy H 1 1.899 0.02 A 48 GLU HBx H 1 1.840 0.02 A 48 GLU HGy H 1 2.186 0.02 A 48 GLU HGx H 1 2.125 0.02 A 48 GLU C C 13 176.152 0.2 A 48 GLU CA C 13 56.461 0.2 A 48 GLU CB C 13 30.428 0.2 A 48 GLU CG C 13 36.149 0.2 A 48 GLU N N 15 121.590 0.2 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 7 ILE HA A 10 ILE HG1x 1.0 1.8 4.98 2 2 A 24 GLU HA A 27 LYS HBy 1.0 1.8 3.60 3 3 A 38 LEU HA A 38 LEU HG 1.0 1.8 4.53 4 4 A 33 LEU HA A 33 LEU HG 1.0 1.8 3.72 5 5 A 2 ILE HA A 2 ILE HG2% 1.0 1.8 4.00 6 6 A 6 LYS HA A 6 LYS HGy 1.0 1.8 4.02 7 7 A 7 ILE HA A 7 ILE HG2% 1.0 1.8 3.64 8 8 A 10 ILE HA A 10 ILE HG2% 1.0 1.8 3.72 9 9 A 12 GLU HA A 12 GLU HGy 1.0 1.8 4.20 10 10 A 16 LYS HA A 16 LYS HGx 1.0 1.8 4.20 11 11 A 18 LYS HA A 18 LYS HGy 1.0 1.8 4.51 12 12 A 21 VAL HA A 21 VAL HG1% 1.0 1.8 3.49 13 13 A 21 VAL HG2% A 22 ILE HA 1.0 1.8 4.28 14 14 A 22 ILE HA A 22 ILE HG2% 1.0 1.8 4.21 15 15 A 23 THR HA A 23 THR HG2% 1.0 1.8 3.66 16 16 A 25 GLU HA A 25 GLU HGy 1.0 1.8 4.30 17 17 A 30 GLN HGy A 31 GLN HA 1.0 1.8 4.83 18 18 A 27 LYS HA A 27 LYS HGy 1.0 1.8 3.98 19 19 A 29 GLU HA A 29 GLU HGy 1.0 1.8 4.38 20 20 A 30 GLN HGy A 30 GLN HA 1.0 1.8 3.93 21 21 A 32 LYS HA A 32 LYS HGy 1.0 1.8 4.41 22 22 A 34 ARG HA A 34 ARG HGx 1.0 1.8 4.22 23 23 A 36 GLU HA A 36 GLU HGy 1.0 1.8 4.39 24 24 A 39 LYS HA A 39 LYS HGy 1.0 1.8 4.41 25 25 A 6 LYS HA A 6 LYS HGx 1.0 1.8 4.02 26 26 A 12 GLU HA A 12 GLU HGx 1.0 1.8 4.02 27 27 A 16 LYS HA A 16 LYS HGy 1.0 1.8 3.99 28 28 A 18 LYS HA A 18 LYS HGx 1.0 1.8 4.51 29 29 A 27 LYS HA A 30 GLN HBx 1.0 1.8 4.08 30 30 A 25 GLU HA A 25 GLU HGx 1.0 1.8 4.30 31 31 A 27 LYS HA A 27 LYS HGx 1.0 1.8 3.98 32 32 A 30 GLN HA A 30 GLN HGx 1.0 1.8 4.42 33 33 A 32 LYS HA A 32 LYS HGx 1.0 1.8 4.41 34 34 A 39 LYS HA A 39 LYS HGx 1.0 1.8 4.41 35 35 A 13 LEU HA A 13 LEU HG 1.0 1.8 4.48 36 36 A 16 LYS HGx A 13 LEU HA 1.0 1.8 4.85 37 37 A 22 ILE HA A 22 ILE HD1% 1.0 1.8 4.09 38 38 A 33 LEU HA A 33 LEU HD1% 1.0 1.8 4.43 39 39 A 38 LEU HA A 38 LEU HD1% 1.0 1.8 4.42 40 40 A 9 ARG HA A 9 ARG HDy 1.0 1.8 4.20 41 41 A 34 ARG HA A 34 ARG HDy 1.0 1.8 5.24 42 42 A 37 TYR HA A 37 TYR HD% 1.0 1.8 4.35 43 43 A 41 PHE HA A 41 PHE HD% 1.0 1.8 4.50 44 44 A 6 LYS HA A 6 LYS HDx 1.0 1.8 4.53 45 45 A 16 LYS HA A 19 ALA HB% 1.0 1.8 3.58 46 46 A 32 LYS HA A 32 LYS HDx 1.0 1.8 4.65 47 46 A 32 LYS HA A 32 LYS HDy 1.0 1.8 4.65 48 47 A 34 ARG HA A 34 ARG HDx 1.0 1.8 5.24 49 48 A 42 ARG HA A 42 ARG HDx 1.0 1.8 4.88 50 48 A 42 ARG HA A 42 ARG HDy 1.0 1.8 4.88 51 49 A 2 ILE HA A 2 ILE HG1x 1.0 1.8 3.93 52 50 A 7 ILE HA A 7 ILE HG1x 1.0 1.8 4.40 53 51 A 10 ILE HG1x A 10 ILE HA 1.0 1.8 4.06 54 52 A 10 ILE HA A 13 LEU HBy 1.0 1.8 4.54 55 53 A 22 ILE HA A 22 ILE HG1y 1.0 1.8 3.96 56 54 A 2 ILE HA A 2 ILE HG1y 1.0 1.8 4.09 57 55 A 7 ILE HA A 7 ILE HG1y 1.0 1.8 4.07 58 56 A 10 ILE HA A 10 ILE HG1y 1.0 1.8 3.71 59 57 A 22 ILE HA A 22 ILE HG1x 1.0 1.8 3.96 60 58 A 6 LYS HA A 6 LYS HEy 1.0 1.8 6.05 61 59 A 6 LYS HA A 6 LYS HEx 1.0 1.8 6.05 62 60 A 32 LYS HA A 32 LYS HEx 1.0 1.8 6.05 63 60 A 32 LYS HA A 32 LYS HEy 1.0 1.8 6.05 64 61 A 39 LYS HA A 39 LYS HEx 1.0 1.8 6.05 65 62 A 39 LYS HA A 39 LYS HEy 1.0 1.8 6.05 66 63 A 15 ALA H A 15 ALA HB% 1.0 1.8 3.37 67 64 A 36 GLU H A 36 GLU HBy 1.0 1.8 4.44 68 65 A 47 LEU H A 46 LYS HBy 1.0 1.8 6.05 69 66 A 35 GLN HA A 38 LEU HBy 1.0 1.8 4.26 70 67 A 13 LEU HA A 16 LYS HBy 1.0 1.8 3.92 71 68 A 30 GLN HGx A 30 GLN HBy 1.0 1.8 2.93 72 69 A 7 ILE HB A 7 ILE HD1% 1.0 1.8 3.66 73 70 A 22 ILE HD1% A 22 ILE HB 1.0 1.8 3.86 74 71 A 33 LEU HBy A 33 LEU HD2% 1.0 1.8 3.99 75 72 A 34 ARG HBy A 34 ARG HDy 1.0 1.8 4.49 76 73 A 38 LEU HBy A 38 LEU HD2% 1.0 1.8 3.85 77 74 A 34 ARG HBx A 34 ARG HDx 1.0 1.8 4.63 78 75 A 7 ILE HG2% A 10 ILE HB 1.0 1.8 4.89 79 76 A 33 LEU HG A 33 LEU H 1.0 1.8 4.36 80 77 A 38 LEU HG A 38 LEU H 1.0 1.8 4.33 81 78 A 35 GLN HA A 35 GLN HGy 1.0 1.8 4.48 82 79 A 29 GLU HA A 29 GLU HGx 1.0 1.8 4.38 83 80 A 34 ARG HA A 34 ARG HGy 1.0 1.8 4.53 84 81 A 35 GLN HA A 35 GLN HGx 1.0 1.8 4.48 85 82 A 36 GLU HA A 36 GLU HGx 1.0 1.8 4.39 86 83 A 25 GLU H A 24 GLU HGy 1.0 1.8 6.05 87 84 A 27 LYS H A 27 LYS HGy 1.0 1.8 4.65 88 85 A 29 GLU H A 29 GLU HGy 1.0 1.8 5.21 89 86 A 30 GLN HGy A 30 GLN H 1.0 1.8 5.21 90 87 A 31 GLN H A 31 GLN HGy 1.0 1.8 5.20 91 88 A 9 ARG H A 9 ARG HGx 1.0 1.8 6.02 92 89 A 29 GLU H A 29 GLU HGx 1.0 1.8 5.21 93 90 A 31 GLN H A 31 GLN HGx 1.0 1.8 5.20 94 91 A 36 GLU H A 36 GLU HGx 1.0 1.8 4.71 95 92 A 30 GLN HGy A 30 GLN HBx 1.0 1.8 3.05 96 93 A 10 ILE HG1y A 33 LEU HBx 1.0 1.8 4.25 97 94 A 38 LEU HD1% A 38 LEU HBx 1.0 1.8 3.66 98 95 A 7 ILE HG2% A 7 ILE HG1x 1.0 1.8 3.74 99 96 A 7 ILE HG2% A 7 ILE HG1y 1.0 1.8 3.75 100 97 A 34 ARG HBx A 34 ARG H 1.0 1.8 4.22 101 98 A 47 LEU H A 46 LYS HBx 1.0 1.8 6.05 102 99 A 34 ARG HBx A 34 ARG HDy 1.0 1.8 4.63 103 100 A 38 LEU HD2% A 38 LEU HBx 1.0 1.8 3.82 104 101 A 32 LYS HDy A 32 LYS HBx 1.0 1.8 3.72 105 101 A 32 LYS HBx A 32 LYS HDx 1.0 1.8 3.72 106 102 A 32 LYS HDy A 32 LYS HBy 1.0 1.8 3.72 107 102 A 32 LYS HBy A 32 LYS HDx 1.0 1.8 3.72 108 103 A 34 ARG HBy A 34 ARG HDx 1.0 1.8 4.49 109 104 A 16 LYS HGx A 16 LYS HEy 1.0 1.8 4.61 110 105 A 16 LYS HGy A 16 LYS HEy 1.0 1.8 4.64 111 106 A 16 LYS HGx A 16 LYS HEx 1.0 1.8 4.61 112 107 A 18 LYS HGy A 18 LYS HEx 1.0 1.8 4.19 113 107 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 4.19 114 108 A 32 LYS HGy A 32 LYS HEx 1.0 1.8 4.21 115 108 A 32 LYS HEy A 32 LYS HGy 1.0 1.8 4.21 116 109 A 16 LYS HGy A 16 LYS HEx 1.0 1.8 4.64 117 110 A 18 LYS HEy A 18 LYS HGx 1.0 1.8 4.19 118 110 A 18 LYS HEx A 18 LYS HGx 1.0 1.8 4.19 119 111 A 32 LYS HEy A 32 LYS HGx 1.0 1.8 4.21 120 111 A 32 LYS HEx A 32 LYS HGx 1.0 1.8 4.21 121 112 A 33 LEU HD1% A 33 LEU HBy 1.0 1.8 3.55 122 113 A 38 LEU HD1% A 38 LEU HBy 1.0 1.8 3.60 123 114 A 13 LEU HD2% A 26 GLU HBx 1.0 1.8 4.35 124 115 A 13 LEU HBy A 13 LEU HD1% 1.0 1.8 3.92 125 116 A 13 LEU HBy A 13 LEU HD2% 1.0 1.8 4.02 126 117 A 13 LEU HD1% A 13 LEU HBx 1.0 1.8 4.05 127 118 A 33 LEU HD1% A 33 LEU HBx 1.0 1.8 4.05 128 119 A 13 LEU HD2% A 13 LEU HBx 1.0 1.8 3.86 129 120 A 33 LEU HD2% A 33 LEU HBx 1.0 1.8 3.71 130 121 A 18 LYS HBy A 18 LYS HDx 1.0 1.8 3.84 131 121 A 18 LYS HBy A 18 LYS HDy 1.0 1.8 3.84 132 122 A 18 LYS HBx A 18 LYS HDx 1.0 1.8 4.09 133 122 A 18 LYS HDy A 18 LYS HBx 1.0 1.8 4.09 134 123 A 27 LYS HBx A 27 LYS HDx 1.0 1.8 3.71 135 123 A 27 LYS HBx A 27 LYS HDy 1.0 1.8 3.71 136 124 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 4.53 137 124 A 42 ARG HBx A 42 ARG HDx 1.0 1.8 4.53 138 125 A 27 LYS HBy A 27 LYS HDx 1.0 1.8 3.72 139 125 A 27 LYS HBy A 27 LYS HDy 1.0 1.8 3.72 140 126 A 42 ARG HDy A 42 ARG HBy 1.0 1.8 4.53 141 126 A 42 ARG HBy A 42 ARG HDx 1.0 1.8 4.53 142 127 A 2 ILE HB A 2 ILE HD1% 1.0 1.8 3.88 143 128 A 10 ILE HB A 10 ILE HD1% 1.0 1.8 3.86 144 129 A 2 ILE HG2% A 2 ILE HD1% 1.0 1.8 5.10 145 130 A 10 ILE HG2% A 10 ILE HD1% 1.0 1.8 3.61 146 131 A 7 ILE HG2% A 7 ILE HD1% 1.0 1.8 2.64 147 132 A 22 ILE HG2% A 22 ILE HD1% 1.0 1.8 2.64 148 133 A 21 VAL HA A 21 VAL HG2% 1.0 1.8 4.57 149 134 A 22 ILE HG2% A 22 ILE H 1.0 1.8 3.76 150 135 A 2 ILE HG2% A 2 ILE HG1x 1.0 1.8 4.39 151 136 A 10 ILE HG1x A 10 ILE HG2% 1.0 1.8 4.17 152 137 A 22 ILE HG2% A 22 ILE HG1y 1.0 1.8 4.29 153 138 A 2 ILE HG2% A 2 ILE HG1y 1.0 1.8 4.07 154 139 A 10 ILE HG2% A 10 ILE HG1y 1.0 1.8 3.66 155 140 A 22 ILE HG2% A 22 ILE HG1x 1.0 1.8 4.29 156 141 A 7 ILE H A 6 LYS HBx 1.0 1.8 4.93 157 142 A 10 ILE H A 9 ARG HBx 1.0 1.8 4.65 158 143 A 16 LYS HBx A 17 ALA H 1.0 1.8 5.32 159 144 A 18 LYS HBy A 19 ALA H 1.0 1.8 4.33 160 145 A 18 LYS HBx A 19 ALA H 1.0 1.8 4.68 161 146 A 27 LYS HBx A 28 ALA H 1.0 1.8 4.69 162 147 A 30 GLN H A 29 GLU HBx 1.0 1.8 4.43 163 148 A 34 ARG HBx A 35 GLN H 1.0 1.8 4.61 164 149 A 38 LEU HBx A 39 LYS H 1.0 1.8 5.35 165 150 A 25 GLU H A 24 GLU HBx 1.0 1.8 4.25 166 151 A 33 LEU HBy A 34 ARG H 1.0 1.8 4.84 167 152 A 22 ILE HB A 23 THR H 1.0 1.8 5.46 168 153 A 30 GLN H A 29 GLU HGy 1.0 1.8 6.05 169 154 A 30 GLN HGy A 31 GLN H 1.0 1.8 5.57 170 155 A 12 GLU HGx A 13 LEU H 1.0 1.8 6.05 171 156 A 25 GLU H A 24 GLU HGx 1.0 1.8 6.05 172 157 A 30 GLN H A 29 GLU HGx 1.0 1.8 6.05 173 158 A 30 GLN HGx A 31 GLN H 1.0 1.8 5.53 174 159 A 37 TYR H A 36 GLU HGx 1.0 1.8 5.98 175 160 A 2 ILE HA A 2 ILE HD1% 1.0 1.8 4.93 176 161 A 7 ILE HA A 7 ILE HD1% 1.0 1.8 4.37 177 162 A 10 ILE HA A 10 ILE HD1% 1.0 1.8 4.35 178 163 A 13 LEU HA A 13 LEU HD1% 1.0 1.8 5.17 179 164 A 27 LYS HA A 13 LEU HD1% 1.0 1.8 5.54 180 165 A 38 LEU HD1% A 35 GLN HA 1.0 1.8 4.30 181 166 A 47 LEU HA A 47 LEU HD1% 1.0 1.8 5.14 182 167 A 13 LEU HA A 13 LEU HD2% 1.0 1.8 3.54 183 168 A 33 LEU HA A 33 LEU HD2% 1.0 1.8 3.50 184 169 A 38 LEU HA A 38 LEU HD2% 1.0 1.8 3.53 185 170 