data_nef_c17886_2m5r 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 2M5R stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 37 SER OG 2 1 PNS P24 stop_ 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 ASN middle . . 3 A 3 ASP middle . . 4 A 4 VAL middle . . 5 A 5 LEU middle . . 6 A 6 THR middle . . 7 A 7 ARG middle . . 8 A 8 VAL middle . . 9 A 9 LEU middle . . 10 A 10 GLU middle . . 11 A 11 VAL middle . . 12 A 12 VAL middle . . 13 A 13 LYS middle . . 14 A 14 ASN middle . . 15 A 15 PHE middle . . 16 A 16 GLU middle . . 17 A 17 LYS middle . . 18 A 18 VAL middle . . 19 A 19 ASP middle . . 20 A 20 ALA middle . . 21 A 21 SER middle . . 22 A 22 LYS middle . . 23 A 23 VAL middle . . 24 A 24 THR middle . . 25 A 25 PRO middle . false 26 A 26 GLU middle . . 27 A 27 SER middle . . 28 A 28 HIS middle . . 29 A 29 PHE middle . . 30 A 30 VAL middle . . 31 A 31 LYS middle . . 32 A 32 ASP middle . . 33 A 33 LEU middle . . 34 A 34 GLY middle . false 35 A 35 LEU middle . . 36 A 36 ASN middle . . 37 A 37 SER middle . . 38 A 38 LEU middle . . 39 A 39 ASP middle . . 40 A 40 VAL middle . . 41 A 41 VAL middle . . 42 A 42 GLU middle . . 43 A 43 VAL middle . . 44 A 44 VAL middle . . 45 A 45 PHE middle . . 46 A 46 ALA middle . . 47 A 47 ILE middle . . 48 A 48 GLU middle . . 49 A 49 GLN middle . . 50 A 50 GLU middle . . 51 A 51 PHE middle . . 52 A 52 ILE middle . . 53 A 53 LEU middle . . 54 A 54 ASP middle . . 55 A 55 ILE middle . . 56 A 56 PRO middle . false 57 A 57 ASP middle . . 58 A 58 HIS middle . . 59 A 59 ASP middle . . 60 A 60 ALA middle . . 61 A 61 GLU middle . . 62 A 62 LYS middle . . 63 A 63 ILE middle . . 64 A 64 GLN middle . . 65 A 65 SER middle . . 66 A 66 ILE middle . . 67 A 67 PRO middle . false 68 A 68 ASP middle . . 69 A 69 ALA middle . . 70 A 70 VAL middle . . 71 A 71 GLU middle . . 72 A 72 TYR middle . . 73 A 73 ILE middle . . 74 A 74 ALA middle . . 75 A 75 GLN middle . . 76 A 76 ASN middle . . 77 A 77 PRO middle . false 78 A 78 MET middle . . 79 A 79 ALA middle . . 80 A 80 LYS end . . 81 B 1 PNS . . . 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 H1 H 1 8.449 0.020 A 1 MET HA H 1 3.975 0.020 A 1 MET HBy H 1 2.362 0.020 A 1 MET HBx H 1 1.952 0.020 A 1 MET C C 13 176.092 0.3 A 1 MET CA C 13 57.401 0.3 A 1 MET CB C 13 31.764 0.3 A 1 MET N N 15 119.039 0.3 A 2 ASN H H 1 8.218 0.020 A 2 ASN HA H 1 4.495 0.020 A 2 ASN HB2 H 1 2.696 0.020 A 2 ASN HB3 H 1 2.696 0.020 A 2 ASN HD21 H 1 7.74 0.020 A 2 ASN HD22 H 1 6.87 0.020 A 2 ASN C C 13 173.846 0.3 A 2 ASN CA C 13 55.329 0.3 A 2 ASN CB C 13 38.455 0.3 A 2 ASN N N 15 118.163 0.3 A 2 ASN ND2 N 15 113.017 0.3 A 3 ASP H H 1 8.212 0.020 A 3 ASP HA H 1 4.454 0.020 A 3 ASP HBy H 1 2.858 0.020 A 3 ASP HBx H 1 2.732 0.020 A 3 ASP C C 13 174.914 0.3 A 3 ASP CA C 13 55.405 0.3 A 3 ASP CB C 13 40.494 0.3 A 3 ASP N N 15 121.548 0.3 A 4 VAL H H 1 7.900 0.020 A 4 VAL HA H 1 3.656 0.020 A 4 VAL HB H 1 2.031 0.020 A 4 VAL HG1% H 1 0.775 0.020 A 4 VAL HG2% H 1 0.744 0.020 A 4 VAL C C 13 174.803 0.3 A 4 VAL CA C 13 66.969 0.3 A 4 VAL CB C 13 31.396 0.3 A 4 VAL CG1 C 13 21.992 0.3 A 4 VAL CG2 C 13 21.992 0.3 A 4 VAL N N 15 119.595 0.3 A 5 LEU H H 1 8.292 0.020 A 5 LEU HA H 1 3.893 0.020 A 5 LEU HBy H 1 1.941 0.020 A 5 LEU HBx H 1 1.513 0.020 A 5 LEU HD1% H 1 0.915 0.020 A 5 LEU HD2% H 1 0.836 0.020 A 5 LEU C C 13 174.872 0.3 A 5 LEU CA C 13 58.727 0.3 A 5 LEU CB C 13 40.743 0.3 A 5 LEU CD1 C 13 25.834 0.3 A 5 LEU CD2 C 13 25.728 0.3 A 5 LEU CG C 13 23.393 0.3 A 5 LEU N N 15 119.430 0.3 A 6 THR H H 1 8.218 0.020 A 6 THR HA H 1 4.193 0.020 A 6 THR HB H 1 3.674 0.020 A 6 THR HG2% H 1 1.164 0.020 A 6 THR C C 13 173.832 0.3 A 6 THR CA C 13 68.748 0.3 A 6 THR CB C 13 67.050 0.3 A 6 THR CG2 C 13 21.347 0.3 A 6 THR N N 15 113.371 0.3 A 7 ARG H H 1 7.590 0.020 A 7 ARG HA H 1 4.012 0.020 A 7 ARG HBy H 1 1.929 0.020 A 7 ARG HBx H 1 1.768 0.020 A 7 ARG HD2 H 1 3.468 0.020 A 7 ARG HGy H 1 1.622 0.020 A 7 ARG HGx H 1 1.461 0.020 A 7 ARG C C 13 176.286 0.3 A 7 ARG CA C 13 59.327 0.3 A 7 ARG CB C 13 32.630 0.3 A 7 ARG CD C 13 44.703 0.3 A 7 ARG CG C 13 27.335 0.3 A 7 ARG N N 15 119.802 0.3 A 8 VAL H H 1 8.783 0.020 A 8 VAL HA H 1 3.486 0.020 A 8 VAL HB H 1 2.170 0.020 A 8 VAL HG1% H 1 1.018 0.020 A 8 VAL HG2% H 1 0.891 0.020 A 8 VAL C C 13 174.761 0.3 A 8 VAL CA C 13 67.873 0.3 A 8 VAL CB C 13 31.049 0.3 A 8 VAL CG1 C 13 24.687 0.3 A 8 VAL CG2 C 13 22.930 0.3 A 8 VAL N N 15 119.732 0.3 A 9 LEU H H 1 8.798 0.020 A 9 LEU HA H 1 3.678 0.020 A 9 LEU HBy H 1 2.035 0.020 A 9 LEU HBx H 1 1.156 0.020 A 9 LEU HD1% H 1 0.733 0.020 A 9 LEU HD2% H 1 0.579 0.020 A 9 LEU HG H 1 1.691 0.020 A 9 LEU C C 13 175.773 0.3 A 9 LEU CA C 13 58.736 0.3 A 9 LEU CB C 13 42.134 0.3 A 9 LEU CD1 C 13 24.177 0.3 A 9 LEU CD2 C 13 23.993 0.3 A 9 LEU CG C 13 26.536 0.3 A 9 LEU N N 15 118.029 0.3 A 10 GLU H H 1 7.528 0.020 A 10 GLU HA H 1 3.827 0.020 A 10 GLU HB2 H 1 2.014 0.020 A 10 GLU HB3 H 1 2.014 0.020 A 10 GLU HG2 H 1 2.251 0.020 A 10 GLU HG3 H 1 2.251 0.020 A 10 GLU C C 13 175.911 0.3 A 10 GLU CA C 13 59.160 0.3 A 10 GLU CB C 13 29.161 0.3 A 10 GLU CG C 13 35.706 0.3 A 10 GLU N N 15 116.181 0.3 A 11 VAL H H 1 7.684 0.020 A 11 VAL HA H 1 3.601 0.020 A 11 VAL HB H 1 2.140 0.020 A 11 VAL HG1% H 1 0.997 0.020 A 11 VAL HG2% H 1 0.777 0.020 A 11 VAL C C 13 174.290 0.3 A 11 VAL CA C 13 65.986 0.3 A 11 VAL CB C 13 31.349 0.3 A 11 VAL CG1 C 13 22.842 0.3 A 11 VAL CG2 C 13 22.771 0.3 A 11 VAL N N 15 118.229 0.3 A 12 VAL H H 1 8.132 0.020 A 12 VAL HA H 1 4.765 0.020 A 12 VAL HB H 1 3.441 0.020 A 12 VAL HG1% H 1 0.996 0.020 A 12 VAL HG2% H 1 0.853 0.020 A 12 VAL CA C 13 67.204 0.3 A 12 VAL CB C 13 31.272 0.3 A 12 VAL CG1 C 13 22.939 0.3 A 12 VAL N N 15 118.204 0.3 A 13 LYS H H 1 8.542 0.020 A 13 LYS HBy H 1 1.813 0.020 A 13 LYS HBx H 1 1.714 0.020 A 13 LYS HD2 H 1 1.542 0.020 A 13 LYS HGy H 1 1.315 0.020 A 13 LYS HGx H 1 1.172 0.020 A 13 LYS C C 13 174.401 0.3 A 13 LYS CA C 13 60.190 0.3 A 13 LYS CB C 13 32.613 0.3 A 13 LYS CD C 13 29.526 0.3 A 13 LYS CE C 13 41.666 0.3 A 13 LYS CG C 13 27.182 0.3 A 13 LYS N N 15 115.041 0.3 A 14 ASN H H 1 7.380 0.020 A 14 ASN HA H 1 4.561 0.020 A 14 ASN HBy H 1 2.825 0.020 A 14 ASN HBx H 1 2.743 0.020 A 14 ASN HD21 H 1 7.684 0.020 A 14 ASN HD22 H 1 6.859 0.020 A 14 ASN C C 13 172.045 0.3 A 14 ASN CA C 13 53.210 0.3 A 14 ASN CB C 13 39.011 0.3 A 14 ASN N N 15 113.638 0.3 A 14 ASN ND2 N 15 113.834 0.3 A 15 PHE H H 1 7.637 