A 47 LEU HA A 47 LEU HD2% 1.0 1.8 5.14 186 171 A 38 LEU HG A 37 TYR HD% 1.0 1.8 5.01 187 172 A 37 TYR HD% A 2 ILE HG1x 1.0 1.8 6.05 188 173 A 37 TYR HD% A 34 ARG HGy 1.0 1.8 6.05 189 174 A 37 TYR HD% A 2 ILE HG1y 1.0 1.8 5.62 190 175 A 37 TYR HD% A 2 ILE HD1% 1.0 1.8 4.69 191 176 A 2 ILE HG2% A 37 TYR HD% 1.0 1.8 5.15 192 177 A 41 PHE HD% A 38 LEU HD2% 1.0 1.8 5.98 193 178 A 38 LEU HG A 37 TYR HE% 1.0 1.8 6.05 194 179 A 7 ILE HG1y A 37 TYR HE% 1.0 1.8 5.94 195 180 A 7 ILE HG2% A 37 TYR HE% 1.0 1.8 5.19 196 181 A 10 ILE HA A 30 GLN HGy 1.0 1.8 6.01 197 182 A 10 ILE HA A 30 GLN HGx 1.0 1.8 5.98 198 183 A 10 ILE HA A 9 ARG HGx 1.0 1.8 5.73 199 184 A 10 ILE HA A 33 LEU HBx 1.0 1.8 5.70 200 185 A 6 LYS HDy A 3 SER HBx 1.0 1.8 6.05 201 186 A 6 LYS HDy A 3 SER HBy 1.0 1.8 6.05 202 187 A 5 ALA HB% A 3 SER HBy 1.0 1.8 5.62 203 188 A 5 ALA HB% A 3 SER HBx 1.0 1.8 5.62 204 189 A 7 ILE HA A 11 ASN H 1.0 1.8 5.70 205 190 A 7 ILE HA A 10 ILE HB 1.0 1.8 3.96 206 191 A 22 ILE HA A 26 GLU HBy 1.0 1.8 5.35 207 192 A 37 TYR HA A 2 ILE HG1x 1.0 1.8 5.60 208 193 A 37 TYR HA A 2 ILE HB 1.0 1.8 5.16 209 194 A 37 TYR HA A 36 GLU HBx 1.0 1.8 5.82 210 195 A 37 TYR HA A 36 GLU HBy 1.0 1.8 5.82 211 196 A 37 TYR HA A 10 ILE HD1% 1.0 1.8 5.75 212 197 A 27 LYS HA A 29 GLU H 1.0 1.8 5.57 213 198 A 34 ARG HA A 37 TYR HBy 1.0 1.8 4.42 214 199 A 34 ARG HA A 37 TYR HBx 1.0 1.8 4.05 215 200 A 34 ARG HA A 10 ILE HD1% 1.0 1.8 4.63 216 201 A 30 GLN HA A 33 LEU HBy 1.0 1.8 4.21 217 202 A 30 GLN HA A 33 LEU HBx 1.0 1.8 5.03 218 203 A 30 GLN HA A 13 LEU HBx 1.0 1.8 5.84 219 204 A 30 GLN HA A 33 LEU HD1% 1.0 1.8 4.27 220 205 A 30 GLN HA A 13 LEU HD1% 1.0 1.8 3.88 221 206 A 6 LYS HA A 33 LEU HD1% 1.0 1.8 5.22 222 207 A 6 LYS HA A 33 LEU HD2% 1.0 1.8 5.38 223 208 A 13 LEU HD1% A 26 GLU HA 1.0 1.8 4.75 224 209 A 31 GLN HA A 34 ARG HDy 1.0 1.8 5.25 225 210 A 41 PHE HA A 38 LEU HD2% 1.0 1.8 6.05 226 211 A 13 LEU HA A 17 ALA H 1.0 1.8 5.64 227 212 A 16 LYS HGy A 13 LEU HA 1.0 1.8 5.29 228 213 A 12 GLU HGy A 9 ARG HA 1.0 1.8 5.31 229 214 A 9 ARG HA A 12 GLU HBx 1.0 1.8 4.48 230 215 A 33 LEU HD1% A 9 ARG HA 1.0 1.8 5.64 231 216 A 9 ARG HA A 13 LEU HD1% 1.0 1.8 5.96 232 217 A 9 ARG HA A 13 LEU HD2% 1.0 1.8 6.05 233 218 A 38 LEU HA A 41 PHE HD% 1.0 1.8 5.13 234 219 A 38 LEU HA A 37 TYR HD% 1.0 1.8 5.30 235 220 A 38 LEU HA A 37 TYR HBx 1.0 1.8 5.90 236 221 A 38 LEU HA A 41 PHE HBx 1.0 1.8 5.22 237 222 A 16 LYS HA A 21 VAL HG2% 1.0 1.8 3.70 238 223 A 34 ARG HA A 38 LEU H 1.0 1.8 5.33 239 224 A 11 ASN HA A 14 ALA HB% 1.0 1.8 3.73 240 225 A 10 ILE HG2% A 11 ASN HA 1.0 1.8 4.61 241 226 A 7 ILE HB A 4 ASN HA 1.0 1.8 3.96 242 227 A 7 ILE HG1x A 4 ASN HA 1.0 1.8 5.02 243 228 A 7 ILE HG1y A 4 ASN HA 1.0 1.8 5.47 244 229 A 7 ILE HD1% A 4 ASN HA 1.0 1.8 4.16 245 230 A 18 LYS HBy A 15 ALA HA 1.0 1.8 4.19 246 231 A 18 LYS HBx A 15 ALA HA 1.0 1.8 4.76 247 232 A 15 ALA HA A 18 LYS HDx 1.0 1.8 4.92 248 232 A 18 LYS HDy A 15 ALA HA 1.0 1.8 4.92 249 233 A 8 ALA HA A 11 ASN HBy 1.0 1.8 4.25 250 234 A 8 ALA HA A 11 ASN HBx 1.0 1.8 4.89 251 235 A 7 ILE HG2% A 8 ALA HA 1.0 1.8 4.58 252 236 A 31 GLN H A 28 ALA HA 1.0 1.8 4.43 253 237 A 27 LYS HBy A 28 ALA HA 1.0 1.8 5.29 254 238 A 19 ALA H A 17 ALA HA 1.0 1.8 5.57 255 239 A 22 ILE H A 17 ALA HA 1.0 1.8 4.69 256 240 A 22 ILE HB A 17 ALA HA 1.0 1.8 4.07 257 241 A 22 ILE HG2% A 17 ALA HA 1.0 1.8 3.56 258 242 A 5 ALA HA A 4 ASN HBx 1.0 1.8 5.03 259 242 A 4 ASN HBy A 5 ALA HA 1.0 1.8 5.03 260 243 A 18 LYS HBy A 19 ALA HA 1.0 1.8 5.87 261 244 A 21 VAL HG1% A 19 ALA HA 1.0 1.8 5.25 262 245 A 17 ALA HB% A 20 GLY HAy 1.0 1.8 6.05 263 246 A 19 ALA HB% A 20 GLY HAy 1.0 1.8 6.05 264 247 A 19 ALA HB% A 20 GLY HAx 1.0 1.8 5.51 265 248 A 22 ILE HG2% A 20 GLY HAy 1.0 1.8 5.24 266 249 A 21 VAL HG1% A 20 GLY HAx 1.0 1.8 4.95 267 250 A 21 VAL HA A 20 GLY HAx 1.0 1.8 6.01 268 251 A 21 VAL HA A 20 GLY HAy 1.0 1.8 6.05 269 252 A 30 GLN HGx A 34 ARG HDx 1.0 1.8 5.71 270 253 A 10 ILE HG1y A 34 ARG HDy 1.0 1.8 6.05 271 254 A 10 ILE HG1y A 34 ARG HDx 1.0 1.8 6.05 272 255 A 10 ILE HG2% A 34 ARG HDy 1.0 1.8 5.79 273 256 A 10 ILE HG2% A 34 ARG HDx 1.0 1.8 5.79 274 257 A 31 GLN HA A 34 ARG HDx 1.0 1.8 5.25 275 258 A 9 ARG HA A 9 ARG HDx 1.0 1.8 4.20 276 259 A 18 LYS HBy A 18 LYS HEx 1.0 1.8 4.36 277 259 A 18 LYS HEy A 18 LYS HBy 1.0 1.8 4.36 278 260 A 18 LYS HBx A 18 LYS HEx 1.0 1.8 4.70 279 260 A 18 LYS HEy A 18 LYS HBx 1.0 1.8 4.70 280 261 A 12 GLU HGx A 16 LYS HEy 1.0 1.8 4.94 281 262 A 33 LEU HD2% A 6 LYS HEy 1.0 1.8 4.92 282 263 A 21 VAL HG2% A 16 LYS HEy 1.0 1.8 4.94 283 264 A 15 ALA HA A 18 LYS HEx 1.0 1.8 4.42 284 264 A 18 LYS HEy A 15 ALA HA 1.0 1.8 4.42 285 265 A 12 GLU HGy A 16 LYS HEy 1.0 1.8 5.31 286 266 A 12 GLU HGx A 16 LYS HEx 1.0 1.8 4.94 287 267 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 5.90 288 268 A 10 ILE HA A 13 LEU HBx 1.0 1.8 5.52 289 269 A 30 GLN HGy A 13 LEU HBy 1.0 1.8 5.58 290 270 A 13 LEU HBy A 30 GLN HBy 1.0 1.8 5.20 291 271 A 13 LEU HBy A 14 ALA HB% 1.0 1.8 5.64 292 272 A 30 GLN HBx A 13 LEU HBx 1.0 1.8 5.28 293 273 A 30 GLN HBy A 13 LEU HBx 1.0 1.8 4.94 294 274 A 16 LYS HBy A 22 ILE HB 1.0 1.8 4.86 295 275 A 22 ILE HB A 17 ALA HB% 1.0 1.8 5.01 296 276 A 38 LEU HA A 41 PHE HBy 1.0 1.8 5.22 297 277 A 38 LEU HG A 41 PHE HBx 1.0 1.8 6.05 298 278 A 38 LEU HBx A 41 PHE HBx 1.0 1.8 6.05 299 279 A 38 LEU HBx A 41 PHE HBy 1.0 1.8 6.05 300 280 A 38 LEU HD2% A 41 PHE HBx 1.0 1.8 5.65 301 281 A 38 LEU HD2% A 41 PHE HBy 1.0 1.8 5.65 302 282 A 2 ILE HB A 6 LYS HDy 1.0 1.8 4.86 303 283 A 38 LEU HG A 37 TYR HBx 1.0 1.8 5.37 304 284 A 10 ILE HG1x A 37 TYR HBy 1.0 1.8 6.05 305 285 A 34 ARG HGy A 37 TYR HBx 1.0 1.8 6.05 306 286 A 34 ARG HBx A 37 TYR HBx 1.0 1.8 5.65 307 287 A 2 ILE HB A 37 TYR HBy 1.0 1.8 6.05 308 288 A 34 ARG HBx A 37 TYR HBy 1.0 1.8 6.05 309 289 A 2 ILE HD1% A 37 TYR HBx 1.0 1.8 5.07 310 290 A 10 ILE HG1y A 37 TYR HBy 1.0 1.8 5.78 311 291 A 38 LEU HD1% A 37 TYR HBx 1.0 1.8 5.41 312 292 A 7 ILE HB A 4 ASN HBx 1.0 1.8 5.14 313 292 A 7 ILE HB A 4 ASN HBy 1.0 1.8 5.14 314 293 A 5 ALA HB% A 4 ASN HBx 1.0 1.8 5.39 315 293 A 5 ALA HB% A 4 ASN HBy 1.0 1.8 5.39 316 294 A 8 ALA HB% A 4 ASN HBx 1.0 1.8 5.98 317 294 A 4 ASN HBy A 8 ALA HB% 1.0 1.8 5.98 318 295 A 7 ILE HD1% A 4 ASN HBx 1.0 1.8 5.18 319 295 A 7 ILE HD1% A 4 ASN HBy 1.0 1.8 5.18 320 296 A 14 ALA HB% A 11 ASN HBy 1.0 1.8 5.65 321 297 A 7 ILE HG2% A 11 ASN HBy 1.0 1.8 5.97 322 298 A 7 ILE HG2% A 11 ASN HBx 1.0 1.8 5.78 323 299 A 7 ILE HB A 8 ALA HA 1.0 1.8 5.86 324 300 A 7 ILE HB A 8 ALA HB% 1.0 1.8 5.32 325 301 A 23 THR HG2% A 26 GLU HGy 1.0 1.8 5.94 326 302 A 23 THR HG2% A 26 GLU HGx 1.0 1.8 5.94 327 303 A 13 LEU HD2% A 26 GLU HGy 1.0 1.8 4.83 328 304 A 13 LEU HD2% A 26 GLU HGx 1.0 1.8 4.83 329 305 A 28 ALA HB% A 25 GLU HGx 1.0 1.8 5.73 330 306 A 28 ALA HB% A 25 GLU HGy 1.0 1.8 5.73 331 307 A 6 LYS HDx A 36 GLU HGy 1.0 1.8 5.91 332 308 A 27 LYS HDy A 24 GLU HGy 1.0 1.8 6.05 333 308 A 24 GLU HGy A 27 LYS HDx 1.0 1.8 6.05 334 309 A 12 GLU HGy A 16 LYS HDy 1.0 1.8 6.05 335 310 A 27 LYS HDy A 24 GLU HGx 1.0 1.8 6.05 336 310 A 24 GLU HGx A 27 LYS HDx 1.0 1.8 6.05 337 311 A 23 THR HG2% A 24 GLU HGy 1.0 1.8 6.05 338 312 A 23 THR HG2% A 24 GLU HGx 1.0 1.8 6.05 339 313 A 6 LYS HDx A 36 GLU HGx 1.0 1.8 5.91 340 314 A 33 LEU HD2% A 36 GLU HGx 1.0 1.8 5.42 341 315 A 2 ILE HD1% A 36 GLU HGx 1.0 1.8 5.95 342 316 A 33 LEU HD2% A 36 GLU HGy 1.0 1.8 5.42 343 317 A 2 ILE HD1% A 36 GLU HGy 1.0 1.8 5.95 344 318 A 12 GLU HGx A 9 ARG HA 1.0 1.8 6.05 345 319 A 16 LYS HGx A 12 GLU HGx 1.0 1.8 5.26 346 320 A 12 GLU HGy A 16 LYS HGx 1.0 1.8 6.05 347 321 A 12 GLU HGy A 16 LYS HDx 1.0 1.8 6.05 348 322 A 13 LEU HD1% A 29 GLU HGx 1.0 1.8 4.79 349 323 A 33 LEU HD1% A 29 GLU HGx 1.0 1.8 4.59 350 324 A 38 LEU HD1% A 35 GLN HGx 1.0 1.8 6.05 351 325 A 38 LEU HD1% A 35 GLN HGy 1.0 1.8 6.05 352 326 A 30 GLN HGx A 14 ALA HA 1.0 1.8 6.05 353 327 A 31 GLN HA A 30 GLN HGx 1.0 1.8 6.05 354 328 A 27 LYS HA A 30 GLN HGx 1.0 1.8 6.05 355 329 A 30 GLN HGy A 27 LYS HA 1.0 1.8 5.52 356 330 A 30 GLN HGx A 34 ARG HDy 1.0 1.8 5.71 357 331 A 30 GLN HGy A 34 ARG HBy 1.0 1.8 6.05 358 332 A 30 GLN HGy A 34 ARG HGx 1.0 1.8 5.68 359 333 A 30 GLN HGx A 13 LEU HBy 1.0 1.8 4.94 360 334 A 34 ARG HGx A 30 GLN HGx 1.0 1.8 5.51 361 335 A 30 GLN HGy A 17 ALA HB% 1.0 1.8 6.05 362 336 A 30 GLN HGy A 34 ARG HGy 1.0 1.8 6.05 363 337 A 30 GLN HGx A 34 ARG HGy 1.0 1.8 6.05 364 338 A 30 GLN HGy A 13 LEU HBx 1.0 1.8 5.50 365 339 A 30 GLN HGx A 13 LEU HBx 1.0 1.8 5.73 366 340 A 30 GLN HGx A 10 ILE HG1y 1.0 1.8 6.05 367 341 A 30 GLN HGx A 33 LEU HD1% 1.0 1.8 6.05 368 342 A 10 ILE HG2% A 30 GLN HGy 1.0 1.8 5.35 369 343 A 30 GLN HGy A 13 LEU HD1% 1.0 1.8 5.73 370 344 A 10 ILE HG2% A 30 GLN HGx 1.0 1.8 5.15 371 345 A 30 GLN HGx A 13 LEU HD1% 1.0 1.8 5.49 372 346 A 30 GLN HGy A 10 ILE HG1y 1.0 1.8 6.05 373 347 A 2 ILE HD1% A 6 LYS HBy 1.0 1.8 4.74 374 348 A 22 ILE HA A 16 LYS HBy 1.0 1.8 5.12 375 349 A 18 LYS HBx A 19 ALA HA 1.0 1.8 5.21 376 350 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 5.90 377 351 A 30 GLN HBx A 27 LYS HBx 1.0 1.8 5.02 378 352 A 27 LYS HBy A 22 ILE HG2% 1.0 1.8 5.14 379 353 A 10 ILE HG1x A 33 LEU HBx 1.0 1.8 4.76 380 354 A 22 ILE HA A 26 GLU HBx 1.0 1.8 5.35 381 355 A 27 LYS H A 27 LYS HDx 1.0 1.8 4.98 382 355 A 27 LYS H A 27 LYS HDy 1.0 1.8 4.98 383 356 A 9 ARG HDy A 12 GLU HBx 1.0 1.8 5.83 384 357 A 9 ARG HDy A 12 GLU HBy 1.0 1.8 5.83 385 358 A 12 GLU HBx A 9 ARG HDx 1.0 1.8 5.83 386 359 A 9 ARG HDx A 12 GLU HBy 1.0 1.8 5.83 387 360 A 24 GLU HA A 27 LYS HDx 1.0 1.8 4.04 388 360 A 24 GLU HA A 27 LYS HDy 1.0 1.8 4.04 389 361 A 33 LEU HD1% A 9 ARG HBx 1.0 1.8 4.66 390 362 A 10 ILE HG2% A 34 ARG HBy 1.0 1.8 6.05 391 363 A 13 LEU HD1% A 29 GLU HBx 1.0 1.8 4.74 392 364 A 23 THR HG2% A 24 GLU HBy 1.0 1.8 5.73 393 365 A 30 GLN HBy A 17 ALA HB% 1.0 1.8 6.03 394 366 A 24 GLU HBx A 27 LYS HDx 1.0 1.8 6.05 395 366 A 27 LYS HDy A 24 GLU HBx 1.0 1.8 6.05 396 367 A 31 GLN HA A 30 GLN HBx 1.0 1.8 5.54 397 368 A 18 LYS HA A 18 LYS HDx 1.0 1.8 4.26 398 368 A 18 LYS HA A 18 LYS HDy 1.0 1.8 4.26 399 369 A 29 GLU HA A 32 LYS HDx 1.0 1.8 4.37 400 369 A 29 GLU HA A 32 LYS HDy 1.0 1.8 4.37 401 370 A 2 ILE HA A 6 LYS HDx 1.0 1.8 5.21 402 371 A 33 LEU HD2% A 6 LYS HDy 1.0 1.8 4.69 403 372 A 37 TYR HA A 2 ILE HG1y 1.0 1.8 5.42 404 373 A 12 GLU HGy A 13 LEU HG 1.0 1.8 6.01 405 374 A 33 LEU HD1% A 9 ARG HGx 1.0 1.8 4.16 406 375 A 13 LEU HD1% A 9 ARG HGy 1.0 1.8 4.96 407 376 A 33 LEU HD1% A 9 ARG HGy 1.0 1.8 4.02 408 377 A 13 LEU HD1% A 29 GLU HGy 1.0 1.8 4.79 409 378 A 13 LEU HD1% A 29 GLU HBy 1.0 1.8 4.74 410 379 A 30 GLN HBy A 13 LEU HD1% 1.0 1.8 3.92 411 380 A 9 ARG HGx A 13 LEU HD1% 1.0 1.8 4.39 412 381 A 6 LYS HDx A 33 LEU HD2% 1.0 1.8 4.31 413 382 A 33 LEU HD2% A 6 LYS HGy 1.0 1.8 4.62 414 383 A 33 LEU HD2% A 6 LYS HEx 1.0 1.8 4.92 415 384 A 13 LEU HD2% A 26 GLU HBy 1.0 1.8 4.35 416 385 A 12 GLU HGy A 13 LEU HD2% 1.0 1.8 5.16 417 386 A 13 LEU HD2% A 16 LYS HEy 1.0 1.8 5.06 418 387 A 13 LEU HD2% A 16 LYS HEx 1.0 1.8 5.06 419 388 A 13 LEU HD2% A 26 GLU HA 1.0 1.8 4.63 420 389 A 13 LEU HD2% A 13 LEU H 1.0 1.8 4.74 421 390 A 21 VAL HG2% A 16 LYS HEx 1.0 1.8 4.94 422 391 A 16 LYS HGx A 21 VAL HG2% 1.0 1.8 4.40 423 392 A 21 VAL HG2% A 16 LYS HBx 1.0 1.8 3.44 424 393 A 21 VAL HG2% A 16 LYS HGy 1.0 1.8 3.93 425 394 A 21 VAL HG2% A 16 LYS HBy 1.0 1.8 4.41 426 395 A 15 ALA HB% A 18 LYS HEx 1.0 1.8 4.60 427 395 A 15 ALA HB% A 18 LYS HEy 1.0 1.8 4.60 428 396 A 14 ALA HB% A 11 ASN HBx 1.0 1.8 4.94 429 397 A 7 ILE HG2% A 8 ALA HB% 1.0 1.8 4.80 430 398 A 22 ILE HG2% A 17 ALA HB% 1.0 1.8 3.54 431 399 A 7 ILE HG2% A 4 ASN HA 1.0 1.8 5.03 432 400 A 22 ILE HG2% A 27 LYS HEy 1.0 1.8 4.79 433 401 A 22 ILE HG2% A 23 THR HA 1.0 1.8 5.56 434 402 A 2 ILE HD1% A 37 TYR HBy 1.0 1.8 4.39 435 403 A 37 TYR HA A 2 ILE HD1% 1.0 1.8 4.28 436 404 A 22 ILE HD1% A 30 GLN HBy 1.0 1.8 4.49 437 405 A 22 ILE HD1% A 16 LYS HBy 1.0 1.8 4.43 438 406 A 22 ILE HD1% A 28 ALA H 1.0 1.8 6.05 439 407 A 33 LEU HA A 10 ILE HD1% 1.0 1.8 5.39 440 408 A 7 ILE HA A 10 ILE HD1% 1.0 1.8 3.95 441 409 A 10 ILE HD1% A 37 TYR HBx 1.0 1.8 4.70 442 410 A 10 ILE HD1% A 37 TYR HBy 1.0 1.8 4.22 443 411 A 33 LEU HBx A 10 ILE HD1% 1.0 1.8 4.11 444 412 A 7 ILE HD1% A 37 TYR HE% 1.0 1.8 5.02 445 413 A 2 ILE HD1% A 6 LYS HBx 1.0 1.8 4.74 446 414 A 22 ILE HD1% A 27 LYS HGx 1.0 1.8 4.64 447 415 A 22 ILE HD1% A 27 LYS HGy 1.0 1.8 4.64 448 416 A 33 LEU HD2% A 6 LYS HGx 1.0 1.8 4.62 449 417 A 2 ILE HD1% A 6 LYS HGx 1.0 1.8 5.33 450 418 A 2 ILE HD1% A 6 LYS HGy 1.0 1.8 5.33 451 419 A 10 ILE HG1y A 34 ARG HGy 1.0 1.8 4.52 452 420 A 34 ARG HGx A 10 ILE HG1y 1.0 1.8 4.84 453 421 A 10 ILE HG2% A 34 ARG HGy 1.0 1.8 5.32 454 422 A 34 ARG HGx A 10 ILE HD1% 1.0 1.8 6.05 455 423 A 10 ILE HG2% A 34 ARG HGx 1.0 1.8 5.86 456 424 A 34 ARG HGy A 10 ILE HD1% 1.0 1.8 4.96 457 425 A 7 ILE HG1y A 10 ILE HD1% 1.0 1.8 5.02 458 426 A 10 ILE HG2% A 14 ALA HB% 1.0 1.8 4.42 459 427 A 22 ILE H A 16 LYS HBx 1.0 1.8 5.79 460 428 A 37 TYR HD% A 7 ILE HG1y 1.0 1.8 6.05 461 429 A 22 ILE HG2% A 27 LYS HGx 1.0 1.8 4.21 462 430 A 22 ILE HG2% A 16 LYS HBy 1.0 1.8 4.59 463 431 A 22 ILE HG2% A 27 LYS HGy 1.0 1.8 4.21 464 432 A 22 ILE HG2% A 27 LYS HDx 1.0 1.8 4.16 465 432 A 22 ILE HG2% A 27 LYS HDy 1.0 1.8 4.16 466 433 A 10 ILE HG2% A 14 ALA HA 1.0 1.8 6.04 467 434 A 22 ILE HD1% A 14 ALA HA 1.0 1.8 6.05 468 435 A 17 ALA HB% A 14 ALA HA 1.0 1.8 3.45 469 436 A 22 ILE HD1% A 17 ALA HB% 1.0 1.8 3.77 470 437 A 31 GLN HA A 34 ARG HBx 1.0 1.8 5.14 471 438 A 35 GLN HA A 34 ARG HBx 1.0 1.8 5.63 472 439 A 31 GLN HA A 34 ARG HBy 1.0 1.8 3.89 473 440 A 5 ALA HA A 8 ALA H 1.0 1.8 4.50 474 441 A 37 TYR HD% A 10 ILE HD1% 1.0 1.8 4.81 475 442 A 37 TYR HD% A 38 LEU HD2% 1.0 1.8 4.76 476 443 A 33 LEU HD1% A 9 ARG HBy 1.0 1.8 4.66 477 444 A 33 LEU HD1% A 29 GLU HGy 1.0 1.8 4.59 478 445 A 22 ILE HA A 23 THR HG2% 1.0 1.8 4.74 479 446 A 33 LEU HBy A 10 ILE HD1% 1.0 1.8 4.96 480 447 A 10 ILE HG2% A 33 LEU HBx 1.0 1.8 5.96 481 448 A 33 LEU HBx A 13 LEU HD1% 1.0 1.8 6.05 482 449 A 10 ILE HG2% A 33 LEU HBy 1.0 1.8 6.05 483 450 A 33 LEU HBy A 13 LEU HD1% 1.0 1.8 6.05 484 451 A 38 LEU HG A 37 TYR HBy 1.0 1.8 6.05 485 452 A 38 LEU HG A 41 PHE HBy 1.0 1.8 6.05 486 453 A 22 ILE HA A 16 LYS HBx 1.0 1.8 4.95 487 454 A 13 LEU HA A 16 LYS HBx 1.0 1.8 4.97 488 455 A 13 LEU HD1% A 9 ARG HDy 1.0 1.8 5.37 489 456 A 13 LEU HD2% A 9 ARG HDy 1.0 1.8 5.86 490 457 A 13 LEU HD1% A 9 ARG HDx 1.0 1.8 5.37 491 458 A 13 LEU HD2% A 9 ARG HDx 1.0 1.8 5.86 492 459 A 21 VAL HG1% A 19 ALA HB% 1.0 1.8 3.90 493 460 A 34 ARG HA A 37 TYR HD% 1.0 1.8 5.59 494 461 A 33 LEU HG A 29 GLU HGx 1.0 1.8 5.28 495 462 A 33 LEU HG A 29 GLU HGy 1.0 1.8 5.28 496 463 A 25 GLU HA A 28 ALA HB% 1.0 1.8 3.27 497 464 A 31 GLN HA A 34 ARG HGy 1.0 1.8 5.44 498 465 A 31 GLN HA A 34 ARG HGx 1.0 1.8 5.35 499 466 A 2 ILE HG2% A 36 GLU HA 1.0 1.8 5.53 500 467 A 2 ILE HG2% A 37 TYR HA 1.0 1.8 4.58 501 468 A 5 ALA HA A 8 ALA HB% 1.0 1.8 3.48 502 469 A 27 LYS HA A 22 ILE HD1% 1.0 1.8 3.87 503 470 A 14 ALA HA A 18 LYS H 1.0 1.8 5.64 504 471 A 30 GLN HGy A 34 ARG HDy 1.0 1.8 5.74 505 472 A 30 GLN HGy A 34 ARG HDx 1.0 1.8 5.74 506 473 A 12 GLU HGy A 16 LYS HEx 1.0 1.8 5.31 507 474 A 16 LYS HBx A 21 VAL HB 1.0 1.8 5.62 508 475 A 19 ALA HB% A 21 VAL HB 1.0 1.8 5.20 509 476 A 19 ALA HB% A 18 LYS HBy 1.0 1.8 5.70 510 477 A 19 ALA HB% A 18 LYS HBx 1.0 1.8 6.05 511 478 A 30 GLN HBx A 13 LEU HD1% 1.0 1.8 4.91 512 479 A 30 GLN HBx A 22 ILE HD1% 1.0 1.8 5.39 513 480 A 9 ARG HA A 12 GLU HBy 1.0 1.8 4.48 514 481 A 22 ILE HG2% A 27 LYS HEx 1.0 1.8 4.79 515 482 A 10 ILE HA A 13 LEU HD1% 1.0 1.8 4.73 516 483 A 10 ILE HA A 13 LEU HG 1.0 1.8 5.39 517 484 A 30 GLN HBy A 13 LEU HD2% 1.0 1.8 5.15 518 485 A 35 GLN HA A 38 LEU H 1.0 1.8 4.42 519 486 A 47 LEU H A 46 LYS HA 1.0 1.8 3.92 520 487 A 7 ILE HB A 7 ILE H 1.0 1.8 3.54 521 488 A 8 ALA HB% A 8 ALA H 1.0 1.8 3.26 522 489 A 10 ILE HB A 10 ILE H 1.0 1.8 3.55 523 490 A 14 ALA HB% A 14 ALA H 1.0 1.8 3.26 524 491 A 15 ALA H A 14 ALA HB% 1.0 1.8 3.37 525 492 A 17 ALA H A 17 ALA HB% 1.0 1.8 3.20 526 493 A 19 ALA HB% A 19 ALA H 1.0 1.8 3.16 527 494 A 22 ILE HB A 22 ILE H 1.0 1.8 3.58 528 495 A 28 ALA H A 28 ALA HB% 1.0 1.8 3.23 529 496 A 6 LYS H A 6 LYS HBy 1.0 1.8 4.18 530 497 A 9 ARG H A 9 ARG HBy 1.0 1.8 3.77 531 498 A 11 ASN H A 11 ASN HBy 1.0 1.8 3.69 532 499 A 12 GLU H A 12 GLU HBy 1.0 1.8 3.60 533 500 A 13 LEU HBy A 13 LEU H 1.0 1.8 3.82 534 501 A 16 LYS HBy A 16 LYS H 1.0 1.8 3.72 535 502 A 24 GLU HBx A 24 GLU H 1.0 1.8 4.03 536 503 A 25 GLU H A 24 GLU HBy 1.0 1.8 3.67 537 504 A 25 GLU H A 25 GLU HBy 1.0 1.8 3.97 538 505 A 26 GLU H A 26 GLU HBy 1.0 1.8 4.19 539 506 A 27 LYS HBy A 27 LYS H 1.0 1.8 3.55 540 507 A 29 GLU H A 29 GLU HBy 1.0 1.8 3.69 541 508 A 30 GLN HBx A 30 GLN H 1.0 1.8 3.63 542 509 A 31 GLN H A 31 GLN HBy 1.0 1.8 3.73 543 510 A 31 GLN H A 31 GLN HBx 1.0 1.8 3.73 544 511 A 32 LYS H A 32 LYS HBy 1.0 1.8 3.56 545 512 A 34 ARG HBy A 34 ARG H 1.0 1.8 3.32 546 513 A 35 GLN H A 35 GLN HBy 1.0 1.8 4.10 547 514 A 36 GLU H A 35 GLN HBx 1.0 1.8 4.40 548 515 A 37 TYR H A 37 TYR HBx 1.0 1.8 3.82 549 516 A 38 LEU HBy A 39 LYS H 1.0 1.8 4.30 550 517 A 41 PHE H A 41 PHE HBy 1.0 1.8 4.38 551 518 A 6 LYS H A 6 LYS HBx 1.0 1.8 4.18 552 519 A 9 ARG H A 9 ARG HBx 1.0 1.8 3.77 553 520 A 11 ASN H A 11 ASN HBx 1.0 1.8 4.17 554 521 A 12 GLU H A 12 GLU HBx 1.0 1.8 3.60 555 522 A 13 LEU HBx A 13 LEU H 1.0 1.8 4.31 556 