0.020 A 15 PHE HA H 1 4.419 0.020 A 15 PHE HBy H 1 3.076 0.020 A 15 PHE HBx H 1 3.051 0.020 A 15 PHE HD1 H 1 7.187 0.020 A 15 PHE HZ H 1 7.133 0.020 A 15 PHE C C 13 175.315 0.3 A 15 PHE CA C 13 58.685 0.3 A 15 PHE CB C 13 38.748 0.3 A 15 PHE CD1 C 13 131.432 0.3 A 15 PHE CD2 C 13 131.534 0.3 A 15 PHE CE1 C 13 131.191 0.3 A 15 PHE CZ C 13 129.839 0.3 A 15 PHE N N 15 124.110 0.3 A 16 GLU H H 1 8.532 0.020 A 16 GLU HA H 1 3.862 0.020 A 16 GLU HBy H 1 1.820 0.020 A 16 GLU HBx H 1 1.689 0.020 A 16 GLU HGy H 1 2.049 0.020 A 16 GLU HGx H 1 2.039 0.020 A 16 GLU C C 13 173.999 0.3 A 16 GLU CA C 13 59.446 0.3 A 16 GLU CB C 13 29.169 0.3 A 16 GLU CG C 13 35.706 0.3 A 16 GLU N N 15 127.935 0.3 A 17 LYS H H 1 6.212 0.020 A 17 LYS HA H 1 4.071 0.020 A 17 LYS HBy H 1 1.899 0.020 A 17 LYS HBx H 1 1.337 0.020 A 17 LYS HDy H 1 1.622 0.020 A 17 LYS HDx H 1 1.541 0.020 A 17 LYS HE2 H 1 2.931 0.020 A 17 LYS HG3 H 1 1.284 0.020 A 17 LYS C C 13 173.347 0.3 A 17 LYS CA C 13 56.410 0.3 A 17 LYS CB C 13 32.991 0.3 A 17 LYS CD C 13 28.915 0.3 A 17 LYS CE C 13 32.890 0.3 A 17 LYS CG C 13 25.443 0.3 A 17 LYS N N 15 112.927 0.3 A 18 VAL H H 1 7.669 0.020 A 18 VAL HA H 1 3.899 0.020 A 18 VAL HB H 1 2.366 0.020 A 18 VAL HG1% H 1 1.005 0.020 A 18 VAL HG2% H 1 0.706 0.020 A 18 VAL C C 13 171.948 0.3 A 18 VAL CA C 13 61.580 0.3 A 18 VAL CB C 13 33.300 0.3 A 18 VAL CG1 C 13 23.870 0.3 A 18 VAL CG2 C 13 22.227 0.3 A 18 VAL N N 15 119.111 0.3 A 19 ASP H H 1 8.390 0.020 A 19 ASP HA H 1 4.620 0.020 A 19 ASP HBy H 1 2.772 0.020 A 19 ASP HBx H 1 2.526 0.020 A 19 ASP C C 13 173.569 0.3 A 19 ASP CA C 13 51.852 0.3 A 19 ASP CB C 13 39.651 0.3 A 19 ASP N N 15 125.544 0.3 A 20 ALA H H 1 8.892 0.020 A 20 ALA HA H 1 3.826 0.020 A 20 ALA HB% H 1 1.482 0.020 A 20 ALA C C 13 176.632 0.3 A 20 ALA CA C 13 55.293 0.3 A 20 ALA CB C 13 18.925 0.3 A 20 ALA N N 15 128.890 0.3 A 21 SER H H 1 8.234 0.020 A 21 SER HA H 1 4.165 0.020 A 21 SER HB2 H 1 3.911 0.020 A 21 SER C C 13 172.751 0.3 A 21 SER CA C 13 60.624 0.3 A 21 SER CB C 13 63.008 0.3 A 21 SER N N 15 111.527 0.3 A 22 LYS H H 1 7.897 0.020 A 22 LYS HA H 1 4.255 0.020 A 22 LYS HB2 H 1 1.712 0.020 A 22 LYS HD2 H 1 1.792 0.020 A 22 LYS HE2 H 1 2.962 0.020 A 22 LYS HGy H 1 1.378 0.020 A 22 LYS HGx H 1 1.260 0.020 A 22 LYS C C 13 173.389 0.3 A 22 LYS CA C 13 55.339 0.3 A 22 LYS CB C 13 33.855 0.3 A 22 LYS CD C 13 28.767 0.3 A 22 LYS CE C 13 42.067 0.3 A 22 LYS CG C 13 25.225 0.3 A 22 LYS N N 15 120.075 0.3 A 23 VAL H H 1 6.946 0.020 A 23 VAL HA H 1 3.746 0.020 A 23 VAL HB H 1 1.914 0.020 A 23 VAL HG1% H 1 0.906 0.020 A 23 VAL HG2% H 1 0.793 0.020 A 23 VAL C C 13 172.571 0.3 A 23 VAL CA C 13 63.541 0.3 A 23 VAL CB C 13 31.451 0.3 A 23 VAL CG1 C 13 24.470 0.3 A 23 VAL CG2 C 13 22.749 0.3 A 23 VAL N N 15 118.566 0.3 A 24 THR H H 1 9.130 0.020 A 24 THR HA H 1 4.878 0.020 A 24 THR HB H 1 4.563 0.020 A 24 THR HG2% H 1 1.075 0.020 A 24 THR CA C 13 58.905 0.3 A 24 THR CB C 13 69.654 0.3 A 24 THR N N 15 121.786 0.3 A 25 PRO HA H 1 4.148 0.020 A 25 PRO HBy H 1 2.377 0.020 A 25 PRO HBx H 1 1.887 0.020 A 25 PRO C C 13 172.142 0.3 A 25 PRO CA C 13 64.435 0.3 A 25 PRO CB C 13 32.210 0.3 A 25 PRO CD C 13 50.876 0.3 A 25 PRO CG C 13 28.270 0.3 A 26 GLU H H 1 7.464 0.020 A 26 GLU HA H 1 4.262 0.020 A 26 GLU HBx H 1 1.613 0.020 A 26 GLU HBy H 1 1.658 0.020 A 26 GLU HG2 H 1 2.129 0.020 A 26 GLU C C 13 174.803 0.3 A 26 GLU CA C 13 54.887 0.3 A 26 GLU CB C 13 30.459 0.3 A 26 GLU CG C 13 36.361 0.3 A 26 GLU N N 15 110.708 0.3 A 27 SER H H 1 7.699 0.020 A 27 SER HA H 1 4.134 0.020 A 27 SER HBy H 1 3.731 0.020 A 27 SER HBx H 1 3.695 0.020 A 27 SER C C 13 169.370 0.3 A 27 SER CA C 13 62.187 0.3 A 27 SER CB C 13 64.581 0.3 A 27 SER N N 15 116.105 0.3 A 28 HIS H H 1 10.723 0.020 A 28 HIS HA H 1 3.975 0.020 A 28 HIS HBy H 1 3.133 0.020 A 28 HIS HBx H 1 3.011 0.020 A 28 HIS HD1 H 1 7.118 0.020 A 28 HIS HE1 H 1 8.219 0.020 A 28 HIS C C 13 175.842 0.3 A 28 HIS CA C 13 56.743 0.3 A 28 HIS CB C 13 32.991 0.3 A 28 HIS CE1 C 13 137.606 0.3 A 28 HIS N N 15 127.329 0.3 A 29 PHE H H 1 8.343 0.020 A 29 PHE HA H 1 4.147 0.020 A 29 PHE HBy H 1 3.024 0.020 A 29 PHE HBx H 1 2.898 0.020 A 29 PHE HD1 H 1 6.789 0.020 A 29 PHE HE1 H 1 6.370 0.020 A 29 PHE C C 13 172.502 0.3 A 29 PHE CA C 13 59.004 0.3 A 29 PHE CB C 13 37.546 0.3 A 29 PHE CD1 C 13 129.522 0.3 A 29 PHE CE1 C 13 128.020 0.3 A 29 PHE N N 15 126.911 0.3 A 30 VAL H H 1 8.794 0.020 A 30 VAL HA H 1 4.244 0.020 A 30 VAL HB H 1 2.172 0.020 A 30 VAL HG1% H 1 0.991 0.020 A 30 VAL HG2% H 1 0.952 0.020 A 30 VAL C C 13 177.090 0.3 A 30 VAL CA C 13 64.450 0.3 A 30 VAL CB C 13 33.884 0.3 A 30 VAL CG1 C 13 22.183 0.3 A 30 VAL CG2 C 13 20.405 0.3 A 30 VAL N N 15 118.081 0.3 A 31 LYS H H 1 9.730 0.020 A 31 LYS HA H 1 3.880 0.020 A 31 LYS HBy H 1 1.611 0.020 A 31 LYS HBx H 1 1.569 0.020 A 31 LYS HDy H 1 1.418 0.020 A 31 LYS HDx H 1 1.304 0.020 A 31 LYS HEy H 1 2.576 0.020 A 31 LYS HEx H 1 2.469 0.020 A 31 LYS HGy H 1 1.182 0.020 A 31 LYS HGx H 1 1.021 0.020 A 31 LYS C C 13 174.886 0.3 A 31 LYS CA C 13 59.803 0.3 A 31 LYS CB C 13 32.518 0.3 A 31 LYS CD C 13 28.569 0.3 A 31 LYS CE C 13 41.139 0.3 A 31 LYS CG C 13 25.239 0.3 A 31 LYS N N 15 120.007 0.3 A 32 ASP H H 1 7.730 0.020 A 32 ASP HA H 1 5.046 0.020 A 32 ASP HBy H 1 3.154 0.020 A 32 ASP HBx H 1 2.964 0.020 A 32 ASP C C 13 174.830 0.3 A 32 ASP CA C 13 55.729 0.3 A 32 ASP CB C 13 42.192 0.3 A 32 ASP N N 15 111.326 0.3 A 33 LEU H H 1 7.103 0.020 A 33 LEU HA H 1 4.612 0.020 A 33 LEU HBy H 1 2.497 0.020 A 33 LEU HBx H 1 1.593 0.020 A 33 LEU HD1% H 1 0.935 0.020 A 33 LEU HD2% H 1 0.741 0.020 A 33 LEU HG H 1 1.401 0.020 A 33 LEU C C 13 174.761 0.3 A 33 LEU CA C 13 53.969 0.3 A 33 LEU CB C 13 40.881 0.3 A 33 LEU CD1 C 13 26.284 0.3 A 33 LEU CG C 13 26.154 0.3 A 33 LEU N N 15 112.896 0.3 A 34 GLY H H 1 7.307 0.020 A 34 GLY HA2 H 1 3.918 0.020 A 34 GLY HA3 H 1 3.918 0.020 A 34 GLY C C 13 171.601 0.3 A 34 GLY CA C 13 46.528 0.3 A 34 GLY N N 15 106.612 0.3 A 35 LEU H H 1 8.001 0.020 A 35 LEU HA H 1 4.366 0.020 A 35 LEU HBy H 1 1.634 0.020 A 35 LEU HBx H 1 1.457 0.020 A 35 LEU HD1% H 1 0.672 0.020 A 35 LEU HD2% H 1 0.411 0.020 A 35 LEU C C 13 173.694 0.3 A 35 LEU CA C 13 54.275 0.3 A 35 LEU CB C 13 40.919 0.3 A 35 LEU CD1 C 13 21.699 0.3 A 35 LEU CD2 C 13 24.902 0.3 A 35 LEU CG C 13 40.919 0.3 A 35 LEU N N 15 118.776 0.3 A 36 ASN H H 1 9.113 0.020 A 36 ASN HA H 1 4.902 0.020 A 36 ASN HBy H 1 3.184 0.020 A 