523 A 16 LYS HBx A 16 LYS H 1.0 1.8 3.96 557 524 A 18 LYS HBy A 18 LYS H 1.0 1.8 3.29 558 525 A 24 GLU HBy A 24 GLU H 1.0 1.8 3.54 559 526 A 25 GLU H A 25 GLU HBx 1.0 1.8 3.97 560 527 A 26 GLU H A 26 GLU HBx 1.0 1.8 4.19 561 528 A 27 LYS H A 27 LYS HBx 1.0 1.8 3.92 562 529 A 30 GLN HBy A 30 GLN H 1.0 1.8 3.60 563 530 A 32 LYS H A 32 LYS HBx 1.0 1.8 3.56 564 531 A 33 LEU H A 33 LEU HBx 1.0 1.8 4.30 565 532 A 35 GLN H A 35 GLN HBx 1.0 1.8 4.10 566 533 A 36 GLU H A 36 GLU HBx 1.0 1.8 4.44 567 534 A 37 TYR H A 37 TYR HBy 1.0 1.8 3.82 568 535 A 38 LEU H A 38 LEU HBx 1.0 1.8 4.16 569 536 A 41 PHE H A 41 PHE HBx 1.0 1.8 4.38 570 537 A 7 ILE H A 6 LYS H 1.0 1.8 2.84 571 538 A 9 ARG H A 8 ALA H 1.0 1.8 3.99 572 539 A 10 ILE H A 11 ASN H 1.0 1.8 3.96 573 540 A 13 LEU H A 14 ALA H 1.0 1.8 3.97 574 541 A 15 ALA H A 14 ALA H 1.0 1.8 3.82 575 542 A 17 ALA H A 16 LYS H 1.0 1.8 3.83 576 543 A 19 ALA H A 18 LYS H 1.0 1.8 3.62 577 544 A 19 ALA H A 20 GLY H 1.0 1.8 3.81 578 545 A 20 GLY H A 21 VAL H 1.0 1.8 3.55 579 546 A 22 ILE H A 23 THR H 1.0 1.8 5.89 580 547 A 29 GLU H A 28 ALA H 1.0 1.8 3.71 581 548 A 29 GLU H A 30 GLN H 1.0 1.8 3.63 582 549 A 31 GLN H A 32 LYS H 1.0 1.8 3.72 583 550 A 33 LEU H A 34 ARG H 1.0 1.8 3.92 584 551 A 38 LEU H A 37 TYR H 1.0 1.8 4.15 585 552 A 38 LEU H A 39 LYS H 1.0 1.8 4.03 586 553 A 39 LYS H A 40 GLY H 1.0 1.8 5.09 587 554 A 17 ALA H A 14 ALA HA 1.0 1.8 4.02 588 555 A 22 ILE HA A 23 THR H 1.0 1.8 3.49 589 556 A 23 THR HA A 24 GLU H 1.0 1.8 3.55 590 557 A 27 LYS HA A 30 GLN H 1.0 1.8 4.43 591 558 A 34 ARG HA A 37 TYR H 1.0 1.8 4.50 592 559 A 47 LEU HA A 48 GLU H 1.0 1.8 3.84 593 560 A 13 LEU HG A 13 LEU H 1.0 1.8 3.63 594 561 A 33 LEU HBy A 33 LEU H 1.0 1.8 3.39 595 562 A 38 LEU HBy A 38 LEU H 1.0 1.8 3.40 596 563 A 6 LYS H A 6 LYS HGy 1.0 1.8 4.31 597 564 A 7 ILE HG2% A 7 ILE H 1.0 1.8 4.33 598 565 A 9 ARG H A 9 ARG HGy 1.0 1.8 5.36 599 566 A 10 ILE HG2% A 10 ILE H 1.0 1.8 4.43 600 567 A 12 GLU HGy A 12 GLU H 1.0 1.8 4.98 601 568 A 16 LYS HGx A 16 LYS H 1.0 1.8 3.72 602 569 A 17 ALA HB% A 18 LYS H 1.0 1.8 3.51 603 570 A 21 VAL HG2% A 22 ILE H 1.0 1.8 3.56 604 571 A 23 THR HG2% A 23 THR H 1.0 1.8 3.58 605 572 A 26 GLU H A 26 GLU HGy 1.0 1.8 3.98 606 573 A 30 GLN HBx A 29 GLU H 1.0 1.8 5.94 607 574 A 32 LYS H A 32 LYS HGy 1.0 1.8 5.01 608 575 A 34 ARG HGx A 34 ARG H 1.0 1.8 4.22 609 576 A 35 GLN H A 35 GLN HGy 1.0 1.8 4.55 610 577 A 36 GLU H A 36 GLU HGy 1.0 1.8 4.71 611 578 A 46 LYS H A 46 LYS HGy 1.0 1.8 6.03 612 579 A 48 GLU H A 48 GLU HGy 1.0 1.8 5.33 613 580 A 6 LYS H A 6 LYS HGx 1.0 1.8 4.31 614 581 A 9 ARG H A 8 ALA HB% 1.0 1.8 3.72 615 582 A 12 GLU HGx A 12 GLU H 1.0 1.8 5.21 616 583 A 16 LYS HGy A 16 LYS H 1.0 1.8 4.19 617 584 A 24 GLU H A 24 GLU HGy 1.0 1.8 4.39 618 585 A 24 GLU H A 24 GLU HGx 1.0 1.8 4.39 619 586 A 26 GLU H A 26 GLU HGx 1.0 1.8 3.98 620 587 A 27 LYS H A 27 LYS HGx 1.0 1.8 4.65 621 588 A 29 GLU H A 29 GLU HBx 1.0 1.8 3.69 622 589 A 30 GLN HGx A 30 GLN H 1.0 1.8 4.98 623 590 A 32 LYS H A 32 LYS HGx 1.0 1.8 5.01 624 591 A 34 ARG HGy A 34 ARG H 1.0 1.8 4.84 625 592 A 35 GLN H A 35 GLN HGx 1.0 1.8 4.55 626 593 A 39 LYS H A 39 LYS HGx 1.0 1.8 4.85 627 594 A 46 LYS H A 46 LYS HGx 1.0 1.8 6.03 628 595 A 48 GLU H A 48 GLU HGx 1.0 1.8 5.33 629 596 A 7 ILE HD1% A 7 ILE H 1.0 1.8 4.74 630 597 A 10 ILE HD1% A 10 ILE H 1.0 1.8 4.49 631 598 A 13 LEU HD1% A 13 LEU H 1.0 1.8 4.16 632 599 A 22 ILE HD1% A 22 ILE H 1.0 1.8 4.92 633 600 A 33 LEU HD1% A 33 LEU H 1.0 1.8 4.32 634 601 A 37 TYR HD% A 37 TYR H 1.0 1.8 5.18 635 602 A 38 LEU HD1% A 38 LEU H 1.0 1.8 4.35 636 603 A 41 PHE HD% A 41 PHE H 1.0 1.8 5.53 637 604 A 47 LEU H A 47 LEU HD1% 1.0 1.8 6.02 638 605 A 9 ARG H A 9 ARG HDy 1.0 1.8 5.93 639 606 A 33 LEU HD2% A 33 LEU H 1.0 1.8 4.59 640 607 A 34 ARG H A 34 ARG HDy 1.0 1.8 5.72 641 608 A 38 LEU HD2% A 38 LEU H 1.0 1.8 4.62 642 609 A 47 LEU H A 47 LEU HD2% 1.0 1.8 6.02 643 610 A 7 ILE HG1x A 6 LYS H 1.0 1.8 4.63 644 611 A 9 ARG H A 9 ARG HDx 1.0 1.8 5.93 645 612 A 15 ALA HB% A 16 LYS H 1.0 1.8 3.41 646 613 A 18 LYS H A 18 LYS HDx 1.0 1.8 5.20 647 613 A 18 LYS HDy A 18 LYS H 1.0 1.8 5.20 648 614 A 32 LYS H A 32 LYS HDx 1.0 1.8 5.20 649 614 A 32 LYS HDy A 32 LYS H 1.0 1.8 5.20 650 615 A 34 ARG H A 34 ARG HDx 1.0 1.8 5.72 651 616 A 7 ILE HG1x A 7 ILE H 1.0 1.8 3.71 652 617 A 10 ILE HG1x A 10 ILE H 1.0 1.8 3.67 653 618 A 22 ILE H A 22 ILE HG1y 1.0 1.8 5.08 654 619 A 7 ILE HG1y A 7 ILE H 1.0 1.8 4.14 655 620 A 10 ILE HG1y A 10 ILE H 1.0 1.8 4.19 656 621 A 33 LEU HD1% A 10 ILE H 1.0 1.8 4.61 657 622 A 22 ILE H A 22 ILE HG1x 1.0 1.8 5.08 658 623 A 21 VAL HG2% A 21 VAL H 1.0 1.8 3.27 659 624 A 11 ASN HBy A 11 ASN HD21 1.0 1.8 4.32 660 625 A 11 ASN HBy A 11 ASN HD22 1.0 1.8 4.32 661 626 A 18 LYS H A 20 GLY H 1.0 1.8 5.26 662 627 A 23 THR H A 26 GLU HBy 1.0 1.8 4.37 663 628 A 23 THR H A 26 GLU HGx 1.0 1.8 5.25 664 629 A 23 THR H A 22 ILE HG1y 1.0 1.8 4.10 665 630 A 23 THR H A 22 ILE HG1x 1.0 1.8 4.10 666 631 A 22 ILE HG2% A 23 THR H 1.0 1.8 4.73 667 632 A 24 GLU H A 27 LYS HDx 1.0 1.8 5.60 668 632 A 27 LYS HDy A 24 GLU H 1.0 1.8 5.60 669 633 A 23 THR HG2% A 24 GLU H 1.0 1.8 4.50 670 634 A 24 GLU H A 23 THR HB 1.0 1.8 3.29 671 635 A 25 GLU H A 24 GLU H 1.0 1.8 4.42 672 636 A 25 GLU H A 28 ALA HB% 1.0 1.8 5.65 673 637 A 23 THR HG2% A 25 GLU H 1.0 1.8 5.21 674 638 A 23 THR HA A 25 GLU H 1.0 1.8 5.16 675 639 A 25 GLU H A 26 GLU H 1.0 1.8 3.96 676 640 A 30 GLN H A 31 GLN H 1.0 1.8 3.69 677 641 A 30 GLN H A 26 GLU HA 1.0 1.8 5.14 678 642 A 13 LEU HBy A 30 GLN H 1.0 1.8 6.05 679 643 A 33 LEU HBy A 30 GLN H 1.0 1.8 6.05 680 644 A 30 GLN H A 28 ALA HB% 1.0 1.8 5.57 681 645 A 33 LEU HD1% A 30 GLN H 1.0 1.8 5.57 682 646 A 30 GLN H A 13 LEU HD1% 1.0 1.8 4.05 683 647 A 13 LEU H A 14 ALA HB% 1.0 1.8 4.83 684 648 A 13 LEU H A 12 GLU HBy 1.0 1.8 4.43 685 649 A 13 LEU H A 12 GLU HBx 1.0 1.8 4.43 686 650 A 12 GLU HGy A 13 LEU H 1.0 1.8 5.09 687 651 A 10 ILE HA A 13 LEU H 1.0 1.8 4.91 688 652 A 9 ARG HA A 13 LEU H 1.0 1.8 5.37 689 653 A 27 LYS H A 23 THR H 1.0 1.8 5.33 690 654 A 25 GLU H A 27 LYS H 1.0 1.8 5.42 691 655 A 27 LYS H A 28 ALA H 1.0 1.8 3.81 692 656 A 22 ILE HD1% A 27 LYS H 1.0 1.8 4.55 693 657 A 29 GLU HA A 33 LEU H 1.0 1.8 5.31 694 658 A 30 GLN HA A 33 LEU H 1.0 1.8 4.81 695 659 A 30 GLN HGx A 33 LEU H 1.0 1.8 6.05 696 660 A 37 TYR H A 36 GLU HGy 1.0 1.8 5.98 697 661 A 37 TYR H A 36 GLU HBy 1.0 1.8 4.52 698 662 A 38 LEU HBy A 37 TYR H 1.0 1.8 5.03 699 663 A 37 TYR H A 36 GLU HBx 1.0 1.8 4.52 700 664 A 2 ILE HD1% A 37 TYR H 1.0 1.8 4.91 701 665 A 10 ILE HD1% A 37 TYR H 1.0 1.8 5.32 702 666 A 2 ILE HG2% A 37 TYR H 1.0 1.8 5.38 703 667 A 9 ARG HA A 12 GLU H 1.0 1.8 4.47 704 668 A 11 ASN HBy A 12 GLU H 1.0 1.8 4.10 705 669 A 11 ASN HBx A 12 GLU H 1.0 1.8 4.49 706 670 A 13 LEU HG A 12 GLU H 1.0 1.8 5.52 707 671 A 14 ALA HB% A 12 GLU H 1.0 1.8 5.14 708 672 A 10 ILE HG2% A 12 GLU H 1.0 1.8 6.05 709 673 A 13 LEU HD1% A 12 GLU H 1.0 1.8 6.05 710 674 A 13 LEU H A 12 GLU H 1.0 1.8 3.93 711 675 A 17 ALA H A 18 LYS H 1.0 1.8 3.87 712 676 A 17 ALA H A 20 GLY H 1.0 1.8 6.05 713 677 A 17 ALA H A 19 ALA H 1.0 1.8 5.19 714 678 A 16 LYS HBy A 17 ALA H 1.0 1.8 3.98 715 679 A 16 LYS HGx A 17 ALA H 1.0 1.8 5.25 716 680 A 22 ILE HB A 17 ALA H 1.0 1.8 4.44 717 681 A 22 ILE HD1% A 17 ALA H 1.0 1.8 4.18 718 682 A 10 ILE H A 8 ALA HB% 1.0 1.8 5.71 719 683 A 9 ARG HGx A 10 ILE H 1.0 1.8 5.91 720 684 A 10 ILE H A 9 ARG HBy 1.0 1.8 4.65 721 685 A 7 ILE HA A 10 ILE H 1.0 1.8 3.99 722 686 A 10 ILE H A 8 ALA HA 1.0 1.8 5.21 723 687 A 30 GLN HA A 34 ARG H 1.0 1.8 5.26 724 688 A 30 GLN HGx A 34 ARG H 1.0 1.8 5.61 725 689 A 33 LEU HBx A 34 ARG H 1.0 1.8 4.63 726 690 A 10 ILE HG1y A 34 ARG H 1.0 1.8 4.84 727 691 A 10 ILE HG2% A 34 ARG H 1.0 1.8 5.85 728 692 A 34 ARG H A 10 ILE HD1% 1.0 1.8 5.52 729 693 A 34 ARG H A 35 GLN H 1.0 1.8 3.87 730 694 A 48 GLU H A 47 LEU HBx 1.0 1.8 5.58 731 695 A 48 GLU H A 47 LEU HBy 1.0 1.8 5.58 732 696 A 48 GLU H A 47 LEU HG 1.0 1.8 6.05 733 697 A 14 ALA H A 12 GLU H 1.0 1.8 4.86 734 698 A 11 ASN HA A 14 ALA H 1.0 1.8 4.49 735 699 A 10 ILE HA A 14 ALA H 1.0 1.8 5.51 736 700 A 13 LEU HBy A 14 ALA H 1.0 1.8 4.26 737 701 A 13 LEU HG A 14 ALA H 1.0 1.8 5.18 738 702 A 13 LEU HBx A 14 ALA H 1.0 1.8 4.80 739 703 A 10 ILE HG2% A 14 ALA H 1.0 1.8 4.91 740 704 A 38 LEU H A 37 TYR HBx 1.0 1.8 4.02 741 705 A 38 LEU H A 37 TYR HBy 1.0 1.8 4.54 742 706 A 37 TYR HD% A 38 LEU H 1.0 1.8 5.08 743 707 A 11 ASN H A 12 GLU H 1.0 1.8 3.73 744 708 A 13 LEU H A 11 ASN H 1.0 1.8 5.46 745 709 A 11 ASN H A 8 ALA HA 1.0 1.8 4.59 746 710 A 10 ILE HB A 11 ASN H 1.0 1.8 3.81 747 711 A 10 ILE HG1x A 11 ASN H 1.0 1.8 4.99 748 712 A 11 ASN H A 8 ALA HB% 1.0 1.8 5.68 749 713 A 11 ASN H A 14 ALA HB% 1.0 1.8 6.01 750 714 A 7 ILE HG2% A 11 ASN H 1.0 1.8 4.80 751 715 A 10 ILE HG2% A 11 ASN H 1.0 1.8 4.23 752 716 A 10 ILE HD1% A 11 ASN H 1.0 1.8 5.48 753 717 A 21 VAL HG2% A 18 LYS H 1.0 1.8 5.97 754 718 A 22 ILE HG2% A 18 LYS H 1.0 1.8 6.05 755 719 A 15 ALA HA A 18 LYS H 1.0 1.8 4.44 756 720 A 2 ILE HB A 3 SER H 1.0 1.8 4.79 757 721 A 6 LYS HDy A 3 SER H 1.0 1.8 5.13 758 722 A 2 ILE HG1x A 3 SER H 1.0 1.8 5.29 759 723 A 2 ILE HG1y A 3 SER H 1.0 1.8 5.49 760 724 A 2 ILE HG2% A 3 SER H 1.0 1.8 5.42 761 725 A 4 ASN HA A 8 ALA H 1.0 1.8 4.88 762 726 A 42 ARG H A 41 PHE HBx 1.0 1.8 5.61 763 727 A 7 ILE HB A 8 ALA H 1.0 1.8 3.78 764 728 A 7 ILE HG1x A 8 ALA H 1.0 1.8 5.89 765 729 A 7 ILE HG1y A 8 ALA H 1.0 1.8 5.71 766 730 A 7 ILE HG2% A 8 ALA H 1.0 1.8 4.23 767 731 A 42 ARG H A 41 PHE HBy 1.0 1.8 5.61 768 732 A 21 VAL HG2% A 16 LYS H 1.0 1.8 4.89 769 733 A 22 ILE HD1% A 16 LYS H 1.0 1.8 5.18 770 734 A 13 LEU HA A 16 LYS H 1.0 1.8 4.26 771 735 A 36 GLU H A 35 GLN HBy 1.0 1.8 4.40 772 736 A 36 GLU H A 33 LEU HD2% 1.0 1.8 5.52 773 737 A 33 LEU HA A 36 GLU H 1.0 1.8 4.35 774 738 A 36 GLU H A 37 TYR H 1.0 1.8 4.03 775 739 A 27 LYS H A 29 GLU H 1.0 1.8 5.42 776 740 A 29 GLU H A 26 GLU HA 1.0 1.8 4.22 777 741 A 29 GLU H A 28 ALA HB% 1.0 1.8 3.71 778 742 A 29 GLU H A 13 LEU HD1% 1.0 1.8 5.13 779 743 A 7 ILE H A 8 ALA HB% 1.0 1.8 4.77 780 744 A 7 ILE H A 6 LYS HBy 1.0 1.8 4.93 781 745 A 7 ILE H A 4 ASN HA 1.0 1.8 4.74 782 746 A 7 ILE H A 8 ALA H 1.0 1.8 3.92 783 747 A 33 LEU H A 31 GLN H 1.0 1.8 5.48 784 748 A 27 LYS HA A 31 GLN H 1.0 1.8 5.31 785 749 A 29 GLU HA A 31 GLN H 1.0 1.8 5.95 786 750 A 30 GLN HBx A 31 GLN H 1.0 1.8 3.86 787 751 A 30 GLN HBy A 31 GLN H 1.0 1.8 4.43 788 752 A 31 GLN H A 28 ALA HB% 1.0 1.8 5.70 789 753 A 31 GLN H A 13 LEU HD1% 1.0 1.8 5.42 790 754 A 33 LEU H A 35 GLN H 1.0 1.8 5.60 791 755 A 35 GLN H A 37 TYR H 1.0 1.8 6.03 792 756 A 36 GLU H A 35 GLN H 1.0 1.8 4.08 793 757 A 34 ARG HBy A 35 GLN H 1.0 1.8 3.99 794 758 A 34 ARG HGx A 35 GLN H 1.0 1.8 5.43 795 759 A 34 ARG HGy A 35 GLN H 1.0 1.8 5.73 796 760 A 38 LEU HD1% A 35 GLN H 1.0 1.8 5.57 797 761 A 5 ALA HB% A 6 LYS H 1.0 1.8 3.98 798 762 A 28 ALA HB% A 26 GLU H 1.0 1.8 5.33 799 763 A 23 THR HG2% A 26 GLU H 1.0 1.8 5.09 800 764 A 22 ILE HD1% A 26 GLU H 1.0 1.8 5.50 801 765 A 24 GLU HA A 26 GLU H 1.0 1.8 5.28 802 766 A 27 LYS H A 26 GLU H 1.0 1.8 3.86 803 767 A 23 THR H A 26 GLU H 1.0 1.8 4.76 804 768 A 15 ALA H A 11 ASN HA 1.0 1.8 5.29 805 769 A 13 LEU HBy A 15 ALA H 1.0 1.8 6.05 806 770 A 15 ALA H A 18 LYS HBy 1.0 1.8 6.05 807 771 A 16 LYS HGx A 15 ALA H 1.0 1.8 5.31 808 772 A 15 ALA H A 16 LYS H 1.0 1.8 3.65 809 773 A 15 ALA H A 13 LEU H 1.0 1.8 5.41 810 774 A 15 ALA H A 17 ALA H 1.0 1.8 5.14 811 775 A 38 LEU HD1% A 39 LYS H 1.0 1.8 5.96 812 776 A 38 LEU HD2% A 39 LYS H 1.0 1.8 6.05 813 777 A 39 LYS H A 39 LYS HGy 1.0 1.8 4.85 814 778 A 9 ARG H A 10 ILE H 1.0 1.8 4.08 815 779 A 7 ILE HA A 9 ARG H 1.0 1.8 5.54 816 780 A 33 LEU HD1% A 9 ARG H 1.0 1.8 5.04 817 781 A 16 LYS HA A 20 GLY H 1.0 1.8 4.68 818 782 A 17 ALA HA A 20 GLY H 1.0 1.8 4.86 819 783 A 18 LYS HBy A 20 GLY H 1.0 1.8 6.05 820 784 A 18 LYS HBx A 20 GLY H 1.0 1.8 6.05 821 785 A 19 ALA HB% A 20 GLY H 1.0 1.8 4.13 822 786 A 21 VAL HG1% A 20 GLY H 1.0 1.8 5.24 823 787 A 21 VAL HG2% A 20 GLY H 1.0 1.8 5.65 824 788 A 22 ILE HG2% A 20 GLY H 1.0 1.8 6.00 825 789 A 22 ILE H A 20 GLY H 1.0 1.8 5.47 826 790 A 32 LYS H A 31 GLN HGy 1.0 1.8 6.05 827 791 A 32 LYS H A 31 GLN HGx 1.0 1.8 6.05 828 792 A 30 GLN HBx A 32 LYS H 1.0 1.8 6.05 829 793 A 29 GLU HA A 32 LYS H 1.0 1.8 4.62 830 794 A 33 LEU H A 32 LYS H 1.0 1.8 3.85 831 795 A 30 GLN H A 32 LYS H 1.0 1.8 5.68 832 796 A 19 ALA HB% A 21 VAL H 1.0 1.8 4.08 833 797 A 22 ILE HB A 21 VAL H 1.0 1.8 4.89 834 798 A 19 ALA HA A 21 VAL H 1.0 1.8 5.83 835 799 A 22 ILE HA A 21 VAL H 1.0 1.8 6.05 836 800 A 16 LYS HA A 21 VAL H 1.0 1.8 4.65 837 801 A 17 ALA HA A 21 VAL H 1.0 1.8 5.36 838 802 A 22 ILE H A 21 VAL H 1.0 1.8 3.52 839 803 A 13 LEU HBy A 30 GLN HE21 1.0 1.8 5.59 840 804 A 17 ALA HB% A 30 GLN HE21 1.0 1.8 4.41 841 805 A 13 LEU HBx A 30 GLN HE21 1.0 1.8 5.63 842 806 A 14 ALA HA A 30 GLN HE21 1.0 1.8 4.65 843 807 A 30 GLN H A 28 ALA H 1.0 1.8 5.18 844 808 A 25 GLU HA A 28 ALA H 1.0 1.8 4.42 845 809 A 30 GLN HBx A 28 ALA H 1.0 1.8 6.05 846 810 A 27 LYS HBy A 28 ALA H 1.0 1.8 3.83 847 811 A 28 ALA H A 27 LYS HDx 1.0 1.8 6.05 848 811 A 27 LYS HDy A 28 ALA H 1.0 1.8 6.05 849 812 A 7 ILE HG2% A 11 ASN HD21 1.0 1.8 4.29 850 813 A 8 ALA HA A 11 ASN HD21 1.0 1.8 5.19 851 814 A 31 GLN HE21 A 31 GLN HBy 1.0 1.8 6.05 852 815 A 31 GLN HE21 A 31 GLN HBx 1.0 1.8 6.05 853 816 A 31 GLN HE22 A 31 GLN HBy 1.0 1.8 6.05 854 817 A 31 GLN HE22 A 31 GLN HBx 1.0 1.8 6.05 855 818 A 7 ILE HG2% A 11 ASN HD22 1.0 1.8 4.29 856 819 A 8 ALA HA A 11 ASN HD22 1.0 1.8 5.19 857 820 A 22 ILE H A 21 VAL HB 1.0 1.8 5.33 858 821 A 16 LYS HBy A 22 ILE H 1.0 1.8 5.39 859 822 A 22 ILE H A 17 ALA HB% 1.0 1.8 6.05 860 823 A 19 ALA HB% A 22 ILE H 1.0 1.8 5.89 861 824 A 16 LYS HA A 22 ILE H 1.0 1.8 4.79 862 825 A 25 GLU H A 23 THR HB 1.0 1.8 3.63 863 826 A 30 GLN H A 29 GLU HBy 1.0 1.8 4.43 864 827 A 19 ALA H A 15 ALA HA 1.0 1.8 5.64 865 828 A 19 ALA H A 20 GLY HAy 1.0 1.8 6.05 866 829 A 21 VAL HG2% A 19 ALA H 1.0 1.8 4.86 867 830 A 14 ALA HA A 30 GLN HE22 1.0 1.8 4.65 868 831 A 17 ALA HB% A 30 GLN HE22 1.0 1.8 4.41 869 832 A 13 LEU HBx A 30 GLN HE22 1.0 1.8 5.63 870 833 A 13 LEU HBy A 30 GLN HE22 1.0 1.8 5.59 871 834 A 22 ILE HD1% A 23 THR H 1.0 1.8 4.63 872 835 A 13 LEU H A 11 ASN HA 1.0 1.8 5.94 873 836 A 31 GLN HA A 34 ARG H 1.0 1.8 4.31 874 837 A 36 GLU H A 2 ILE HB 1.0 1.8 6.05 875 838 A 34 ARG HBy A 31 GLN H 1.0 1.8 6.05 876 839 A 36 GLU HA A 39 LYS H 1.0 1.8 4.60 877 840 A 6 LYS HA A 9 ARG H 1.0 1.8 4.18 878 841 A 16 LYS HA A 19 ALA H 1.0 1.8 4.27 879 842 A 17 ALA H A 15 ALA HA 1.0 1.8 5.52 880 843 A 9 ARG HE A 9 ARG HBy 1.0 1.8 5.75 881 844 A 9 ARG HE A 9 ARG HBx 1.0 1.8 5.75 882 845 A 9 ARG HGy A 9 ARG HE 1.0 1.8 4.17 883 846 A 9 ARG HGx A 9 ARG HE 1.0 1.8 4.47 884 847 A 33 LEU HD1% A 9 ARG HE 1.0 1.8 5.28 885 848 A 13 LEU HD1% A 9 ARG HE 1.0 1.8 5.39 886 849 A 13 LEU HD2% A 9 ARG HE 1.0 1.8 6.05 887 850 A 27 LYS H A 22 ILE HG1y 1.0 1.8 4.61 888 851 A 27 LYS H A 22 ILE HG1x 1.0 1.8 4.61 889 852 A 23 THR H A 26 GLU HA 1.0 1.8 6.05 890 853 A 27 LYS H A 30 GLN H 1.0 1.8 5.71 891 854 A 34 ARG H A 32 LYS H 1.0 1.8 5.64 892 855 A 23 THR H A 26 GLU HGy 1.0 1.8 5.25 893 856 A 36 GLU H A 34 ARG H 1.0 1.8 5.63 894 857 A 23 THR H A 26 GLU HBx 1.0 1.8 4.37 895 858 A 2 ILE HA A 6 LYS HEx 1.0 1.8 5.87 896 858 A 2 ILE HA A 6 LYS HEy 1.0 1.8 5.87 897 859 A 2 ILE HG2% A 6 LYS HBx 1.0 1.8 5.26 898 859 A 2 ILE HG2% A 6 LYS HBy 1.0 1.8 5.26 899 860 A 2 ILE HG2% A 36 GLU HBy 1.0 1.8 4.80 900 860 A 2 ILE HG2% A 36 GLU HBx 1.0 1.8 4.80 901 861 A 2 ILE HG1y A 6 LYS HBx 1.0 1.8 4.82 902 861 A 2 ILE HG1y A 6 LYS HBy 1.0 1.8 4.82 903 862 A 2 ILE HG1y A 36 GLU HBy 1.0 1.8 5.87 904 862 A 2 ILE HG1y A 36 GLU HBx 1.0 1.8 5.87 905 863 A 2 ILE HG1x A 6 LYS HBx 1.0 1.8 4.85 906 863 A 2 ILE HG1x A 6 LYS HBy 1.0 1.8 4.85 907 864 A 2 ILE HG1x A 36 GLU HGy 1.0 1.8 5.80 908 864 A 2 ILE HG1x A 36 GLU HGx 1.0 1.8 5.80 909 865 A 2 ILE HD1% A 6 LYS HBx 1.0 1.8 3.84 910 865 A 2 ILE HD1% A 6 LYS HBy 1.0 1.8 3.84 911 866 A 2 ILE HD1% A 6 LYS HGx 1.0 1.8 4.46 912 866 A 2 ILE HD1% A 6 LYS HGy 1.0 1.8 4.46 913 867 A 2 ILE HD1% A 36 GLU HBy 1.0 1.8 4.51 914 867 A 2 ILE HD1% A 36 GLU HBx 1.0 1.8 4.51 915 868 A 2 ILE HD1% A 36 GLU HGy 1.0 1.8 5.03 916 868 A 2 ILE HD1% A 36 GLU HGx 1.0 1.8 5.03 917 869 A 5 ALA HB% A 3 SER HBy 1.0 1.8 4.84 918 869 A 5 ALA HB% A 3 SER HBx 1.0 1.8 4.84 919 870 A 3 SER HBx A 6 LYS HGx 1.0 1.8 5.60 920 870 A 3 SER HBy A 6 LYS HGx 1.0 1.8 5.60 921 870 A 6 LYS HGy A 3 SER HBy 1.0 1.8 5.60 922 870 A 6 LYS HGy A 3 SER HBx 1.0 1.8 5.60 923 871 A 6 LYS H A 6 LYS HBx 1.0 1.8 3.55 924 871 A 6 LYS H A 6 LYS HBy 1.0 1.8 3.55 925 872 A 6 LYS H A 6 LYS HGx 1.0 1.8 3.76 926 872 A 6 LYS H A 6 LYS HGy 1.0 1.8 3.76 927 873 A 6 LYS HA A 6 LYS HGx 1.0 1.8 3.29 928 873 A 6 LYS HA A 6 LYS HGy 1.0 1.8 3.29 929 874 A 6 LYS HDy A 6 LYS HBx 1.0 1.8 3.96 930 874 A 6 LYS HDy A 6 LYS HBy 1.0 1.8 3.96 931 875 A 6 LYS HDx A 6 LYS HBx 1.0 1.8 3.00 932 875 A 6 LYS HDx A 6 LYS HBy 1.0 1.8 3.00 933 876 A 7 ILE H A 6 LYS HBx 1.0 1.8 4.04 934 876 A 7 ILE H A 6 LYS HBy 1.0 1.8 4.04 935 877 A 33 LEU HD2% A 6 LYS HBx 1.0 1.8 3.98 936 877 A 33 LEU HD2% A 6 LYS HBy 1.0 1.8 3.98 937 878 A 6 LYS HEx A 6 LYS HGx 1.0 1.8 3.41 938 878 A 6 LYS HGy A 6 LYS HEx 1.0 1.8 3.41 939 878 A 6 LYS HEy A 6 LYS HGy 1.0 1.8 3.41 940 878 A 6 LYS HEy A 6 LYS HGx 1.0 1.8 3.41 941 879 A 33 LEU HD2% A 6 LYS