36 ASN HBx H 1 2.817 0.020 A 36 ASN HD21 H 1 7.469 0.020 A 36 ASN HD22 H 1 6.803 0.020 A 36 ASN C C 13 173.680 0.3 A 36 ASN CA C 13 50.766 0.3 A 36 ASN CB C 13 39.206 0.3 A 36 ASN N N 15 118.360 0.3 A 36 ASN ND2 N 15 111.951 0.3 A 37 SER H H 1 8.735 0.020 A 37 SER HA H 1 4.940 0.020 A 37 SER HB2 H 1 4.045 0.020 A 37 SER HB3 H 1 4.045 0.020 A 37 SER C C 13 174.193 0.3 A 37 SER CA C 13 57.916 0.3 A 37 SER CB C 13 65.228 0.3 A 37 SER N N 15 111.905 0.3 A 38 LEU H H 1 7.777 0.020 A 38 LEU HA H 1 4.101 0.020 A 38 LEU HBy H 1 1.596 0.020 A 38 LEU HBx H 1 1.526 0.020 A 38 LEU HD1% H 1 0.839 0.020 A 38 LEU HG H 1 1.733 0.020 A 38 LEU C C 13 176.729 0.3 A 38 LEU CA C 13 57.551 0.3 A 38 LEU CB C 13 40.893 0.3 A 38 LEU CD1 C 13 24.749 0.3 A 38 LEU CD2 C 13 23.581 0.3 A 38 LEU CG C 13 40.881 0.3 A 38 LEU N N 15 124.069 0.3 A 39 ASP H H 1 8.155 0.020 A 39 ASP HA H 1 4.280 0.020 A 39 ASP HBy H 1 3.031 0.020 A 39 ASP HBx H 1 2.443 0.020 A 39 ASP C C 13 175.634 0.3 A 39 ASP CA C 13 56.718 0.3 A 39 ASP CB C 13 42.319 0.3 A 39 ASP N N 15 120.414 0.3 A 40 VAL H H 1 7.998 0.020 A 40 VAL HA H 1 2.969 0.020 A 40 VAL HB H 1 2.035 0.020 A 40 VAL HG1% H 1 0.873 0.020 A 40 VAL C C 13 174.151 0.3 A 40 VAL CA C 13 67.122 0.3 A 40 VAL CB C 13 31.105 0.3 A 40 VAL CG1 C 13 24.353 0.3 A 40 VAL CG2 C 13 22.158 0.3 A 40 VAL N N 15 117.818 0.3 A 41 VAL H H 1 6.961 0.020 A 41 VAL HA H 1 3.436 0.020 A 41 VAL HB H 1 2.135 0.020 A 41 VAL HG1% H 1 0.991 0.020 A 41 VAL HG2% H 1 0.756 0.020 A 41 VAL C C 13 175.856 0.3 A 41 VAL CA C 13 66.146 0.3 A 41 VAL CB C 13 31.817 0.3 A 41 VAL CG1 C 13 24.285 0.3 A 41 VAL CG2 C 13 21.726 0.3 A 41 VAL N N 15 117.681 0.3 A 42 GLU H H 1 7.228 0.020 A 42 GLU HA H 1 4.088 0.020 A 42 GLU HBy H 1 2.291 0.020 A 42 GLU HBx H 1 2.238 0.020 A 42 GLU HGy H 1 2.552 0.020 A 42 GLU HGx H 1 2.373 0.020 A 42 GLU C C 13 177.048 0.3 A 42 GLU CA C 13 59.255 0.3 A 42 GLU CB C 13 29.184 0.3 A 42 GLU CG C 13 36.314 0.3 A 42 GLU N N 15 117.678 0.3 A 43 VAL H H 1 8.091 0.020 A 43 VAL HA H 1 3.105 0.020 A 43 VAL HB H 1 1.173 0.020 A 43 VAL HG1% H 1 -0.042 0.020 A 43 VAL HG2% H 1 -0.245 0.020 A 43 VAL C C 13 174.512 0.3 A 43 VAL CA C 13 65.670 0.3 A 43 VAL CB C 13 30.236 0.3 A 43 VAL CG1 C 13 20.777 0.3 A 43 VAL CG2 C 13 22.058 0.3 A 43 VAL N N 15 123.425 0.3 A 44 VAL H H 1 8.280 0.020 A 44 VAL HA H 1 3.279 0.020 A 44 VAL HB H 1 2.043 0.020 A 44 VAL HG1% H 1 0.924 0.020 A 44 VAL HG2% H 1 0.867 0.020 A 44 VAL C C 13 175.246 0.3 A 44 VAL CA C 13 67.832 0.3 A 44 VAL CB C 13 30.385 0.3 A 44 VAL CG1 C 13 24.079 0.3 A 44 VAL CG2 C 13 21.814 0.3 A 44 VAL N N 15 121.439 0.3 A 45 PHE H H 1 8.186 0.020 A 45 PHE HA H 1 4.513 0.020 A 45 PHE HB2 H 1 3.193 0.020 A 45 PHE HD1 H 1 7.240 0.020 A 45 PHE C C 13 175.149 0.3 A 45 PHE CA C 13 60.223 0.3 A 45 PHE CB C 13 38.170 0.3 A 45 PHE CD1 C 13 131.552 0.3 A 45 PHE N N 15 120.618 0.3 A 46 ALA H H 1 7.960 0.020 A 46 ALA HA H 1 4.055 0.020 A 46 ALA HB% H 1 1.517 0.020 A 46 ALA C C 13 178.864 0.3 A 46 ALA CA C 13 55.013 0.3 A 46 ALA CB C 13 17.481 0.3 A 46 ALA N N 15 122.067 0.3 A 47 ILE H H 1 8.436 0.020 A 47 ILE HA H 1 3.604 0.020 A 47 ILE HB H 1 2.237 0.020 A 47 ILE HD1% H 1 0.667 0.020 A 47 ILE HG1y H 1 1.008 0.020 A 47 ILE HG1x H 1 0.887 0.020 A 47 ILE HG2% H 1 0.776 0.020 A 47 ILE C C 13 174.636 0.3 A 47 ILE CA C 13 66.374 0.3 A 47 ILE CB C 13 37.555 0.3 A 47 ILE CD1 C 13 13.436 0.3 A 47 ILE CG1 C 13 30.035 0.3 A 47 ILE CG2 C 13 17.615 0.3 A 47 ILE N N 15 121.987 0.3 A 48 GLU H H 1 8.858 0.020 A 48 GLU HA H 1 3.817 0.020 A 48 GLU HB2 H 1 2.260 0.020 A 48 GLU HB3 H 1 2.260 0.020 A 48 GLU HGy H 1 2.576 0.020 A 48 GLU HGx H 1 2.417 0.020 A 48 GLU C C 13 176.410 0.3 A 48 GLU CA C 13 60.171 0.3 A 48 GLU CB C 13 28.385 0.3 A 48 GLU CG C 13 35.735 0.3 A 48 GLU N N 15 120.293 0.3 A 49 GLN H H 1 8.030 0.020 A 49 GLN HA H 1 3.890 0.020 A 49 GLN HBy H 1 2.048 0.020 A 49 GLN HBx H 1 1.940 0.020 A 49 GLN HE21 H 1 6.750 0.020 A 49 GLN HE22 H 1 6.805 0.020 A 49 GLN C C 13 175.925 0.3 A 49 GLN CA C 13 57.920 0.3 A 49 GLN CB C 13 28.394 0.3 A 49 GLN CG C 13 34.221 0.3 A 49 GLN N N 15 115.768 0.3 A 49 GLN NE2 N 15 114.390 0.3 A 50 GLU H H 1 7.627 0.020 A 50 GLU HA H 1 3.977 0.020 A 50 GLU HB2 H 1 1.894 0.020 A 50 GLU C C 13 173.583 0.3 A 50 GLU CA C 13 57.664 0.3 A 50 GLU CB C 13 28.338 0.3 A 50 GLU CG C 13 34.717 0.3 A 50 GLU N N 15 120.281 0.3 A 51 PHE H H 1 7.406 0.020 A 51 PHE HA H 1 4.609 0.020 A 51 PHE HBy H 1 3.246 0.020 A 51 PHE HBx H 1 2.454 0.020 A 51 PHE HD1 H 1 7.495 0.020 A 51 PHE HE1 H 1 6.995 0.020 A 51 PHE C C 13 170.645 0.3 A 51 PHE CA C 13 57.464 0.3 A 51 PHE CB C 13 39.557 0.3 A 51 PHE CD1 C 13 132.988 0.3 A 51 PHE CE1 C 13 130.106 0.3 A 51 PHE N N 15 112.795 0.3 A 52 ILE H H 1 7.590 0.020 A 52 ILE HA H 1 3.459 0.020 A 52 ILE HB H 1 2.315 0.020 A 52 ILE HD1% H 1 0.743 0.020 A 52 ILE HG1y H 1 1.282 0.020 A 52 ILE HG1x H 1 0.949 0.020 A 52 ILE HG2% H 1 0.860 0.020 A 52 ILE C C 13 171.740 0.3 A 52 ILE CA C 13 61.567 0.3 A 52 ILE CB C 13 33.984 0.3 A 52 ILE CD1 C 13 12.362 0.3 A 52 ILE CG1 C 13 27.343 0.3 A 52 ILE CG2 C 13 19.274 0.3 A 52 ILE N N 15 118.869 0.3 A 53 LEU H H 1 7.982 0.020 A 53 LEU HA H 1 4.564 0.020 A 53 LEU HBy H 1 1.498 0.020 A 53 LEU HBx H 1 1.397 0.020 A 53 LEU HD1% H 1 0.755 0.020 A 53 LEU C C 13 172.308 0.3 A 53 LEU CA C 13 53.057 0.3 A 53 LEU CB C 13 46.354 0.3 A 53 LEU CD1 C 13 25.970 0.3 A 53 LEU N N 15 119.116 0.3 A 54 ASP H H 1 8.139 0.020 A 54 ASP HA H 1 4.655 0.020 A 54 ASP HBy H 1 2.552 0.020 A 54 ASP HBx H 1 2.390 0.020 A 54 ASP C C 13 172.641 0.3 A 54 ASP CA C 13 52.773 0.3 A 54 ASP CB C 13 41.189 0.3 A 54 ASP N N 15 120.893 0.3 A 55 ILE H H 1 8.260 0.020 A 55 ILE HA H 1 4.288 0.020 A 55 ILE HB H 1 1.571 0.020 A 55 ILE HD1% H 1 0.446 0.020 A 55 ILE HG1y H 1 0.871 0.020 A 55 ILE HG1x H 1 0.834 0.020 A 55 ILE HG2% H 1 0.511 0.020 A 55 ILE CA C 13 59.309 0.3 A 55 ILE CB C 13 38.446 0.3 A 55 ILE N N 15 125.000 0.3 A 56 PRO HA H 1 4.358 0.020 A 56 PRO HBy H 1 2.310 0.020 A 56 PRO HBx H 1 1.624 0.020 A 56 PRO HDy H 1 3.998 0.020 A 56 PRO HDx H 1 3.726 0.020 A 56 PRO HG2 H 1 1.941 0.020 A 56 PRO C C 13 174.775 0.3 A 56 PRO CA C 13 62.644 0.3 A 56 PRO CB C 13 32.360 0.3 A 56 PRO CD C 13 51.211 0.3 A 56 PRO CG C 13 27.942 0.3 A 57 ASP H H 1 8.768 0.020 A 57 ASP HA H 1 4.187 0.020 A 57 ASP HBy H 1 2.638 0.020 A 57 ASP HBx H 1 2.519 0.020 A 57 ASP C C 13 175.108 0.3 A 57 ASP CA C 13 57.679 0.3 A 57 ASP CB C 13 39.738 0.3 A 57 ASP N N 15 123.738 0.3 A 58 HIS H H 1 8.517 0.020 A 58 HIS HA H 1 4.324 0.020 A 58 HIS HBy H 1 3.188 0.020 A 58 HIS HBx H 1 3.063 0.020 A 58 HIS HD2 H 1 6.780 0.020 A 58 HIS HE1 H 1 7.880 0.020 A 58 HIS C C 13 173.528 0.3 A 58 HIS CA C 13 57.679 0.3 A 58 HIS CB C 13 28.385 0.3 A 58 HIS CE1 C 13 139.649 0.3 A 58 HIS N N 15 114.331 0.3 A 59 ASP H H 1 7.087 0.020 A 59 ASP HA H 1 4.448 0.020 A 59 ASP HBy H 1 2.409 0.020 A 59 ASP HBx H 1 2.237 0.020 A 59 ASP C C 13 175.218 0.3 A 59 ASP CA C 13 55.611 0.3 A 59 ASP CB C 13 40.738 0.3 A 59 ASP N N 15 118.160 0.3 A 60 ALA H H 1 8.282 0.020 A 60 ALA HA H 1 3.494 0.020 A 60 ALA HB% H 1 1.233 0.020 A 60 ALA C C 13 177.242 0.3 A 60 ALA CA C 13 55.023 0.3 A 60 ALA CB C 13 17.837 0.3 A 60 ALA N N 15 123.765 0.3 A 61 GLU H H 1 7.699 0.020 A 61 GLU HA H 1 3.889 0.020 A 61 GLU HB2 H 1 1.911 0.020 A 61 GLU HB3 H 1 1.911 0.020 A 61 GLU HG2 H 1 2.221 0.020 A 61 GLU HG3 H 1 2.221 0.020 A 61 GLU C C 13 174.165 0.3 A 61 GLU CA C 13 57.807 0.3 A 61 GLU CB C 13 29.328 0.3 A 61 GLU CG C 13 35.628 0.3 A 61 GLU N N 15 114.605 0.3 A 62 LYS H H 1 6.993 0.020 A 62 LYS HA H 1 4.171 0.020 A 62 LYS HB2 H 1 1.943 0.020 A 62 LYS HD2 H 1 1.733 0.020 A 62 LYS HG2 H 1 1.335 0.020 A 62 LYS HG3 H 1 1.335 0.020 A 62 LYS C C 13 173.832 0.3 A 62 LYS CA C 13 55.946 0.3 A 62 LYS CB C 13 32.323 0.3 A 62 LYS CD C 13 29.170 0.3 A 62 LYS CE C 13 42.175 0.3 A 62 LYS CG C 13 25.091 0.3 A 62 LYS N N 15 115.222 0.3 A 63 ILE H H 1 7.343 0.020 A 63 ILE HA H 1 3.776 0.020 A 63 ILE HB H 1 1.969 0.020 A 63 ILE HD1% H 1 0.277 0.020 A 63 ILE HG1y H 1 1.457 0.020 A 63 ILE HG1x H 1 0.709 0.020 A 63 ILE HG2% H 1 0.537 0.020 A 63 ILE C C 13 171.185 0.3 A 63 ILE CA C 13 61.579 0.3 A 63 ILE CB C 13 35.763 0.3 A 63 ILE CD1 C 13 12.404 0.3 A 63 ILE CG1 C 13 26.889 0.3 A 63 ILE CG2 C 13 17.344 0.3 A 63 ILE N N 15 119.977 0.3 A 64 GLN H H 1 8.375 0.020 A 64 GLN HA H 1 4.256 0.020 A 64 GLN HBy H 1 2.156 0.020 A 64 GLN HBx H 1 1.497 0.020 A 64 GLN HE21 H 1 6.600 0.020 A 64 GLN HE22 H 1 7.136 0.020 A 64 GLN HG2 H 1 1.920 0.020 A 64 GLN HG3 H 1 1.920 0.020 A 64 GLN C C 13 170.783 0.3 A 64 GLN CA C 13 54.290 0.3 A 64 GLN CB C 13 30.196 0.3 A 64 GLN CG C 13 33.128 0.3 A 64 GLN N N 15 123.288 0.3 A 64 GLN NE2 N 15 112.287 0.3 A 65 SER H H 1 7.109 0.020 A 65 SER HA H 1 3.492 0.020 A 65 SER HBx H 1 5.933 0.020 A 65 SER HBy H 1 5.933 0.020 A 65 SER C C 13 169.702 0.3 A 65 SER CA C 13 55.344 0.3 A 65 SER CB C 13 66.676 0.3 A 65 SER N N 15 112.891 0.3 A 66 ILE H H 1 8.407 0.020 A 66 ILE HA H 1 3.656 0.020 A 66 ILE HB H 1 2.454 0.020 A 66 ILE HD1% H 1 0.745 0.020 A 66 ILE HG1y H 1 2.006 0.020 A 66 ILE HG1x H 1 0.978 0.020 A 66 ILE HG2% H 1 0.774 0.020 A 66 ILE CA C 13 67.367 0.3 A 66 ILE CB C 13 34.640 0.3 A 66 ILE N N 15 118.837 0.3 A 67 PRO HA H 1 4.102 0.020 A 67 PRO HBx H 1 2.287 0.020 A 67 PRO HBy H 1 2.287 0.020 A 67 PRO C C 13 176.272 0.3 A 67 PRO CA C 13 66.315 0.3 A 67 PRO CB C 13 30.922 0.3 A 67 PRO CD C 13 48.451 0.3 A 67 PRO CG C 13 28.412 0.3 A 68 ASP H H 1 7.372 0.020 A 68 ASP HA H 1 4.211 0.020 A 68 ASP HBy H 1 2.779 0.020 A 68 ASP HBx H 1 2.613 0.020 A 68 ASP C C 13 176.216 0.3 A 68 ASP CA C 13 57.089 0.3 A 68 ASP CB C 13 42.085 0.3 A 68 ASP N N 15 114.795 0.3 A 69 ALA H H 1 7.904 0.020 A 69 ALA HA H 1 3.824 0.020 A 69 ALA HB% H 1 1.392 0.020 A 69 ALA C C 13 175.108 0.3 A 69 ALA CA C 13 55.245 0.3 A 69 ALA CB C 13 17.777 0.3 A 69 ALA N N 15 122.060 0.3 A 70 VAL H H 1 8.421 0.020 A 70 VAL HA H 1 3.178 0.020 A 70 VAL HB H 1 2.008 0.020 A 70 VAL HG1% H 1 0.955 0.020 A 70 VAL HG2% H 1 0.799 0.020 A 70 VAL C C 13 174.456 0.3 A 70 VAL CA C 13 66.280 0.3 A 70 VAL CB C 13 31.452 0.3 A 70 VAL CG1 C 13 23.536 0.3 A 70 VAL CG2 C 13 20.975 0.3 A 70 VAL N N 15 116.690 0.3 A 71 GLU H H 1 8.017 0.020 A 71 GLU HA H 1 3.813 0.020 A 71 GLU HB2 H 1 1.943 0.020 A 71 GLU HB3 H 1 1.943 0.020 A 71 GLU HG2 H 1 2.174 0.020 A 71 GLU C C 13 175.482 0.3 A 71 GLU CA C 13 58.963 0.3 A 71 GLU CB C 13 29.109 0.3 A 71 GLU CG C 13 36.001 0.3 A 71 GLU N N 15 117.342 0.3 A 72 TYR H H 1 7.591 0.020 A 72 TYR HA H 1 3.864 0.020 A 72 TYR HBy H 1 3.019 0.020 A 72 TYR HBx H 1 2.829 0.020 A 72 TYR HD1 H 1 6.793 0.020 A 72 TYR HE1 H 1 6.557 0.020 A 72 TYR C C 13 175.537 0.3 A 72 TYR CA C 13 61.792 0.3 A 72 TYR CB C 13 38.260 0.3 A 72 TYR CD1 C 13 133.053 0.3 A 72 TYR CE1 C 13 117.947 0.3 A 72 TYR N N 15 117.209 0.3 A 73 ILE H H 1 8.171 0.020 A 73 ILE HA H 1 3.116 0.020 A 73 ILE HB H 1 1.341 0.020 A 73 ILE HD1% H 1 -0.117 0.020 A 73 ILE HG12 H 1 0.776 0.020 A 73 ILE HG2% H 1 0.034 0.020 A 73 ILE C C 13 175.953 0.3 A 73 ILE CA C 13 63.706 0.3 A 73 ILE CB C 13 36.898 0.3 A 73 ILE CD1 C 13 12.423 0.3 A 73 ILE CG1 C 13 28.814 0.3 A 73 ILE CG2 C 13 17.450 0.3 A 73 ILE N N 15 118.569 0.3 A 74 ALA H H 1 8.598 0.020 A 74 ALA HA H 1 3.852 0.020 A 74 ALA HB% H 1 1.316 0.020 A 74 ALA C C 13 175.717 0.3 A 74 ALA CA C 13 54.458 0.3 A 74 ALA CB C 13 18.263 0.3 A 74 ALA N N 15 119.539 0.3 A 75 GLN H H 1 7.025 0.020 A 75 GLN HA H 1 4.268 0.020 A 75 GLN HB2 H 1 1.952 0.020 A 75 GLN HE21 H 1 7.348 0.020 A 75 GLN HE22 H 1 6.692 0.020 A 75 GLN HG2 H 1 2.365 0.020 A 75 GLN C C 13 172.058 0.3 A 75 GLN CA C 13 54.787 0.3 A 75 GLN CB C 13 28.695 0.3 A 75 GLN CG C 13 33.761 0.3 A 75 GLN N N 15 111.625 0.3 A 75 GLN NE2 N 15 112.021 0.3 A 76 ASN H H 1 7.401 0.020 A 76 ASN HA H 1 4.848 0.020 A 76 ASN HBy H 1 2.746 0.020 A 76 ASN HBx H 1 2.235 0.020 A 76 ASN HD21 H 1 6.553 0.020 A 76 ASN HD22 H 1 7.065 0.020 A 76 ASN CA C 13 50.863 0.3 A 76 ASN CB C 13 39.363 0.3 A 76 ASN N N 15 120.549 0.3 A 76 ASN ND2 N 15 113.474 0.3 A 77 PRO HA H 1 4.369 0.020 A 77 PRO HBy H 1 2.226 0.020 A 77 PRO HBx H 1 1.895 0.020 A 77 PRO C C 13 174.498 0.3 A 77 PRO CA C 13 63.712 0.3 A 77 PRO CB C 13 32.128 0.3 A 77 PRO CD C 13 51.134 0.3 A 77 PRO CG C 13 27.188 0.3 A 78 MET H H 1 8.232 0.020 A 78 MET HA H 1 4.415 0.020 A 78 MET HGy H 1 2.116 0.020 A 78 MET HGx H 1 1.964 0.020 A 78 MET C C 13 173.472 0.3 A 78 MET CA C 13 54.901 0.3 A 78 MET CB C 13 32.218 0.3 A 78 MET N N 15 116.658 0.3 A 79 ALA H H 1 7.558 0.020 A 79 ALA HA H 1 4.192 0.020 A 79 ALA HB% H 1 1.394 0.020 A 79 ALA C C 13 173.763 0.3 A 79 ALA CA C 13 52.714 0.3 A 79 ALA CB C 13 19.656 0.3 A 79 ALA N N 15 123.016 0.3 A 80 LYS H H 1 8.407 0.020 A 80 LYS HA H 1 4.218 0.020 A 80 LYS HB2 H 1 1.575 0.020 A 80 LYS HD2 H 1 1.729 0.020 A 80 LYS HE2 H 1 2.921 0.020 A 80 LYS HG2 H 1 1.390 0.020 