HGx 1.0 1.8 3.98 942 879 A 33 LEU HD2% A 6 LYS HGy 1.0 1.8 3.98 943 880 A 6 LYS HDx A 36 GLU HBy 1.0 1.8 4.63 944 880 A 6 LYS HDx A 36 GLU HBx 1.0 1.8 4.63 945 881 A 6 LYS HDx A 36 GLU HGy 1.0 1.8 5.05 946 881 A 6 LYS HDx A 36 GLU HGx 1.0 1.8 5.05 947 882 A 33 LEU HD2% A 6 LYS HEx 1.0 1.8 3.96 948 882 A 33 LEU HD2% A 6 LYS HEy 1.0 1.8 3.96 949 883 A 6 LYS HEy A 36 GLU HGy 1.0 1.8 4.25 950 883 A 6 LYS HEx A 36 GLU HGy 1.0 1.8 4.25 951 883 A 36 GLU HGx A 6 LYS HEx 1.0 1.8 4.25 952 883 A 6 LYS HEy A 36 GLU HGx 1.0 1.8 4.25 953 884 A 7 ILE HB A 11 ASN HD21 1.0 1.8 5.76 954 884 A 7 ILE HB A 11 ASN HD22 1.0 1.8 5.76 955 885 A 7 ILE HG2% A 11 ASN HD21 1.0 1.8 3.74 956 885 A 7 ILE HG2% A 11 ASN HD22 1.0 1.8 3.74 957 886 A 8 ALA HA A 11 ASN HD21 1.0 1.8 4.44 958 886 A 8 ALA HA A 11 ASN HD22 1.0 1.8 4.44 959 887 A 8 ALA HB% A 11 ASN HD21 1.0 1.8 5.61 960 887 A 8 ALA HB% A 11 ASN HD22 1.0 1.8 5.61 961 888 A 9 ARG H A 9 ARG HDx 1.0 1.8 5.07 962 888 A 9 ARG H A 9 ARG HDy 1.0 1.8 5.07 963 889 A 9 ARG HA A 9 ARG HDx 1.0 1.8 3.64 964 889 A 9 ARG HA A 9 ARG HDy 1.0 1.8 3.64 965 890 A 9 ARG HA A 12 GLU HBy 1.0 1.8 3.88 966 890 A 9 ARG HA A 12 GLU HBx 1.0 1.8 3.88 967 891 A 9 ARG HGy A 9 ARG HBx 1.0 1.8 2.66 968 891 A 9 ARG HGy A 9 ARG HBy 1.0 1.8 2.66 969 892 A 9 ARG HBx A 9 ARG HDx 1.0 1.8 3.60 970 892 A 9 ARG HBy A 9 ARG HDx 1.0 1.8 3.60 971 892 A 9 ARG HDy A 9 ARG HBx 1.0 1.8 3.60 972 892 A 9 ARG HDy A 9 ARG HBy 1.0 1.8 3.60 973 893 A 9 ARG HE A 9 ARG HBx 1.0 1.8 4.92 974 893 A 9 ARG HE A 9 ARG HBy 1.0 1.8 4.92 975 894 A 10 ILE H A 9 ARG HBx 1.0 1.8 3.98 976 894 A 10 ILE H A 9 ARG HBy 1.0 1.8 3.98 977 895 A 11 ASN H A 9 ARG HBx 1.0 1.8 5.53 978 895 A 11 ASN H A 9 ARG HBy 1.0 1.8 5.53 979 896 A 13 LEU HD1% A 9 ARG HBx 1.0 1.8 5.87 980 896 A 13 LEU HD1% A 9 ARG HBy 1.0 1.8 5.87 981 897 A 33 LEU HD1% A 9 ARG HBx 1.0 1.8 4.07 982 897 A 33 LEU HD1% A 9 ARG HBy 1.0 1.8 4.07 983 898 A 9 ARG HDy A 12 GLU HBy 1.0 1.8 4.26 984 898 A 9 ARG HDx A 12 GLU HBy 1.0 1.8 4.26 985 898 A 12 GLU HBx A 9 ARG HDx 1.0 1.8 4.26 986 898 A 9 ARG HDy A 12 GLU HBx 1.0 1.8 4.26 987 899 A 13 LEU H A 9 ARG HDx 1.0 1.8 5.59 988 899 A 13 LEU H A 9 ARG HDy 1.0 1.8 5.59 989 900 A 13 LEU HG A 9 ARG HDx 1.0 1.8 4.72 990 900 A 13 LEU HG A 9 ARG HDy 1.0 1.8 4.72 991 901 A 33 LEU HD1% A 9 ARG HDx 1.0 1.8 5.72 992 901 A 33 LEU HD1% A 9 ARG HDy 1.0 1.8 5.72 993 902 A 9 ARG HE A 29 GLU HBy 1.0 1.8 5.87 994 902 A 9 ARG HE A 29 GLU HBx 1.0 1.8 5.87 995 903 A 10 ILE HG2% A 30 GLN HE21 1.0 1.8 5.52 996 903 A 10 ILE HG2% A 30 GLN HE22 1.0 1.8 5.52 997 904 A 11 ASN H A 11 ASN HD22 1.0 1.8 5.43 998 904 A 11 ASN H A 11 ASN HD21 1.0 1.8 5.43 999 905 A 11 ASN HBy A 11 ASN HD22 1.0 1.8 3.69 1000 905 A 11 ASN HBy A 11 ASN HD21 1.0 1.8 3.69 1001 906 A 11 ASN HBx A 11 ASN HD21 1.0 1.8 3.90 1002 906 A 11 ASN HBx A 11 ASN HD22 1.0 1.8 3.90 1003 907 A 13 LEU H A 12 GLU HBy 1.0 1.8 3.73 1004 907 A 13 LEU H A 12 GLU HBx 1.0 1.8 3.73 1005 908 A 13 LEU HG A 12 GLU HBy 1.0 1.8 5.27 1006 908 A 13 LEU HG A 12 GLU HBx 1.0 1.8 5.27 1007 909 A 13 LEU HD2% A 12 GLU HBy 1.0 1.8 5.87 1008 909 A 13 LEU HD2% A 12 GLU HBx 1.0 1.8 5.87 1009 910 A 12 GLU HGy A 16 LYS HDx 1.0 1.8 5.25 1010 910 A 12 GLU HGy A 16 LYS HDy 1.0 1.8 5.25 1011 911 A 12 GLU HGx A 16 LYS HDx 1.0 1.8 4.96 1012 911 A 12 GLU HGx A 16 LYS HDy 1.0 1.8 4.96 1013 912 A 12 GLU HGx A 16 LYS HEx 1.0 1.8 4.33 1014 912 A 12 GLU HGx A 16 LYS HEy 1.0 1.8 4.33 1015 913 A 13 LEU HA A 16 LYS HDx 1.0 1.8 4.14 1016 913 A 13 LEU HA A 16 LYS HDy 1.0 1.8 4.14 1017 914 A 13 LEU HA A 16 LYS HEx 1.0 1.8 5.59 1018 914 A 13 LEU HA A 16 LYS HEy 1.0 1.8 5.59 1019 915 A 13 LEU HBy A 30 GLN HE21 1.0 1.8 4.81 1020 915 A 13 LEU HBy A 30 GLN HE22 1.0 1.8 4.81 1021 916 A 13 LEU HBx A 30 GLN HE21 1.0 1.8 4.84 1022 916 A 13 LEU HBx A 30 GLN HE22 1.0 1.8 4.84 1023 917 A 13 LEU HD1% A 29 GLU HBy 1.0 1.8 4.10 1024 917 A 13 LEU HD1% A 29 GLU HBx 1.0 1.8 4.10 1025 918 A 13 LEU HD2% A 16 LYS HDx 1.0 1.8 3.86 1026 918 A 13 LEU HD2% A 16 LYS HDy 1.0 1.8 3.86 1027 919 A 13 LEU HD2% A 16 LYS HEx 1.0 1.8 4.37 1028 919 A 13 LEU HD2% A 16 LYS HEy 1.0 1.8 4.37 1029 920 A 13 LEU HD2% A 26 GLU HBy 1.0 1.8 3.59 1030 920 A 13 LEU HD2% A 26 GLU HBx 1.0 1.8 3.59 1031 921 A 14 ALA H A 30 GLN HE21 1.0 1.8 5.54 1032 921 A 14 ALA H A 30 GLN HE22 1.0 1.8 5.54 1033 922 A 14 ALA HA A 30 GLN HE21 1.0 1.8 4.07 1034 922 A 14 ALA HA A 30 GLN HE22 1.0 1.8 4.07 1035 923 A 16 LYS H A 16 LYS HDx 1.0 1.8 5.50 1036 923 A 16 LYS H A 16 LYS HDy 1.0 1.8 5.50 1037 924 A 16 LYS HA A 16 LYS HDx 1.0 1.8 4.79 1038 924 A 16 LYS HA A 16 LYS HDy 1.0 1.8 4.79 1039 925 A 16 LYS HBy A 16 LYS HDx 1.0 1.8 3.44 1040 925 A 16 LYS HBy A 16 LYS HDy 1.0 1.8 3.44 1041 926 A 16 LYS HBy A 16 LYS HEx 1.0 1.8 5.15 1042 926 A 16 LYS HBy A 16 LYS HEy 1.0 1.8 5.15 1043 927 A 16 LYS HBx A 16 LYS HDx 1.0 1.8 3.31 1044 927 A 16 LYS HBx A 16 LYS HDy 1.0 1.8 3.31 1045 928 A 21 VAL HG2% A 16 LYS HDx 1.0 1.8 4.11 1046 928 A 21 VAL HG2% A 16 LYS HDy 1.0 1.8 4.11 1047 929 A 22 ILE HB A 16 LYS HDx 1.0 1.8 4.58 1048 929 A 22 ILE HB A 16 LYS HDy 1.0 1.8 4.58 1049 930 A 21 VAL HG2% A 16 LYS HEx 1.0 1.8 4.32 1050 930 A 21 VAL HG2% A 16 LYS HEy 1.0 1.8 4.32 1051 931 A 17 ALA HB% A 30 GLN HE21 1.0 1.8 3.78 1052 931 A 17 ALA HB% A 30 GLN HE22 1.0 1.8 3.78 1053 932 A 18 LYS H A 18 LYS HGx 1.0 1.8 4.74 1054 932 A 18 LYS H A 18 LYS HGy 1.0 1.8 4.74 1055 933 A 18 LYS HA A 18 LYS HGx 1.0 1.8 3.88 1056 933 A 18 LYS HA A 18 LYS HGy 1.0 1.8 3.88 1057 934 A 18 LYS HEy A 18 LYS HGx 1.0 1.8 3.65 1058 934 A 18 LYS HGy A 18 LYS HEx 1.0 1.8 3.65 1059 934 A 18 LYS HEy A 18 LYS HGy 1.0 1.8 3.65 1060 934 A 18 LYS HEx A 18 LYS HGx 1.0 1.8 3.65 1061 935 A 22 ILE H A 22 ILE HG1y 1.0 1.8 4.46 1062 935 A 22 ILE H A 22 ILE HG1x 1.0 1.8 4.46 1063 936 A 22 ILE HA A 22 ILE HG1y 1.0 1.8 3.37 1064 936 A 22 ILE HA A 22 ILE HG1x 1.0 1.8 3.37 1065 937 A 22 ILE HA A 26 GLU HBy 1.0 1.8 4.44 1066 937 A 22 ILE HA A 26 GLU HBx 1.0 1.8 4.44 1067 938 A 22 ILE HB A 26 GLU HBy 1.0 1.8 5.73 1068 938 A 22 ILE HB A 26 GLU HBx 1.0 1.8 5.73 1069 939 A 22 ILE HG2% A 22 ILE HG1y 1.0 1.8 3.39 1070 939 A 22 ILE HG2% A 22 ILE HG1x 1.0 1.8 3.39 1071 940 A 22 ILE HG2% A 27 LYS HGx 1.0 1.8 3.63 1072 940 A 22 ILE HG2% A 27 LYS HGy 1.0 1.8 3.63 1073 941 A 23 THR H A 22 ILE HG1y 1.0 1.8 3.53 1074 941 A 23 THR H A 22 ILE HG1x 1.0 1.8 3.53 1075 942 A 22 ILE HG1x A 26 GLU HBy 1.0 1.8 3.43 1076 942 A 22 ILE HG1y A 26 GLU HBy 1.0 1.8 3.43 1077 942 A 26 GLU HBx A 22 ILE HG1y 1.0 1.8 3.43 1078 942 A 26 GLU HBx A 22 ILE HG1x 1.0 1.8 3.43 1079 943 A 27 LYS H A 22 ILE HG1y 1.0 1.8 3.87 1080 943 A 27 LYS H A 22 ILE HG1x 1.0 1.8 3.87 1081 944 A 22 ILE HG1x A 27 LYS HGx 1.0 1.8 4.36 1082 944 A 22 ILE HG1y A 27 LYS HGx 1.0 1.8 4.36 1083 944 A 27 LYS HGy A 22 ILE HG1y 1.0 1.8 4.36 1084 944 A 22 ILE HG1x A 27 LYS HGy 1.0 1.8 4.36 1085 945 A 22 ILE HD1% A 26 GLU HBy 1.0 1.8 4.39 1086 945 A 22 ILE HD1% A 26 GLU HBx 1.0 1.8 4.39 1087 946 A 22 ILE HD1% A 27 LYS HGx 1.0 1.8 3.93 1088 946 A 22 ILE HD1% A 27 LYS HGy 1.0 1.8 3.93 1089 947 A 22 ILE HD1% A 30 GLN HE21 1.0 1.8 4.35 1090 947 A 22 ILE HD1% A 30 GLN HE22 1.0 1.8 4.35 1091 948 A 23 THR H A 26 GLU HBy 1.0 1.8 3.58 1092 948 A 23 THR H A 26 GLU HBx 1.0 1.8 3.58 1093 949 A 23 THR H A 26 GLU HGy 1.0 1.8 4.55 1094 949 A 23 THR H A 26 GLU HGx 1.0 1.8 4.55 1095 950 A 23 THR HG2% A 26 GLU HBy 1.0 1.8 5.87 1096 950 A 23 THR HG2% A 26 GLU HBx 1.0 1.8 5.87 1097 951 A 23 THR HG2% A 26 GLU HGy 1.0 1.8 5.18 1098 951 A 23 THR HG2% A 26 GLU HGx 1.0 1.8 5.18 1099 952 A 24 GLU H A 24 GLU HGy 1.0 1.8 3.78 1100 952 A 24 GLU H A 24 GLU HGx 1.0 1.8 3.78 1101 953 A 24 GLU HA A 24 GLU HGy 1.0 1.8 3.65 1102 953 A 24 GLU HA A 24 GLU HGx 1.0 1.8 3.65 1103 954 A 24 GLU HA A 27 LYS HEx 1.0 1.8 5.87 1104 954 A 24 GLU HA A 27 LYS HEy 1.0 1.8 5.87 1105 955 A 25 GLU H A 24 GLU HGy 1.0 1.8 5.31 1106 955 A 25 GLU H A 24 GLU HGx 1.0 1.8 5.31 1107 956 A 25 GLU H A 25 GLU HGy 1.0 1.8 4.79 1108 956 A 25 GLU H A 25 GLU HGx 1.0 1.8 4.79 1109 957 A 25 GLU HA A 25 GLU HGy 1.0 1.8 3.65 1110 957 A 25 GLU HA A 25 GLU HGx 1.0 1.8 3.65 1111 958 A 26 GLU H A 25 GLU HBy 1.0 1.8 4.21 1112 958 A 26 GLU H A 25 GLU HBx 1.0 1.8 4.21 1113 959 A 28 ALA H A 25 GLU HGy 1.0 1.8 5.87 1114 959 A 28 ALA H A 25 GLU HGx 1.0 1.8 5.87 1115 960 A 28 ALA HB% A 25 GLU HGy 1.0 1.8 5.01 1116 960 A 28 ALA HB% A 25 GLU HGx 1.0 1.8 5.01 1117 961 A 26 GLU H A 26 GLU HBy 1.0 1.8 3.53 1118 961 A 26 GLU H A 26 GLU HBx 1.0 1.8 3.53 1119 962 A 26 GLU H A 26 GLU HGy 1.0 1.8 3.49 1120 962 A 26 GLU H A 26 GLU HGx 1.0 1.8 3.49 1121 963 A 26 GLU HA A 26 GLU HGy 1.0 1.8 3.50 1122 963 A 26 GLU HA A 26 GLU HGx 1.0 1.8 3.50 1123 964 A 26 GLU HA A 29 GLU HBy 1.0 1.8 3.96 1124 964 A 26 GLU HA A 29 GLU HBx 