A 80 LYS CA C 13 57.151 0.3 A 80 LYS CB C 13 33.841 0.3 A 80 LYS N N 15 127.937 0.3 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 3 ASP H A 2 ASN HB2 1.0 1.8 4.4 2 1 A 2 ASN HB3 A 3 ASP H 1.0 1.8 4.4 3 2 A 2 ASN H A 2 ASN HA 1.0 1.8 2.8 4 3 A 2 ASN H A 2 ASN HB2 1.0 1.6 4.2 5 3 A 2 ASN HB3 A 2 ASN H 1.0 1.6 4.2 6 4 A 3 ASP HA A 2 ASN HB2 1.0 1.8 4.4 7 4 A 2 ASN HB3 A 3 ASP HA 1.0 1.8 4.4 8 5 A 3 ASP HA A 3 ASP HBx 1.0 1.8 2.8 9 6 A 3 ASP H A 3 ASP HA 1.0 1.8 2.8 10 7 A 3 ASP H A 2 ASN HA 1.0 1.8 3.4 11 8 A 3 ASP H A 3 ASP HA 1.0 1.8 2.8 12 9 A 3 ASP H A 3 ASP HBx 1.0 1.8 5.0 13 10 A 3 ASP H A 3 ASP HBy 1.0 1.8 5.0 14 11 A 3 ASP H A 4 VAL H 1.0 1.8 3.4 15 12 A 4 VAL HA A 4 VAL HB 1.0 1.8 2.8 16 13 A 4 VAL HA A 4 VAL HG1% 1.0 1.8 6.0 17 13 A 4 VAL HA A 4 VAL HG2% 1.0 1.8 6.0 18 14 A 4 VAL HA A 51 PHE HE% 1.0 1.8 7.0 19 15 A 4 VAL HA A 6 THR H 1.0 1.8 5.0 20 16 A 4 VAL HA A 7 ARG H 1.0 1.8 5.0 21 17 A 4 VAL HA A 8 VAL HB 1.0 1.8 5.0 22 18 A 4 VAL HA A 8 VAL HG1% 1.0 1.8 5.0 23 19 A 4 VAL HA A 8 VAL H 1.0 1.8 5.0 24 20 A 4 VAL HA A 4 VAL HB 1.0 1.8 2.8 25 21 A 4 VAL HB A 70 VAL HG1% 1.0 1.8 8.0 26 21 A 4 VAL HB A 70 VAL HG2% 1.0 1.8 8.0 27 22 A 4 VAL HG1% A 73 ILE HG1y 1.0 1.8 8.0 28 22 A 73 ILE HG12 A 4 VAL HG1% 1.0 1.8 8.0 29 22 A 4 VAL HG2% A 73 ILE HG1y 1.0 1.8 8.0 30 22 A 4 VAL HG2% A 73 ILE HG12 1.0 1.8 8.0 31 22 A 4 VAL HG2% A 73 ILE HG2% 1.0 1.8 8.0 32 22 A 73 ILE HG2% A 4 VAL HG1% 1.0 1.8 8.0 33 23 A 74 ALA H A 4 VAL HG1% 1.0 1.8 7.0 34 23 A 4 VAL HG2% A 74 ALA H 1.0 1.8 7.0 35 24 A 4 VAL HG2% A 4 VAL HG1% 1.0 1.8 5.0 36 25 A 8 VAL HB A 4 VAL HG1% 1.0 1.8 5.0 37 26 A 4 VAL HA A 4 VAL HG1% 1.0 1.8 6.0 38 26 A 4 VAL HA A 4 VAL HG2% 1.0 1.8 6.0 39 27 A 4 VAL HG2% A 51 PHE HBx 1.0 1.8 7.0 40 27 A 4 VAL HG1% A 51 PHE HBx 1.0 1.8 7.0 41 28 A 4 VAL HG2% A 51 PHE HBy 1.0 1.8 7.0 42 28 A 51 PHE HBy A 4 VAL HG1% 1.0 1.8 7.0 43 29 A 4 VAL HG1% A 51 PHE HDy 1.0 1.8 8.0 44 29 A 4 VAL HG2% A 51 PHE HDy 1.0 1.8 8.0 45 29 A 4 VAL HG2% A 51 PHE HD1 1.0 1.8 8.0 46 29 A 51 PHE HD1 A 4 VAL HG1% 1.0 1.8 8.0 47 30 A 51 PHE HE% A 4 VAL HG1% 1.0 1.8 8.0 48 30 A 4 VAL HG2% A 51 PHE HE% 1.0 1.8 8.0 49 31 A 4 VAL HG1% A 73 ILE HG1y 1.0 1.8 8.0 50 31 A 73 ILE HG12 A 4 VAL HG1% 1.0 1.8 8.0 51 31 A 4 VAL HG2% A 73 ILE HG1y 1.0 1.8 8.0 52 31 A 4 VAL HG2% A 73 ILE HG12 1.0 1.8 8.0 53 31 A 4 VAL HG2% A 73 ILE HG2% 1.0 1.8 8.0 54 31 A 73 ILE HG2% A 4 VAL HG1% 1.0 1.8 8.0 55 32 A 4 VAL HG1% A 8 VAL HG1% 1.0 1.8 7.0 56 32 A 4 VAL HG2% A 8 VAL HG1% 1.0 1.8 7.0 57 32 A 8 VAL HG2% A 4 VAL HG1% 1.0 1.8 7.0 58 32 A 4 VAL HG2% A 8 VAL HG2% 1.0 1.8 7.0 59 33 A 2 ASN HA A 4 VAL H 1.0 1.8 5.0 60 34 A 4 VAL H A 1 MET HA 1.0 1.8 5.0 61 35 A 3 ASP HA A 4 VAL H 1.0 1.8 3.4 62 36 A 4 VAL H A 3 ASP HBy 1.0 1.8 4.4 63 36 A 4 VAL H A 3 ASP HBx 1.0 1.8 4.4 64 37 A 3 ASP H A 4 VAL H 1.0 1.8 5.0 65 38 A 4 VAL H A 4 VAL HA 1.0 1.8 2.8 66 39 A 4 VAL H A 4 VAL HB 1.0 1.8 5.0 67 40 A 4 VAL H A 4 VAL HG1% 1.0 1.8 5.0 68 40 A 4 VAL H A 4 VAL HG2% 1.0 1.8 5.0 69 41 A 4 VAL H A 51 PHE HE% 1.0 1.8 7.0 70 42 A 4 VAL H A 5 LEU HD1% 1.0 1.8 5.0 71 43 A 4 VAL H A 5 LEU H 1.0 1.8 5.0 72 44 A 4 VAL H A 74 ALA HB% 1.0 1.8 7.0 73 45 A 5 LEU HA A 5 LEU HBx 1.0 1.8 2.8 74 46 A 5 LEU HA A 5 LEU HBy 1.0 1.8 2.8 75 47 A 5 LEU HD1% A 5 LEU HA 1.0 1.8 5.0 76 48 A 6 THR H A 5 LEU HA 1.0 1.8 3.4 77 49 A 8 VAL HB A 5 LEU HA 1.0 1.8 5.0 78 50 A 8 VAL H A 5 LEU HA 1.0 1.8 5.0 79 51 A 5 LEU HA A 5 LEU HBx 1.0 1.8 5.0 80 52 A 5 LEU HD1% A 5 LEU HBx 1.0 1.8 5.0 81 53 A 5 LEU H A 5 LEU HBx 1.0 1.8 5.0 82 54 A 5 LEU HA A 5 LEU HBy 1.0 1.8 5.0 83 55 A 5 LEU HD1% A 5 LEU HBy 1.0 1.8 3.4 84 56 A 5 LEU H A 5 LEU HBy 1.0 1.8 5.0 85 57 A 6 THR H A 5 LEU HBy 1.0 1.8 4.4 86 57 A 6 THR H A 5 LEU HBx 1.0 1.8 4.4 87 58 A 5 LEU HBx A 70 VAL HG1% 1.0 1.8 7.0 88 58 A 5 LEU HBy A 70 VAL HG1% 1.0 1.8 7.0 89 58 A 70 VAL HG2% A 5 LEU HBy 1.0 1.8 7.0 90 58 A 70 VAL HG2% A 5 LEU HBx 1.0 1.8 7.0 91 59 A 5 LEU HD1% A 5 LEU HA 1.0 1.8 5.0 92 60 A 5 LEU HD1% A 5 LEU HBy 1.0 1.8 6.0 93 60 A 5 LEU HD1% A 5 LEU HBx 1.0 1.8 6.0 94 61 A 5 LEU HD1% A 5 LEU H 1.0 1.8 5.0 95 62 A 6 THR H A 5 LEU HD1% 1.0 1.8 5.0 96 63 A 2 ASN HA A 5 LEU H 1.0 1.8 5.0 97 64 A 4 VAL HA A 5 LEU H 1.0 1.8 5.0 98 65 A 5 LEU H A 4 VAL HG1% 1.0 1.8 6.0 99 65 A 4 VAL HG2% A 5 LEU H 1.0 1.8 6.0 100 66 A 4 VAL H A 5 LEU H 1.0 1.8 5.0 101 67 A 5 LEU H A 5 LEU HA 1.0 1.8 2.8 102 68 A 5 LEU H A 5 LEU HBx 1.0 1.8 5.0 103 69 A 5 LEU H A 5 LEU HBy 1.0 1.8 5.0 104 70 A 5 LEU HD1% A 5 LEU H 1.0 1.8 5.0 105 71 A 6 THR H A 5 LEU H 1.0 1.8 5.0 106 72 A 5 LEU H A 9 LEU HBy 1.0 1.8 6.0 107 72 A 5 LEU H A 9 LEU HBx 1.0 1.8 6.0 108 73 A 5 LEU H A 9 LEU H 1.0 1.8 5.0 109 74 A 6 THR HA A 2 ASN HB2 1.0 1.8 6.0 110 74 A 2 ASN HB3 A 6 THR HA 1.0 1.8 6.0 111 75 A 5 LEU HBx A 6 THR HA 1.0 1.8 6.0 112 76 A 6 THR HA A 5 LEU HBy 1.0 1.8 5.0 113 77 A 6 THR HA A 6 THR HG1 1.0 1.8 5.0 114 78 A 6 THR H A 6 THR HA 1.0 1.8 2.8 115 79 A 7 ARG H A 6 THR HA 1.0 1.8 3.4 116 80 A 8 VAL H A 6 THR HA 1.0 1.8 5.0 117 81 A 6 THR HA A 6 THR HG1 1.0 1.8 5.0 118 82 A 6 THR HG1 A 6 THR HB 1.0 1.8 3.4 119 83 A 6 THR HG1 A 7 ARG HA 1.0 1.8 5.0 120 84 A 7 ARG H A 6 THR HG1 1.0 1.8 5.0 121 85 A 2 ASN HA A 6 THR H 1.0 1.8 5.0 122 86 A 6 THR H A 5 LEU HA 1.0 1.8 5.0 123 87 A 6 THR H A 5 LEU HBy 1.0 1.8 6.0 124 87 A 6 THR H A 5 LEU HBx 1.0 1.8 6.0 125 88 A 6 THR H A 5 LEU HD1% 1.0 1.8 5.0 126 89 A 6 THR H A 6 THR HA 1.0 1.8 2.8 127 90 A 6 THR H A 6 THR HB 1.0 1.8 5.0 128 91 A 6 THR H A 6 THR HG1 1.0 1.8 6.0 129 92 A 6 THR H A 7 ARG H 1.0 1.8 5.0 130 93 A 6 THR H A 9 LEU H 1.0 1.8 5.0 131 94 A 7 ARG HA A 10 GLU H 1.0 1.8 5.0 132 95 A 6 THR HG1 A 7 ARG HA 1.0 1.8 5.0 133 96 A 7 ARG HA A 7 ARG HBx 1.0 1.8 5.0 134 97 A 7 ARG HA A 7 ARG HD2 1.0 1.8 5.0 135 98 A 7 ARG H A 7 ARG HA 1.0 1.8 2.8 136 99 A 46 ALA HB% A 7 ARG HD2 1.0 1.8 7.0 137 99 A 7 ARG HDy A 46 ALA HB% 1.0 1.8 7.0 138 100 A 3 ASP HA A 7 ARG H 1.0 1.8 5.0 139 101 A 7 ARG H A 7 ARG HA 1.0 1.8 2.8 140 102 A 7 ARG H A 7 ARG HBx 1.0 1.8 5.0 141 103 A 7 ARG H A 7 ARG HBy 1.0 1.8 5.0 142 104 A 7 ARG H A 8 VAL HA 1.0 1.8 5.0 143 105 A 7 ARG H A 8 VAL H 1.0 1.8 3.4 144 106 A 10 GLU H A 8 VAL HA 1.0 1.8 5.0 145 107 A 8 VAL HA A 11 VAL H 1.0 1.8 5.0 146 108 A 8 VAL HA A 12 VAL H 1.0 1.8 5.0 147 109 A 51 PHE HE% A 8 VAL HA 1.0 1.8 7.0 148 110 A 7 ARG HA A 8 VAL HA 1.0 1.8 5.0 149 111 A 8 VAL HB A 8 VAL HA 1.0 1.8 5.0 150 112 A 8 VAL HA A 8 VAL HG1% 1.0 1.8 5.0 151 113 A 8 VAL HG2% A 8 VAL HA 1.0 1.8 3.4 152 114 A 8 VAL H A 8 VAL HA 1.0 1.8 5.0 153 115 A 8 VAL HB A 4 VAL HG1% 1.0 1.8 6.0 154 115 A 4 VAL HG2% A 8 VAL HB 1.0 1.8 6.0 155 116 A 8 VAL HB A 5 LEU HA 1.0 1.8 5.0 156 117 A 8 VAL HB A 8 VAL HG1% 1.0 1.8 5.0 157 118 A 8 VAL HB A 8 VAL HG2% 1.0 1.8 5.0 158 119 A 8 VAL HB A 8 VAL H 1.0 1.8 5.0 159 120 A 4 VAL HA A 8 VAL HG1% 1.0 1.8 5.0 160 121 A 8 VAL HB A 8 VAL HG1% 1.0 1.8 3.4 161 122 A 8 VAL HG2% A 8 VAL HG1% 1.0 1.8 5.0 162 123 A 8 VAL H A 8 VAL HG1% 1.0 1.8 5.0 163 124 A 8 VAL HA A 8 VAL HG1% 1.0 1.8 5.0 164 125 A 8 VAL HG2% A 8 VAL HG1% 1.0 1.8 5.0 165 126 A 8 VAL H A 8 VAL HG2% 1.0 1.8 5.0 166 127 A 8 VAL HG2% A 8 VAL HA 1.0 1.8 5.0 167 128 A 11 VAL HB A 8 VAL HG1% 1.0 1.8 6.0 168 128 A 8 VAL HG2% A 11 VAL HB 1.0 1.8 6.0 169 129 A 11 VAL H A 8 VAL HG1% 1.0 1.8 6.0 170 129 A 8 VAL HG2% A 11 VAL H 1.0 1.8 6.0 171 130 A 12 VAL H A 8 VAL HG1% 1.0 1.8 6.0 172 130 A 8 VAL HG2% A 12 VAL H 1.0 1.8 6.0 173 131 A 4 VAL HG1% A 8 VAL HG1% 1.0 1.8 7.0 174 131 A 4 VAL HG2% A 8 VAL HG1% 1.0 1.8 7.0 175 131 A 8 VAL HG2% A 4 VAL HG1% 1.0 1.8 7.0 176 131 A 4 VAL HG2% A 8 VAL HG2% 1.0 1.8 7.0 177 132 A 66 ILE HG2% A 8 VAL HG1% 1.0 1.8 9.0 178 132 A 8 VAL HG2% A 66 ILE HG2% 1.0 1.8 9.0 179 133 A 73 ILE HD1% A 8 VAL HG1% 1.0 1.8 7.0 180 133 A 8 VAL HG2% A 73 ILE HD1% 1.0 1.8 7.0 181 134 A 9 LEU HA A 8 VAL HG1% 1.0 1.8 6.0 182 134 A 8 VAL HG2% A 9 LEU HA 1.0 1.8 6.0 183 135 A 8 VAL H A 10 GLU H 1.0 1.8 5.0 184 136 A 4 VAL HA A 8 VAL H 1.0 1.8 5.0 185 137 A 8 VAL H A 51 PHE HD1 1.0 1.8 8.0 186 137 A 8 VAL H A 51 PHE HDy 1.0 1.8 8.0 187 138 A 51 PHE HE% A 8 VAL H 1.0 1.8 7.0 188 139 A 8 VAL H A 5 LEU HA 1.0 1.8 5.0 189 140 A 8 VAL H A 5 LEU HBy 1.0 1.8 6.0 190 140 A 8 VAL H A 5 LEU HBx 1.0 1.8 6.0 191 141 A 8 VAL H A 6 THR HA 1.0 1.8 5.0 192 142 A 6 THR H A 8 VAL H 1.0 1.8 5.0 193 143 A 8 VAL H A 8 VAL HA 1.0 1.8 2.8 194 144 A 8 VAL HB A 8 VAL H 1.0 1.8 5.0 195 145 A 8 VAL H A 8 VAL HG1% 1.0 1.8 5.0 196 146 A 8 VAL H A 8 VAL HG2% 1.0 1.8 5.0 197 147 A 11 VAL H A 9 LEU HA 1.0 1.8 5.0 198 148 A 9 LEU HA A 8 VAL HG1% 1.0 1.8 6.0 199 148 A 8 VAL HG2% A 9 LEU HA 1.0 1.8 6.0 200 149 A 9 LEU HBx A 9 LEU HA 1.0 1.8 5.0 201 150 A 9 LEU HA A 9 LEU HBy 1.0 1.8 5.0 202 151 A 9 LEU HA A 9 LEU HD1% 1.0 1.8 5.0 203 152 A 9 LEU HA A 9 LEU HG 1.0 1.8 5.0 204 153 A 9 LEU H A 9 LEU HA 1.0 1.8 2.8 205 154 A 9 LEU HBx A 9 LEU HA 1.0 1.8 5.0 206 155 A 9 LEU HBx A 9 LEU HG 1.0 1.8 2.8 207 156 A 9 LEU HBx A 10 GLU HB3 1.0 1.8 7.0 208 156 A 9 LEU HBy A 10 GLU HB3 1.0 1.8 7.0 209 156 A 10 GLU HB2 A 9 LEU HBy 1.0 1.8 7.0 210 156 A 9 LEU HBx A 10 GLU HB2 1.0 1.8 7.0 211 157 A 9 LEU HBx A 13 LYS HGy 1.0 1.8 6.0 212 157 A 13 LYS HGy A 9 LEU HBy 1.0 1.8 6.0 213 158 A 9 LEU HD1% A 23 VAL HG1% 1.0 1.8 7.0 214 159 A 5 LEU H A 9 LEU HBy 1.0 1.8 6.0 215 159 A 5 LEU H A 9 LEU HBx 1.0 1.8 6.0 216 160 A 9 LEU HD1% A 9 LEU HBy 1.0 1.8 6.0 217 160 A 9 LEU HBx A 9 LEU HD1% 1.0 1.8 6.0 218 161 A 9 LEU HD2% A 9 LEU HBy 1.0 1.8 6.0 219 161 A 9 LEU HBx A 9 LEU HD2% 1.0 1.8 6.0 220 162 A 10 GLU H A 9 LEU HD1% 1.0 1.8 5.0 221 163 A 9 LEU HD1% A 13 LYS HA 1.0 1.8 6.0 222 164 A 9 LEU HD1% A 13 LYS HD2 1.0 1.8 5.0 223 165 A 9 LEU HA A 9 LEU HD1% 1.0 1.8 5.0 224 166 A 9 LEU HBx A 9 LEU HD1% 1.0 1.8 5.0 225 167 A 9 LEU HD1% A 9 LEU HBy 1.0 1.8 5.0 226 168 A 9 LEU HD1% A 9 LEU HG 1.0 1.8 3.4 227 169 A 9 LEU H A 9 LEU HD1% 1.0 1.8 5.0 228 170 A 9 LEU HBx A 9 LEU HD2% 1.0 1.8 3.4 229 171 A 9 LEU HG A 9 LEU HD2% 1.0 1.8 3.4 230 172 A 9 LEU H A 9 LEU HD2% 1.0 1.8 5.0 231 173 A 10 GLU H A 9 LEU HG 1.0 1.8 5.0 232 174 A 9 LEU H A 10 GLU H 1.0 1.8 5.0 233 175 A 9 LEU H A 11 VAL H 1.0 1.8 5.0 234 176 A 5 LEU HA A 9 LEU H 1.0 1.8 5.0 235 177 A 9 LEU H A 9 LEU HBy 1.0 1.8 6.0 236 177 A 9 LEU HBx A 9 LEU H 1.0 1.8 6.0 237 178 A 9 LEU H A 9 LEU HG 1.0 1.8 5.0 238 179 A 10 GLU HA A 10 GLU HB3 1.0 1.8 5.0 239 180 A 10 GLU HA A 10 GLU HG3 1.0 1.8 5.0 240 180 A 10 GLU HA A 10 GLU HG2 1.0 1.8 5.0 241 181 A 10 GLU H A 10 GLU HA 1.0 1.8 2.8 242 182 A 11 VAL H A 10 GLU HA 1.0 1.8 3.4 243 183 A 12 VAL H A 10 GLU HA 1.0 1.8 5.0 244 184 A 10 GLU HA A 13 LYS HBx 1.0 1.8 5.0 245 185 A 10 GLU HA A 13 LYS HBy 1.0 1.8 5.0 246 186 A 10 GLU HA A 13 LYS HGx 1.0 1.8 5.0 247 187 A 10 GLU HA A 13 LYS HGy 1.0 1.8 5.0 248 188 A 10 GLU HA A 13 LYS H 1.0 1.8 5.0 249 189 A 10 GLU HA A 14 ASN H 1.0 1.8 5.0 250 190 A 9 LEU HD1% A 10 GLU HA 1.0 1.8 5.0 251 191 A 10 GLU HG2 A 10 GLU HB3 1.0 1.8 4.4 252 191 A 10 GLU HB3 A 10 GLU HG3 1.0 1.8 4.4 253 192 A 11 VAL HA A 10 GLU HB3 1.0 1.8 6.0 254 192 A 10 GLU HB2 A 11 VAL HA 1.0 1.8 6.0 255 193 A 11 VAL H A 10 GLU HB3 1.0 1.8 6.0 256 193 A 11 VAL H A 10 GLU HB2 1.0 1.8 6.0 257 194 A 14 ASN H A 10 GLU HB3 1.0 1.8 6.0 258 194 A 10 GLU HB2 A 14 ASN H 1.0 1.8 6.0 259 195 A 9 LEU HBx A 10 GLU HB3 1.0 1.8 7.0 260 195 A 9 LEU HBy A 10 GLU HB3 1.0 1.8 7.0 261 195 A 10 GLU HB2 A 9 LEU HBy 1.0 1.8 7.0 262 195 A 9 LEU HBx A 10 GLU HB2 1.0 1.8 7.0 263 196 A 10 GLU HB3 A 10 GLU HG3 1.0 1.8 4.4 264 196 A 10 GLU HB2 A 10 GLU HG3 1.0 1.8 4.4 265 197 A 11 VAL HG2% A 10 GLU HG3 1.0 1.8 6.0 266 197 A 10 GLU HG3 A 11 VAL HG1% 1.0 1.8 6.0 267 198 A 9 LEU H A 10 GLU HG3 1.0 1.8 5.0 268 199 A 10 GLU HG2 A 11 VAL HG2% 1.0 1.8 6.0 269 199 A 10 GLU HG2 A 11 VAL HG1% 1.0 1.8 6.0 270 200 A 9 LEU H A 10 GLU HG2 1.0 1.8 5.0 271 201 A 10 GLU HA A 10 GLU HG3 1.0 1.8 6.0 272 201 A 10 GLU HA A 10 GLU HG2 1.0 1.8 6.0 273 202 A 10 GLU H A 10 GLU HG3 1.0 1.8 6.0 274 202 A 10 GLU H A 10 GLU HG2 1.0 1.8 6.0 275 203 A 14 ASN HD21 A 10 GLU HG3 1.0 1.8 6.0 276 203 A 10 GLU HG2 A 14 ASN HD21 1.0 1.8 6.0 277 204 A 14 ASN HD22 A 10 GLU HG3 1.0 1.8 6.0 278 204 A 10 GLU HG2 A 14 ASN HD22 1.0 1.8 6.0 279 205 A 14 ASN H A 10 GLU HG3 1.0 1.8 6.0 280 205 A 10 GLU HG2 A 14 ASN H 1.0 1.8 6.0 281 206 A 6 THR HG1 A 10 GLU HG3 1.0 1.8 6.0 282 206 A 6 THR HG1 A 10 GLU HG2 1.0 1.8 6.0 283 207 A 6 THR HG2% A 10 GLU HG3 1.0 1.8 6.0 284 207 A 10 GLU HG2 A 6 THR HG2% 1.0 1.8 6.0 285 208 A 10 GLU H A 10 GLU HA 1.0 1.8 2.8 286 209 A 10 GLU H A 10 GLU HB3 1.0 1.8 6.0 287 209 A 10 GLU H A 10 GLU HB2 1.0 1.8 6.0 288 210 A 10 GLU H A 10 GLU HG3 1.0 1.8 6.0 289 210 A 10 GLU H A 10 GLU HG2 1.0 1.8 6.0 290 211 A 10 GLU H A 11 VAL HG1% 1.0 1.8 6.0 291 211 A 10 GLU H A 11 VAL HG2% 1.0 1.8 6.0 292 212 A 10 GLU H A 11 VAL H 1.0 1.8 5.0 293 213 A 10 GLU H A 13 LYS HBx 1.0 1.8 6.0 294 213 A 10 GLU H A 13 LYS HBy 1.0 1.8 6.0 295 214 A 6 THR HA A 10 