1.0 1.8 3.96 1125 965 A 27 LYS H A 26 GLU HBy 1.0 1.8 4.18 1126 965 A 27 LYS H A 26 GLU HBx 1.0 1.8 4.18 1127 966 A 27 LYS H A 26 GLU HGy 1.0 1.8 5.09 1128 966 A 27 LYS H A 26 GLU HGx 1.0 1.8 5.09 1129 967 A 27 LYS HA A 27 LYS HGx 1.0 1.8 3.36 1130 967 A 27 LYS HA A 27 LYS HGy 1.0 1.8 3.36 1131 968 A 27 LYS HA A 27 LYS HEx 1.0 1.8 4.81 1132 968 A 27 LYS HA A 27 LYS HEy 1.0 1.8 4.81 1133 969 A 27 LYS HBx A 27 LYS HEx 1.0 1.8 4.86 1134 969 A 27 LYS HBx A 27 LYS HEy 1.0 1.8 4.86 1135 970 A 27 LYS HEy A 27 LYS HGx 1.0 1.8 3.62 1136 970 A 27 LYS HEx A 27 LYS HGx 1.0 1.8 3.62 1137 970 A 27 LYS HGy A 27 LYS HEx 1.0 1.8 3.62 1138 970 A 27 LYS HGy A 27 LYS HEy 1.0 1.8 3.62 1139 971 A 28 ALA H A 27 LYS HGx 1.0 1.8 5.87 1140 971 A 28 ALA H A 27 LYS HGy 1.0 1.8 5.87 1141 972 A 30 GLN HBy A 27 LYS HGx 1.0 1.8 5.86 1142 972 A 30 GLN HBy A 27 LYS HGy 1.0 1.8 5.86 1143 973 A 28 ALA H A 29 GLU HBy 1.0 1.8 5.56 1144 973 A 28 ALA H A 29 GLU HBx 1.0 1.8 5.56 1145 974 A 28 ALA HA A 31 GLN HBx 1.0 1.8 4.16 1146 974 A 28 ALA HA A 31 GLN HBy 1.0 1.8 4.16 1147 975 A 28 ALA HB% A 29 GLU HBy 1.0 1.8 4.95 1148 975 A 28 ALA HB% A 29 GLU HBx 1.0 1.8 4.95 1149 976 A 29 GLU H A 29 GLU HBy 1.0 1.8 3.20 1150 976 A 29 GLU H A 29 GLU HBx 1.0 1.8 3.20 1151 977 A 29 GLU HA A 29 GLU HGy 1.0 1.8 3.55 1152 977 A 29 GLU HA A 29 GLU HGx 1.0 1.8 3.55 1153 978 A 29 GLU HA A 32 LYS HBx 1.0 1.8 4.51 1154 978 A 29 GLU HA A 32 LYS HBy 1.0 1.8 4.51 1155 979 A 30 GLN H A 29 GLU HBy 1.0 1.8 3.73 1156 979 A 30 GLN H A 29 GLU HBx 1.0 1.8 3.73 1157 980 A 33 LEU HD1% A 29 GLU HBy 1.0 1.8 5.10 1158 980 A 33 LEU HD1% A 29 GLU HBx 1.0 1.8 5.10 1159 981 A 30 GLN H A 29 GLU HGy 1.0 1.8 5.16 1160 981 A 30 GLN H A 29 GLU HGx 1.0 1.8 5.16 1161 982 A 32 LYS H A 29 GLU HGy 1.0 1.8 5.87 1162 982 A 32 LYS H A 29 GLU HGx 1.0 1.8 5.87 1163 983 A 33 LEU H A 29 GLU HGy 1.0 1.8 5.52 1164 983 A 33 LEU H A 29 GLU HGx 1.0 1.8 5.52 1165 984 A 33 LEU HG A 29 GLU HGy 1.0 1.8 4.55 1166 984 A 33 LEU HG A 29 GLU HGx 1.0 1.8 4.55 1167 985 A 30 GLN HBy A 30 GLN HE21 1.0 1.8 5.26 1168 985 A 30 GLN HBy A 30 GLN HE22 1.0 1.8 5.26 1169 986 A 30 GLN HGy A 30 GLN HE21 1.0 1.8 3.78 1170 986 A 30 GLN HGy A 30 GLN HE22 1.0 1.8 3.78 1171 987 A 30 GLN HGy A 34 ARG HDx 1.0 1.8 4.97 1172 987 A 30 GLN HGy A 34 ARG HDy 1.0 1.8 4.97 1173 988 A 30 GLN HGx A 34 ARG HDx 1.0 1.8 4.80 1174 988 A 30 GLN HGx A 34 ARG HDy 1.0 1.8 4.80 1175 989 A 31 GLN H A 31 GLN HBx 1.0 1.8 3.17 1176 989 A 31 GLN H A 31 GLN HBy 1.0 1.8 3.17 1177 990 A 31 GLN H A 31 GLN HGx 1.0 1.8 4.55 1178 990 A 31 GLN H A 31 GLN HGy 1.0 1.8 4.55 1179 991 A 31 GLN H A 32 LYS HBx 1.0 1.8 5.87 1180 991 A 31 GLN H A 32 LYS HBy 1.0 1.8 5.87 1181 992 A 31 GLN HA A 31 GLN HGx 1.0 1.8 3.89 1182 992 A 31 GLN HA A 31 GLN HGy 1.0 1.8 3.89 1183 993 A 31 GLN HA A 31 GLN HE21 1.0 1.8 5.87 1184 993 A 31 GLN HA A 31 GLN HE22 1.0 1.8 5.87 1185 994 A 32 LYS H A 31 GLN HBx 1.0 1.8 3.58 1186 994 A 32 LYS H A 31 GLN HBy 1.0 1.8 3.58 1187 995 A 33 LEU H A 31 GLN HBx 1.0 1.8 5.87 1188 995 A 33 LEU H A 31 GLN HBy 1.0 1.8 5.87 1189 996 A 32 LYS H A 31 GLN HGx 1.0 1.8 5.22 1190 996 A 32 LYS H A 31 GLN HGy 1.0 1.8 5.22 1191 997 A 32 LYS H A 32 LYS HBx 1.0 1.8 3.08 1192 997 A 32 LYS H A 32 LYS HBy 1.0 1.8 3.08 1193 998 A 32 LYS HA A 32 LYS HGx 1.0 1.8 3.83 1194 998 A 32 LYS HA A 32 LYS HGy 1.0 1.8 3.83 1195 999 A 32 LYS HBy A 32 LYS HEx 1.0 1.8 4.40 1196 999 A 32 LYS HBx A 32 LYS HEx 1.0 1.8 4.40 1197 999 A 32 LYS HEy A 32 LYS HBx 1.0 1.8 4.40 1198 999 A 32 LYS HEy A 32 LYS HBy 1.0 1.8 4.40 1199 1000 A 33 LEU H A 32 LYS HBx 1.0 1.8 3.61 1200 1000 A 33 LEU H A 32 LYS HBy 1.0 1.8 3.61 1201 1001 A 32 LYS HEy A 32 LYS HGx 1.0 1.8 3.66 1202 1001 A 32 LYS HEx A 32 LYS HGx 1.0 1.8 3.66 1203 1001 A 32 LYS HGy A 32 LYS HEx 1.0 1.8 3.66 1204 1001 A 32 LYS HEy A 32 LYS HGy 1.0 1.8 3.66 1205 1002 A 33 LEU HA A 36 GLU HBy 1.0 1.8 4.42 1206 1002 A 33 LEU HA A 36 GLU HBx 1.0 1.8 4.42 1207 1003 A 33 LEU HA A 36 GLU HGy 1.0 1.8 3.97 1208 1003 A 33 LEU HA A 36 GLU HGx 1.0 1.8 3.97 1209 1004 A 33 LEU HBx A 36 GLU HBy 1.0 1.8 5.87 1210 1004 A 33 LEU HBx A 36 GLU HBx 1.0 1.8 5.87 1211 1005 A 33 LEU HD2% A 36 GLU HBy 1.0 1.8 4.86 1212 1005 A 33 LEU HD2% A 36 GLU HBx 1.0 1.8 4.86 1213 1006 A 33 LEU HD2% A 36 GLU HGy 1.0 1.8 4.74 1214 1006 A 33 LEU HD2% A 36 GLU HGx 1.0 1.8 4.74 1215 1007 A 34 ARG H A 34 ARG HDx 1.0 1.8 5.02 1216 1007 A 34 ARG H A 34 ARG HDy 1.0 1.8 5.02 1217 1008 A 34 ARG HA A 34 ARG HDx 1.0 1.8 4.32 1218 1008 A 34 ARG HA A 34 ARG HDy 1.0 1.8 4.32 1219 1009 A 34 ARG HBy A 35 GLN HE22 1.0 1.8 5.87 1220 1009 A 34 ARG HBy A 35 GLN HE21 1.0 1.8 5.87 1221 1010 A 34 ARG HBx A 35 GLN HE22 1.0 1.8 5.87 1222 1010 A 34 ARG HBx A 35 GLN HE21 1.0 1.8 5.87 1223 1011 A 35 GLN H A 35 GLN HBx 1.0 1.8 3.41 1224 1011 A 35 GLN H A 35 GLN HBy 1.0 1.8 3.41 1225 1012 A 35 GLN H A 35 GLN HGx 1.0 1.8 3.88 1226 1012 A 35 GLN H A 35 GLN HGy 1.0 1.8 3.88 1227 1013 A 35 GLN HA A 35 GLN HGx 1.0 1.8 3.86 1228 1013 A 35 GLN HA A 35 GLN HGy 1.0 1.8 3.86 1229 1014 A 35 GLN HA A 35 GLN HE22 1.0 1.8 5.87 1230 1014 A 35 GLN HA A 35 GLN HE21 1.0 1.8 5.87 1231 1015 A 36 GLU H A 35 GLN HBx 1.0 1.8 3.85 1232 1015 A 36 GLU H A 35 GLN HBy 1.0 1.8 3.85 1233 1016 A 38 LEU HD1% A 35 GLN HGx 1.0 1.8 5.22 1234 1016 A 38 LEU HD1% A 35 GLN HGy 1.0 1.8 5.22 1235 1017 A 36 GLU H A 36 GLU HBy 1.0 1.8 3.72 1236 1017 A 36 GLU H A 36 GLU HBx 1.0 1.8 3.72 1237 1018 A 36 GLU H A 36 GLU HGy 1.0 1.8 3.89 1238 1018 A 36 GLU H A 36 GLU HGx 1.0 1.8 3.89 1239 1019 A 36 GLU HA A 39 LYS HGx 1.0 1.8 3.89 1240 1019 A 36 GLU HA A 39 LYS HGy 1.0 1.8 3.89 1241 1020 A 36 GLU HA A 39 LYS HEy 1.0 1.8 4.35 1242 1020 A 36 GLU HA A 39 LYS HEx 1.0 1.8 4.35 1243 1021 A 36 GLU HBx A 36 GLU HGy 1.0 1.8 2.40 1244 1021 A 36 GLU HBy A 36 GLU HGy 1.0 1.8 2.40 1245 1021 A 36 GLU HGx A 36 GLU HBy 1.0 1.8 2.40 1246 1021 A 36 GLU HBx A 36 GLU HGx 1.0 1.8 2.40 1247 1022 A 37 TYR H A 36 GLU HGy 1.0 1.8 5.25 1248 1022 A 37 TYR H A 36 GLU HGx 1.0 1.8 5.25 1249 1023 A 36 GLU HGx A 39 LYS HGx 1.0 1.8 5.65 1250 1023 A 36 GLU HGy A 39 LYS HGx 1.0 1.8 5.65 1251 1023 A 39 LYS HGy A 36 GLU HGy 1.0 1.8 5.65 1252 1023 A 36 GLU HGx A 39 LYS HGy 1.0 1.8 5.65 1253 1024 A 38 LEU HA A 41 PHE HBx 1.0 1.8 4.50 1254 1024 A 38 LEU HA A 41 PHE HBy 1.0 1.8 4.50 1255 1025 A 38 LEU HBy A 41 PHE HBx 1.0 1.8 5.87 1256 1025 A 38 LEU HBy A 41 PHE HBy 1.0 1.8 5.87 1257 1026 A 38 LEU HD2% A 41 PHE HBx 1.0 1.8 4.76 1258 1026 A 38 LEU HD2% A 41 PHE HBy 1.0 1.8 4.76 1259 1027 A 39 LYS H A 39 LYS HBx 1.0 1.8 3.86 1260 1027 A 39 LYS H A 39 LYS HBy 1.0 1.8 3.86 1261 1028 A 39 LYS H A 39 LYS HGx 1.0 1.8 3.90 1262 1028 A 39 LYS H A 39 LYS HGy 1.0 1.8 3.90 1263 1029 A 39 LYS H A 39 LYS HDx 1.0 1.8 5.56 1264 1029 A 39 LYS H A 39 LYS HDy 1.0 1.8 5.56 1265 1030 A 39 LYS HA A 39 LYS HGx 1.0 1.8 3.87 1266 1030 A 39 LYS HA A 39 LYS HGy 1.0 1.8 3.87 1267 1031 A 39 LYS HA A 39 LYS HDx 1.0 1.8 4.60 1268 1031 A 39 LYS HA A 39 LYS HDy 1.0 1.8 4.60 1269 1032 A 39 LYS HBx A 39 LYS HDx 1.0 1.8 3.32 1270 1032 A 39 LYS HBy A 39 LYS HDx 1.0 1.8 3.32 1271 1032 A 39 LYS HDy A 39 LYS HBx 1.0 1.8 3.32 1272 1032 A 39 LYS HBy A 39 LYS HDy 1.0 1.8 3.32 1273 1033 A 39 LYS HBx A 39 LYS HEy 1.0 1.8 5.24 1274 1033 A 39 LYS HBy A 39 LYS HEy 1.0 1.8 5.24 1275 1033 A 39 LYS HEx A 39 LYS HBx 1.0 1.8 5.24 1276 1033 A 39 LYS HEx A 39 LYS HBy 1.0 1.8 5.24 1277 1034 A 40 GLY H A 39 LYS HBx 1.0 1.8 4.42 1278 1034 A 40 GLY H A 39 LYS HBy 1.0 1.8 4.42 1279 1035 A 39 LYS HBx A 40 GLY HAy 1.0 1.8 5.10 1280 1035 A 39 LYS HBy A 40 GLY HAy 1.0 1.8 5.10 1281 1035 A 40 GLY HAx A 39 LYS HBx 1.0 1.8 5.10 1282 1035 A 39 LYS HBy A 40 GLY HAx 1.0 1.8 5.10 1283 1036 A 39 LYS HEy A 39 LYS HGx 1.0 1.8 3.64 1284 1036 A 39 LYS HGy A 39 LYS HEy 1.0 1.8 3.64 1285 1036 A 39 LYS HGy A 39 LYS HEx 1.0 1.8 3.64 1286 1036 A 39 LYS HEx A 39 LYS HGx 1.0 1.8 3.64 1287 1037 A 41 PHE H A 41 PHE HBx 1.0 1.8 3.78 1288 1037 A 41 PHE H A 41 PHE HBy 1.0 1.8 3.78 1289 1038 A 41 PHE HA A 42 ARG HGy 1.0 1.8 5.20 1290 1038 A 41 PHE HA A 42 ARG HGx 1.0 1.8 5.20 1291 1039 A 41 PHE HBx A 42 ARG HGy 1.0 1.8 5.24 1292 1039 A 41 PHE HBy A 42 ARG HGy 1.0 1.8 5.24 1293 1039 A 42 ARG HGx A 41 PHE HBx 1.0 1.8 5.24 1294 1039 A 41 PHE HBy A 42 ARG HGx 1.0 1.8 5.24 1295 1040 A 42 ARG H A 42 ARG HGy 1.0 1.8 4.91 1296 1040 A 42 ARG H A 42 ARG HGx 1.0 1.8 4.91 1297 1041 A 42 ARG HA A 42 ARG HGy 1.0 1.8 4.08 1298 1041 A 42 ARG HA A 42 ARG HGx 1.0 1.8 4.08 1299 1042 A 42 ARG HBy A 42 ARG HDx 1.0 1.8 3.83 1300 1042 A 42 ARG HBx A 42 ARG HDx 1.0 1.8 3.83 1301 1042 A 42 ARG HDy A 42 ARG HBx 1.0 1.8 3.83 1302 1042 A 42 ARG HDy A 42 ARG HBy 1.0 1.8 3.83 1303 1043 A 46 LYS H A 46 LYS HGx 1.0 1.8 5.21 1304 1043 A 46 LYS H A 46 LYS HGy 1.0 1.8 5.21 1305 