GLU H 1.0 1.8 5.0 296 215 A 7 ARG HA A 10 GLU H 1.0 1.8 5.0 297 216 A 10 GLU H A 9 LEU HBy 1.0 1.8 6.0 298 216 A 9 LEU HBx A 10 GLU H 1.0 1.8 6.0 299 217 A 10 GLU H A 9 LEU HD1% 1.0 1.8 5.0 300 218 A 9 LEU H A 10 GLU H 1.0 1.8 5.0 301 219 A 11 VAL HA A 10 GLU HB3 1.0 1.8 5.0 302 219 A 10 GLU HB2 A 11 VAL HA 1.0 1.8 5.0 303 220 A 11 VAL HB A 11 VAL HA 1.0 1.8 2.8 304 221 A 11 VAL HA A 11 VAL HG1% 1.0 1.8 5.0 305 222 A 11 VAL HA A 11 VAL HG2% 1.0 1.8 5.0 306 223 A 11 VAL H A 11 VAL HA 1.0 1.8 2.8 307 224 A 12 VAL H A 11 VAL HA 1.0 1.8 3.4 308 225 A 13 LYS H A 11 VAL HA 1.0 1.8 5.0 309 226 A 11 VAL HA A 14 ASN HBx 1.0 1.8 6.0 310 226 A 11 VAL HA A 14 ASN HBy 1.0 1.8 6.0 311 227 A 11 VAL HA A 14 ASN HD22 1.0 1.8 5.0 312 228 A 14 ASN H A 11 VAL HA 1.0 1.8 5.0 313 229 A 11 VAL HB A 11 VAL HA 1.0 1.8 2.8 314 230 A 11 VAL HB A 11 VAL HG1% 1.0 1.8 3.4 315 231 A 11 VAL HB A 11 VAL HG2% 1.0 1.8 3.4 316 232 A 11 VAL H A 11 VAL HB 1.0 1.8 5.0 317 233 A 12 VAL H A 11 VAL HB 1.0 1.8 5.0 318 234 A 11 VAL HB A 7 ARG HD2 1.0 1.8 5.0 319 235 A 10 GLU HG3 A 11 VAL HG1% 1.0 1.8 6.0 320 235 A 10 GLU HG2 A 11 VAL HG1% 1.0 1.8 6.0 321 236 A 11 VAL HA A 11 VAL HG1% 1.0 1.8 5.0 322 237 A 11 VAL HB A 11 VAL HG1% 1.0 1.8 3.4 323 238 A 11 VAL H A 11 VAL HG1% 1.0 1.8 5.0 324 239 A 12 VAL H A 11 VAL HG1% 1.0 1.8 5.0 325 240 A 11 VAL HG2% A 43 VAL HG2% 1.0 1.8 7.0 326 240 A 11 VAL HG2% A 43 VAL HG1% 1.0 1.8 7.0 327 241 A 47 ILE HG2% A 11 VAL HG1% 1.0 1.8 7.0 328 241 A 47 ILE HG1y A 11 VAL HG1% 1.0 1.8 7.0 329 241 A 11 VAL HG1% A 47 ILE HG1x 1.0 1.8 7.0 330 242 A 11 VAL HG2% A 10 GLU HG3 1.0 1.8 6.0 331 242 A 10 GLU HG2 A 11 VAL HG2% 1.0 1.8 6.0 332 243 A 11 VAL HA A 11 VAL HG2% 1.0 1.8 5.0 333 244 A 11 VAL HB A 11 VAL HG2% 1.0 1.8 3.4 334 245 A 11 VAL H A 11 VAL HG2% 1.0 1.8 5.0 335 246 A 12 VAL H A 11 VAL HG2% 1.0 1.8 5.0 336 247 A 10 GLU HB2 A 11 VAL HG1% 1.0 1.8 7.0 337 247 A 11 VAL HG2% A 10 GLU HB3 1.0 1.8 7.0 338 247 A 10 GLU HB2 A 11 VAL HG2% 1.0 1.8 7.0 339 247 A 10 GLU HB3 A 11 VAL HG1% 1.0 1.8 7.0 340 248 A 10 GLU H A 11 VAL HG1% 1.0 1.8 6.0 341 248 A 10 GLU H A 11 VAL HG2% 1.0 1.8 6.0 342 249 A 11 VAL HG2% A 15 PHE HBx 1.0 1.8 7.0 343 249 A 11 VAL HG1% A 15 PHE HBx 1.0 1.8 7.0 344 249 A 15 PHE HBy A 11 VAL HG1% 1.0 1.8 7.0 345 249 A 11 VAL HG2% A 15 PHE HBy 1.0 1.8 7.0 346 250 A 15 PHE H A 11 VAL HG1% 1.0 1.8 6.0 347 250 A 11 VAL HG2% A 15 PHE H 1.0 1.8 6.0 348 251 A 11 VAL HG2% A 50 GLU HGx 1.0 1.8 8.0 349 251 A 11 VAL HG2% A 50 GLU HGy 1.0 1.8 8.0 350 252 A 11 VAL HG2% A 7 ARG HD2 1.0 1.8 6.0 351 252 A 7 ARG HD2 A 11 VAL HG1% 1.0 1.8 6.0 352 253 A 8 VAL H A 11 VAL HG1% 1.0 1.8 6.0 353 253 A 8 VAL H A 11 VAL HG2% 1.0 1.8 6.0 354 254 A 11 VAL H A 10 GLU HA 1.0 1.8 5.0 355 255 A 10 GLU H A 11 VAL H 1.0 1.8 5.0 356 256 A 11 VAL H A 11 VAL HA 1.0 1.8 2.8 357 257 A 11 VAL H A 11 VAL HB 1.0 1.8 5.0 358 258 A 11 VAL H A 11 VAL HG1% 1.0 1.8 5.0 359 259 A 11 VAL H A 11 VAL HG2% 1.0 1.8 5.0 360 260 A 11 VAL H A 12 VAL H 1.0 1.8 5.0 361 261 A 11 VAL H A 13 LYS HBx 1.0 1.8 6.0 362 261 A 11 VAL H A 13 LYS HBy 1.0 1.8 6.0 363 262 A 11 VAL H A 13 LYS H 1.0 1.8 5.0 364 263 A 11 VAL H A 14 ASN H 1.0 1.8 5.0 365 264 A 7 ARG HA A 11 VAL H 1.0 1.8 5.0 366 265 A 13 LYS H A 12 VAL HG1% 1.0 1.8 5.0 367 266 A 43 VAL HG2% A 12 VAL HG1% 1.0 1.8 7.0 368 266 A 12 VAL HG1% A 43 VAL HG1% 1.0 1.8 7.0 369 267 A 47 ILE HG2% A 12 VAL HG1% 1.0 1.8 8.0 370 267 A 47 ILE HG1y A 12 VAL HG1% 1.0 1.8 8.0 371 267 A 12 VAL HG1% A 47 ILE HG1x 1.0 1.8 8.0 372 268 A 35 LEU HD2% A 12 VAL HG1% 1.0 1.8 7.0 373 269 A 12 VAL H A 11 VAL HA 1.0 1.8 5.0 374 270 A 12 VAL H A 11 VAL HB 1.0 1.8 5.0 375 271 A 12 VAL H A 11 VAL HG1% 1.0 1.8 6.0 376 271 A 12 VAL H A 11 VAL HG2% 1.0 1.8 6.0 377 272 A 11 VAL H A 12 VAL H 1.0 1.8 5.0 378 273 A 12 VAL H A 12 VAL HB 1.0 1.8 5.0 379 274 A 12 VAL H A 12 VAL HG1% 1.0 1.8 5.0 380 275 A 12 VAL H A 12 VAL HG2% 1.0 1.8 5.0 381 276 A 12 VAL H A 13 LYS H 1.0 1.8 5.0 382 277 A 12 VAL H A 14 ASN H 1.0 1.8 5.0 383 278 A 8 VAL HA A 12 VAL H 1.0 1.8 5.0 384 279 A 12 VAL H A 9 LEU HA 1.0 1.8 5.0 385 280 A 13 LYS HA A 13 LYS HBx 1.0 1.8 5.0 386 281 A 13 LYS HGy A 13 LYS HBx 1.0 1.8 3.4 387 281 A 13 LYS HBx A 13 LYS HGx 1.0 1.8 3.4 388 282 A 14 ASN H A 13 LYS HBx 1.0 1.8 5.0 389 283 A 13 LYS HBy A 13 LYS HGy 1.0 1.8 3.4 390 283 A 13 LYS HBy A 13 LYS HGx 1.0 1.8 3.4 391 284 A 14 ASN H A 13 LYS HBy 1.0 1.8 5.0 392 285 A 13 LYS HD2 A 13 LYS HBx 1.0 1.8 4.4 393 285 A 13 LYS HD2 A 13 LYS HBy 1.0 1.8 4.4 394 286 A 13 LYS H A 13 LYS HBx 1.0 1.8 6.0 395 286 A 13 LYS H A 13 LYS HBy 1.0 1.8 6.0 396 287 A 10 GLU HA A 13 LYS HBy 1.0 1.8 5.0 397 288 A 13 LYS HD2 A 13 LYS HBx 1.0 1.8 5.0 398 289 A 13 LYS HD2 A 13 LYS HBy 1.0 1.8 5.0 399 290 A 13 LYS HD2 A 13 LYS HGx 1.0 1.8 3.4 400 291 A 13 LYS HD2 A 13 LYS HGy 1.0 1.8 3.4 401 292 A 13 LYS HD2 A 13 LYS H 1.0 1.8 5.0 402 293 A 13 LYS HD2 A 14 ASN H 1.0 1.8 5.0 403 294 A 13 LYS HA A 13 LYS HGx 1.0 1.8 5.0 404 295 A 13 LYS HBy A 13 LYS HGx 1.0 1.8 2.8 405 295 A 13 LYS HBx A 13 LYS HGx 1.0 1.8 2.8 406 296 A 13 LYS HGy A 13 LYS HGx 1.0 1.8 3.4 407 297 A 13 LYS H A 13 LYS HGx 1.0 1.8 5.0 408 298 A 13 LYS HA A 13 LYS HGy 1.0 1.8 5.0 409 299 A 13 LYS HGy A 13 LYS HBx 1.0 1.8 2.8 410 299 A 13 LYS HBy A 13 LYS HGy 1.0 1.8 2.8 411 300 A 13 LYS HGy A 13 LYS HGx 1.0 1.8 3.4 412 301 A 13 LYS H A 13 LYS HGy 1.0 1.8 5.0 413 302 A 13 LYS HGy A 13 LYS HBx 1.0 1.8 3.8 414 302 A 13 LYS HBx A 13 LYS HGx 1.0 1.8 3.8 415 303 A 13 LYS HD2 A 13 LYS HGx 1.0 1.8 4.4 416 303 A 13 LYS HD2 A 13 LYS HGy 1.0 1.8 4.4 417 304 A 20 ALA HB% A 13 LYS HGx 1.0 1.8 7.0 418 304 A 13 LYS HGy A 20 ALA HB% 1.0 1.8 7.0 419 305 A 13 LYS HGx A 23 VAL HG1% 1.0 1.8 8.0 420 305 A 13 LYS HGy A 23 VAL HG1% 1.0 1.8 8.0 421 305 A 23 VAL HG2% A 13 LYS HGx 1.0 1.8 8.0 422 305 A 13 LYS HGy A 23 VAL HG2% 1.0 1.8 8.0 423 306 A 11 VAL H A 13 LYS H 1.0 1.8 5.0 424 307 A 13 LYS H A 12 VAL HA 1.0 1.8 5.0 425 308 A 13 LYS H A 12 VAL HG1% 1.0 1.8 6.0 426 308 A 13 LYS H A 12 VAL HG2% 1.0 1.8 6.0 427 309 A 12 VAL H A 13 LYS H 1.0 1.8 5.0 428 310 A 13 LYS HA A 13 LYS H 1.0 1.8 2.8 429 311 A 13 LYS H A 13 LYS HBx 1.0 1.8 5.0 430 312 A 13 LYS H A 13 LYS HBy 1.0 1.8 5.0 431 313 A 13 LYS HD2 A 13 LYS H 1.0 1.8 5.0 432 314 A 13 LYS H A 13 LYS HEx 1.0 1.8 5.0 433 315 A 13 LYS H A 13 LYS HGx 1.0 1.8 6.0 434 315 A 13 LYS H A 13 LYS HGy 1.0 1.8 6.0 435 316 A 13 LYS H A 14 ASN HD21 1.0 1.8 5.0 436 317 A 13 LYS H A 14 ASN H 1.0 1.8 