1044 A 46 LYS H A 46 LYS HDx 1.0 1.8 5.87 1306 1044 A 46 LYS H A 46 LYS HDy 1.0 1.8 5.87 1307 1045 A 46 LYS HA A 46 LYS HDx 1.0 1.8 4.43 1308 1045 A 46 LYS HA A 46 LYS HDy 1.0 1.8 4.43 1309 1046 A 46 LYS HBx A 46 LYS HDx 1.0 1.8 3.50 1310 1046 A 46 LYS HDy A 46 LYS HBx 1.0 1.8 3.50 1311 1046 A 46 LYS HDy A 46 LYS HBy 1.0 1.8 3.50 1312 1046 A 46 LYS HBy A 46 LYS HDx 1.0 1.8 3.50 1313 1047 A 46 LYS HBx A 46 LYS HEx 1.0 1.8 5.06 1314 1047 A 46 LYS HBy A 46 LYS HEx 1.0 1.8 5.06 1315 1047 A 46 LYS HEy A 46 LYS HBx 1.0 1.8 5.06 1316 1047 A 46 LYS HBy A 46 LYS HEy 1.0 1.8 5.06 1317 1048 A 47 LEU H A 47 LEU HBy 1.0 1.8 3.84 1318 1048 A 47 LEU H A 47 LEU HBx 1.0 1.8 3.84 1319 1049 A 47 LEU HA A 47 LEU HD1% 1.0 1.8 4.02 1320 1049 A 47 LEU HA A 47 LEU HD2% 1.0 1.8 4.02 1321 1050 A 48 GLU H A 47 LEU HBy 1.0 1.8 4.74 1322 1050 A 48 GLU H A 47 LEU HBx 1.0 1.8 4.74 1323 1051 A 48 GLU H A 48 GLU HBy 1.0 1.8 3.98 1324 1051 A 48 GLU H A 48 GLU HBx 1.0 1.8 3.98 stop_ save_ save_CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_5 _nef_distance_restraint_list.restraint_origin hbond _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 4 ASN O A 8 ALA N 1.0 2.4 3.3 2 2 A 8 ALA H A 4 ASN O 1.0 1.5 2.3 3 3 A 5 ALA O A 9 ARG N 1.0 2.4 3.3 4 4 A 9 ARG H A 5 ALA O 1.0 1.5 2.3 5 5 A 6 LYS O A 10 ILE N 1.0 2.4 3.3 6 6 A 10 ILE H A 6 LYS O 1.0 1.5 2.3 7 7 A 7 ILE O A 11 ASN N 1.0 2.4 3.3 8 8 A 11 ASN H A 7 ILE O 1.0 1.5 2.3 9 9 A 8 ALA O A 12 GLU N 1.0 2.4 3.3 10 10 A 12 GLU H A 8 ALA O 1.0 1.5 2.3 11 11 A 9 ARG O A 13 LEU N 1.0 2.4 3.3 12 12 A 13 LEU H A 9 ARG O 1.0 1.5 2.3 13 13 A 10 ILE O A 14 ALA N 1.0 2.4 3.3 14 14 A 14 ALA H A 10 ILE O 1.0 1.5 2.3 15 15 A 11 ASN O A 15 ALA N 1.0 2.4 3.3 16 16 A 15 ALA H A 11 ASN O 1.0 1.5 2.3 17 17 A 13 LEU O A 17 ALA N 1.0 2.4 3.3 18 18 A 17 ALA H A 13 LEU O 1.0 1.5 2.3 19 19 A 14 ALA O A 18 LYS N 1.0 2.4 3.3 20 20 A 18 LYS H A 14 ALA O 1.0 1.5 2.3 21 21 A 15 ALA O A 19 ALA N 1.0 2.4 3.3 22 22 A 19 ALA H A 15 ALA O 1.0 1.5 2.3 23 23 A 16 LYS O A 20 GLY N 1.0 2.4 3.3 24 24 A 20 GLY H A 16 LYS O 1.0 1.5 2.3 25 25 A 24 GLU O A 28 ALA N 1.0 2.4 3.3 26 26 A 28 ALA H A 24 GLU O 1.0 1.5 2.3 27 27 A 25 GLU O A 29 GLU N 1.0 2.4 3.3 28 28 A 29 GLU H A 25 GLU O 1.0 1.5 2.3 29 29 A 26 GLU O A 30 GLN N 1.0 2.4 3.3 30 30 A 30 GLN H A 26 GLU O 1.0 1.5 2.3 31 31 A 27 LYS O A 31 GLN N 1.0 2.4 3.3 32 32 A 31 GLN H A 27 LYS O 1.0 1.5 2.3 33 33 A 28 ALA O A 32 LYS N 1.0 2.4 3.3 34 34 A 32 LYS H A 28 ALA O 1.0 1.5 2.3 35 35 A 29 GLU O A 33 LEU N 1.0 2.4 3.3 36 36 A 33 LEU H A 29 GLU O 1.0 1.5 2.3 37 37 A 30 GLN O A 34 ARG N 1.0 2.4 3.3 38 38 A 34 ARG H A 30 GLN O 1.0 1.5 2.3 39 39 A 31 GLN O A 35 GLN N 1.0 2.4 3.3 40 40 A 35 GLN H A 31 GLN O 1.0 1.5 2.3 41 41 A 32 LYS O A 36 GLU N 1.0 2.4 3.3 42 42 A 36 GLU H A 32 LYS O 1.0 1.5 2.3 43 43 A 33 LEU O A 37 TYR N 1.0 2.4 3.3 44 44 A 37 TYR H A 33 LEU O 1.0 1.5 2.3 45 45 A 34 ARG O A 38 LEU N 1.0 2.4 3.3 46 46 A 38 LEU H A 34 ARG O 1.0 1.5 2.3 47 47 A 35 GLN O A 39 LYS N 1.0 2.4 3.3 48 48 A 39 LYS H A 35 GLN O 1.0 1.5 2.3 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 3 SER C A 4 ASN N A 4 ASN CA A 4 ASN C 1.0 -98.36 -18.36 PHI 2 2 A 4 ASN N A 4 ASN CA A 4 ASN C A 5 ALA N 1.0 -88.20 11.80 PSI 3 3 A 4 ASN C A 5 ALA N A 5 ALA CA A 5 ALA C 1.0 -107.56 -27.56 PHI 4 4 A 5 ALA N A 5 ALA CA A 5 ALA C A 6 LYS N 1.0 -90.58 9.42 PSI 5 5 A 5 ALA C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -106.85 -26.85 PHI 6 6 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 ILE N 1.0 -91.20 8.80 PSI 7 7 A 6 LYS C A 7 ILE N A 7 ILE CA A 7 ILE C 1.0 -102.58 -22.58 PHI 8 8 A 7 ILE N A 7 ILE CA A 7 ILE C A 8 ALA N 1.0 -92.07 7.93 PSI 9 9 A 7 ILE C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -102.27 -22.27 PHI 10 10 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 ARG N 1.0 -87.83 12.17 PSI 11 11 A 8 ALA C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -107.66 -27.66 PHI 12 12 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 ILE N 1.0 -90.92 9.08 PSI 13 13 A 9 ARG C A 10 ILE N A 10 ILE CA A 10 ILE C 1.0 -102.23 -22.23 PHI 14 14 A 10 ILE N A 10 ILE CA A 10 ILE C A 11 ASN N 1.0 -93.47 6.53 PSI 15 15 A 10 ILE C A 11 ASN N A 11 ASN CA A 11 ASN C 1.0 -102.42 -22.42 PHI 16 16 A 11 ASN N A 11 ASN CA A 11 ASN C A 12 GLU N 1.0 -90.47 9.53 PSI 17 17 A 11 ASN C A 12 GLU N A 12 GLU CA A 12 GLU C 1.0 -104.61 -24.61 PHI 18 18 A 12 GLU N A 12 GLU CA A 12 GLU C A 13 LEU N 1.0 -93.69 6.31 PSI 19 19 A 12 GLU C A 13 LEU N A 13 LEU CA A 13 LEU C 1.0 -98.46 -18.46 PHI 20 20 A 13 LEU N A 13 LEU CA A 13 LEU C A 14 ALA N 1.0 -92.10 7.90 PSI 21 21 A 13 LEU C A 14 ALA N A 14 ALA CA A 14 ALA C 1.0 -100.39 -20.39 PHI 22 22 A 14 ALA N A 14 ALA CA A 14 ALA C A 15 ALA N 1.0 -93.36 6.64 PSI 23 23 A 14 ALA C A 15 ALA N A 15 ALA CA A 15 ALA C 1.0 -104.51 -24.51 PHI 24 24 A 15 ALA N A 15 ALA CA A 15 ALA C A 16 LYS N 1.0 -89.21 10.79 PSI 25 25 A 15 ALA C A 16 LYS N A 16 LYS CA A 16 LYS C 1.0 -104.36 -24.36 PHI 26 26 A 16 LYS N A 16 LYS CA A 16 LYS C A 17 ALA N 1.0 -92.06 7.94 PSI 27 27 A 16 LYS C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -106.25 -26.25 PHI 28 28 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 LYS N 1.0 -85.58 14.42 PSI 29 29 A 17 ALA C A 18 LYS N A 18 LYS CA A 18 LYS C 1.0 -106.92 -26.92 PHI 30 30 A 18 LYS N A 18 LYS CA A 18 LYS C A 19 ALA N 1.0 -76.22 23.78 PSI 31 31 A 18 LYS C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -128.58 -48.58 PHI 32 32 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 GLY N 1.0 -49.02 50.98 PSI 33 33 A 21 VAL C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -141.53 -61.53 PHI 34 34 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 THR N 1.0 77.27 177.27 PSI 35 35 A 22 ILE C A 23 THR N A 23 THR CA A 23 THR C 1.0 -125.77 -45.77 PHI 36 36 A 23 THR N A 23 THR CA A 23 THR C A 24 GLU N 1.0 114.24 214.24 PSI 37 37 A 23 THR C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -98.45 -18.45 PHI 38 38 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 GLU N 1.0 -87.42 12.58 PSI 39 39 A 24 GLU C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -104.69 -24.69 PHI 40 40 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 GLU N 1.0 -90.82 9.18 PSI 41 41 A 25 GLU C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -108.44 -28.44 PHI 42 42 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 LYS N 1.0 -91.02 8.98 PSI 43 43 A 26 GLU C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -107.38 -27.38 PHI 44 44 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ALA N 1.0 -88.69 11.31 PSI 45 45 A 27 LYS C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -106.06 -26.06 PHI 46 46 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 GLU N 1.0 -88.01 11.99 PSI 47 47 A 28 ALA C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -109.91 -29.91 PHI 48 48 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 GLN N 1.0 -88.96 11.04 PSI 49 49 A 29 GLU C A 30 GLN N A 30 GLN CA A 30 GLN C 1.0 -102.07 -22.07 PHI 50 50 A 30 GLN N A 30 GLN CA A 30 GLN C A 31 GLN N 1.0 -92.41 7.59 PSI 51 51 A 30 GLN C A 31 GLN N A 31 GLN CA A 31 GLN C 1.0 -102.65 -22.65 PHI 52 52 A 31 GLN N A 31 GLN CA A 31 GLN C A 32 LYS N 1.0 -95.82 4.18 PSI 53 53 A 31 GLN C A 32 LYS N A 32 LYS CA A 32 LYS C 1.0 -106.63 -26.63 PHI 54 54 A 32 LYS N A 32 LYS CA A 32 LYS C A 33 LEU N 1.0 -90.11 9.89 PSI 55 55 A 32 LYS C A 33 LEU N A 33 LEU CA A 33 LEU C 1.0 -103.68 -23.68 PHI 56 56 A 33 LEU N A 33 LEU CA A 33 LEU C A 34 ARG N 1.0 -89.25 10.75 PSI 57 57 A 33 LEU C A 34 ARG N A 34 ARG CA A 34 ARG C 1.0 -105.54 -25.54 PHI 58 58 A 34 ARG N A 34 ARG CA A 34 ARG C A 35 GLN N 1.0 -87.60 12.40 PSI 59 59 A 34 ARG C A 35 GLN N A 35 GLN CA A 35 GLN C 1.0 -102.96 -22.96 PHI 60 60 A 35 GLN N A 35 GLN CA A 35 GLN C A 36 GLU N 1.0 -92.40 7.60 PSI 61 61 A 35 GLN C A 36 GLU N A 36 GLU CA A 36 GLU C 1.0 -105.06 -25.06 PHI 62 62 A 36 GLU N A 36 GLU CA A 36 GLU C A 37 TYR N 1.0 -90.06 9.94 PSI 63 63 A 36 GLU C A 37 TYR N A 37 TYR CA A 37 TYR C 1.0 -105.17 -25.17 PHI 64 64 A 37 TYR N A 37 TYR CA A 37 TYR C A 38 LEU N 1.0 -92.31 7.69 PSI 65 65 A 37 TYR C A 38 LEU N A 38 LEU CA A 38 LEU C 1.0 -107.29 -27.29 PHI 66 66 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 LYS N 1.0 -86.03 13.97 PSI 67 67 A 39 LYS C A 40 GLY N A 40 GLY CA A 40 GLY C 1.0 25.20 105.20 PHI 68 68 A 40 GLY N A 40 GLY CA A 40 GLY C A 41 PHE N 1.0 -80.42 19.58 PSI stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H . 2 13C . 3 1H . stop_ save_ save_spectral_peak_list_2 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_2 _nef_nmr_spectrum.num_dimensions . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectral_width 1 1H . 2 15N . 3 1H . stop_ save_