5.0 437 318 A 9 LEU HA A 13 LYS H 1.0 1.8 5.0 438 319 A 13 LYS HA A 14 ASN HA 1.0 1.8 5.0 439 320 A 14 ASN HA A 13 LYS HBx 1.0 1.8 6.0 440 320 A 13 LYS HBy A 14 ASN HA 1.0 1.8 6.0 441 321 A 14 ASN HA A 14 ASN HBx 1.0 1.8 5.0 442 322 A 14 ASN HBy A 14 ASN HA 1.0 1.8 5.0 443 323 A 14 ASN HD22 A 14 ASN HA 1.0 1.8 5.0 444 324 A 14 ASN H A 14 ASN HA 1.0 1.8 2.8 445 325 A 15 PHE H A 14 ASN HA 1.0 1.8 3.4 446 326 A 14 ASN HA A 14 ASN HBx 1.0 1.8 2.8 447 327 A 14 ASN HD21 A 14 ASN HBx 1.0 1.8 3.4 448 328 A 14 ASN HD22 A 14 ASN HBx 1.0 1.8 5.0 449 329 A 14 ASN H A 14 ASN HBx 1.0 1.8 5.0 450 330 A 15 PHE HA A 14 ASN HBx 1.0 1.8 5.0 451 331 A 14 ASN HBy A 14 ASN HA 1.0 1.8 5.0 452 332 A 14 ASN HD21 A 14 ASN HBy 1.0 1.8 5.0 453 333 A 14 ASN HD22 A 14 ASN HBy 1.0 1.8 5.0 454 334 A 14 ASN H A 14 ASN HBy 1.0 1.8 5.0 455 335 A 14 ASN HBy A 15 PHE HA 1.0 1.8 5.0 456 336 A 11 VAL HA A 14 ASN HBx 1.0 1.8 6.0 457 336 A 11 VAL HA A 14 ASN HBy 1.0 1.8 6.0 458 337 A 14 ASN HD21 A 10 GLU HG3 1.0 1.8 6.0 459 337 A 10 GLU HG2 A 14 ASN HD21 1.0 1.8 6.0 460 338 A 14 ASN HD21 A 14 ASN HA 1.0 1.8 5.0 461 339 A 14 ASN HD21 A 14 ASN HBx 1.0 1.8 5.0 462 340 A 14 ASN HD21 A 14 ASN HBy 1.0 1.8 3.4 463 341 A 14 ASN H A 14 ASN HD21 1.0 1.8 5.0 464 342 A 14 ASN HD22 A 10 GLU HB3 1.0 1.8 6.0 465 342 A 10 GLU HB2 A 14 ASN HD22 1.0 1.8 6.0 466 343 A 14 ASN HD22 A 14 ASN HA 1.0 1.8 5.0 467 344 A 14 ASN HD22 A 14 ASN HBx 1.0 1.8 5.0 468 345 A 14 ASN HD22 A 14 ASN HBy 1.0 1.8 5.0 469 346 A 14 ASN H A 14 ASN HD22 1.0 1.8 5.0 470 347 A 14 ASN HD22 A 10 GLU HG3 1.0 1.8 5.0 471 347 A 10 GLU HG2 A 14 ASN HD22 1.0 1.8 5.0 472 348 A 10 GLU HA A 14 ASN H 1.0 1.8 5.0 473 349 A 14 ASN H A 10 GLU HB3 1.0 1.8 6.0 474 349 A 10 GLU HB2 A 14 ASN H 1.0 1.8 6.0 475 350 A 14 ASN H A 10 GLU HG3 1.0 1.8 6.0 476 350 A 10 GLU HG2 A 14 ASN H 1.0 1.8 6.0 477 351 A 14 ASN H A 11 VAL HG1% 1.0 1.8 7.0 478 351 A 14 ASN H A 11 VAL HG2% 1.0 1.8 7.0 479 352 A 13 LYS HA A 14 ASN H 1.0 1.8 5.0 480 353 A 14 ASN H A 13 LYS HBx 1.0 1.8 6.0 481 353 A 14 ASN H A 13 LYS HBy 1.0 1.8 6.0 482 354 A 13 LYS HD2 A 14 ASN H 1.0 1.8 5.0 483 355 A 13 LYS H A 14 ASN H 1.0 1.8 5.0 484 356 A 14 ASN H A 14 ASN HA 1.0 1.8 2.8 485 357 A 14 ASN H A 14 ASN HBx 1.0 1.8 5.0 486 358 A 14 ASN H A 14 ASN HBy 1.0 1.8 5.0 487 359 A 14 ASN H A 14 ASN HD21 1.0 1.8 5.0 488 360 A 14 ASN H A 14 ASN HD22 1.0 1.8 5.0 489 361 A 14 ASN H A 15 PHE HBy 1.0 1.8 5.0 490 362 A 14 ASN H A 15 PHE H 1.0 1.8 5.0 491 363 A 15 PHE HA A 14 ASN HBx 1.0 1.8 5.0 492 364 A 14 ASN HBy A 15 PHE HA 1.0 1.8 5.0 493 365 A 15 PHE HA A 15 PHE HBx 1.0 1.8 5.0 494 366 A 15 PHE HA A 15 PHE HD1 1.0 1.8 6.0 495 366 A 15 PHE HA A 15 PHE HDy 1.0 1.8 6.0 496 367 A 15 PHE HA A 15 PHE HE% 1.0 1.8 6.0 497 368 A 15 PHE H A 15 PHE HA 1.0 1.8 2.8 498 369 A 15 PHE HA A 16 GLU HBx 1.0 1.8 5.0 499 370 A 15 PHE HA A 16 GLU HGx 1.0 1.8 7.0 500 370 A 15 PHE HA A 16 GLU HGy 1.0 1.8 7.0 501 371 A 15 PHE HA A 16 GLU H 1.0 1.8 3.4 502 372 A 12 VAL HA A 15 PHE HBx 1.0 1.8 5.0 503 373 A 15 PHE HA A 15 PHE HBx 1.0 1.8 5.0 504 374 A 15 PHE HD1 A 15 PHE HBx 1.0 1.8 5.0 505 375 A 15 PHE H A 15 PHE HBx 1.0 1.8 5.0 506 376 A 16 GLU H A 15 PHE HBx 1.0 1.8 5.0 507 377 A 14 ASN H A 15 PHE HBy 1.0 1.8 5.0 508 378 A 15 PHE HBy A 15 PHE HA 1.0 1.8 5.0 509 379 A 15 PHE HBy A 15 PHE HD1 1.0 1.8 3.4 510 380 A 15 PHE HBy A 15 PHE H 1.0 1.8 5.0 511 381 A 15 PHE HBy A 16 GLU H 1.0 1.8 5.0 512 382 A 11 VAL HG2% A 15 PHE HDy 1.0 1.8 7.0 513 382 A 11 VAL HG2% A 15 PHE HD1 1.0 1.8 7.0 514 382 A 15 PHE HD1 A 11 VAL HG1% 1.0 1.8 7.0 515 382 A 11 VAL HG1% A 15 PHE HDy 1.0 1.8 7.0 516 383 A 14 ASN H A 15 PHE HD1 1.0 1.8 6.0 517 383 A 14 ASN H A 15 PHE HDy 1.0 1.8 6.0 518 384 A 15 PHE HA A 15 PHE HD1 1.0 1.8 4.4 519 384 A 15 PHE HA A 15 PHE HDy 1.0 1.8 4.4 520 385 A 15 PHE HD1 A 15 PHE HBx 1.0 1.8 5.4 521 385 A 15 PHE HBx A 15 PHE HDy 1.0 1.8 5.4 522 385 A 15 PHE HBy A 15 PHE HD1 1.0 1.8 5.4 523 385 A 15 PHE HBy A 15 PHE HDy 1.0 1.8 5.4 524 386 A 15 PHE H A 15 PHE HD1 1.0 1.8 6.0 525 386 A 15 PHE H A 15 PHE HDy 1.0 1.8 6.0 526 387 A 16 GLU H A 15 PHE HD1 1.0 1.8 6.0 527 387 A 16 GLU H A 15 PHE HDy 1.0 1.8 6.0 528 388 A 15 PHE HD1 A 43 VAL HG1% 1.0 1.8 7.0 529 388 A 43 VAL HG2% A 15 PHE HD1 1.0 1.8 7.0 530 388 A 43 VAL HG2% A 15 PHE HDy 1.0 1.8 7.0 531 388 A 15 PHE HDy A 43 VAL HG1% 1.0 1.8 7.0 532 389 A 15 PHE HA A 15 PHE HE% 1.0 1.8 6.0 533 390 A 15 PHE HE% A 15 PHE HBx 1.0 1.8 6.0 534 391 A 15 PHE HE% A 42 GLU HBx 1.0 1.8 9.0 535 391 A 15 PHE HE% A 42 GLU HBy 1.0 1.8 9.0 536 392 A 15 PHE HE% A 43 VAL HG1% 1.0 1.8 8.0 537 392 A 43 VAL HG2% A 15 PHE HE% 1.0 1.8 8.0 538 393 A 11 VAL HA A 15 PHE H 1.0 1.8 5.0 539 394 A 15 PHE H A 11 VAL HG1% 1.0 1.8 6.0 540 394 A 11 VAL HG2% A 15 PHE H 1.0 1.8 6.0 541 395 A 15 PHE H A 14 ASN HA 1.0 1.8 5.0 542 396 A 15 PHE H A 14 ASN HBx 1.0 1.8 5.0 543 397 A 14 ASN HBy A 15 PHE H 1.0 1.8 5.0 544 398 A 14 ASN H A 15 PHE H 1.0 1.8 5.0 545 399 A 15 PHE H A 15 PHE HA 1.0 1.8 2.8 546 400 A 15 PHE H A 15 PHE HBx 1.0 1.8 5.0 547 401 A 15 PHE HBy A 15 PHE H 1.0 1.8 5.0 548 402 A 15 PHE H A 15 PHE HD1 1.0 1.8 6.0 549 402 A 15 PHE H A 15 PHE HDy 1.0 1.8 6.0 550 403 A 15 PHE H A 16 GLU H 1.0 1.8 5.0 551 404 A 15 PHE H A 43 VAL HG1% 1.0 1.8 8.0 552 405 A 16 GLU HBx A 16 GLU HA 1.0 1.8 5.0 553 406 A 16 GLU HA A 16 GLU HGx 1.0 1.8 5.0 554 407 A 16 GLU HGy A 16 GLU HA 1.0 1.8 5.0 555 408 A 16 GLU H A 16 GLU HA 1.0 1.8 2.8 556 409 A 16 GLU HA A 17 LYS H 1.0 1.8 5.0 557 410 A 15 PHE HA A 16 GLU HBx 1.0 1.8 5.0 558 411 A 16 GLU HBx A 16 GLU HGx 1.0 1.8 4.4 559 411 A 16 GLU HBx A 16 GLU HGy 1.0 1.8 4.4 560 412 A 16 GLU HBx A 16 GLU H 1.0 1.8 5.0 561 413 A 16 GLU HBx A 17 LYS H 1.0 1.8 5.0 562 414 A 16 GLU HBy A 16 GLU HGx 1.0 1.8 4.4 563 414 A 16 GLU HGy A 16 GLU HBy 1.0 1.8 4.4 564 415 A 16 GLU H A 16 GLU HBy 1.0 1.8 5.0 565 416 A 17 LYS H A 16 GLU HBy 1.0 1.8 5.0 566 417 A 16 GLU HBx A 16 GLU HGx 1.0 1.8 2.8 567 418 A 16 GLU HBy A 16 GLU HGx 1.0 1.8 2.8 568 419 A 16 GLU H A 16 GLU HGx 1.0 1.8 5.0 569 420 A 17 LYS HDy A 16 GLU HGx 1.0 1.8 5.0 570 421 A 17 LYS H A 16 GLU HGx 1.0 1.8 5.0 571 422 A 16 GLU HBx A 16 GLU HGy 1.0 1.8 2.8 572 423 A 16 GLU HGy A 16 GLU HBy 1.0 1.8 2.8 573 424 A 16 GLU HGy A 16 GLU H 1.0 1.8 5.0 574 425 A 16 GLU HGy A 17 LYS HDy 1.0 1.8 5.0 575 426 A 16 GLU HGy A 17 LYS H 1.0 1.8 5.0 576 427 A 16 GLU HA A 16 GLU HGx 1.0 1.8 6.0 577 427 A 16 GLU HGy A 16 GLU HA 1.0 1.8 6.0 578 428 A 15 PHE HA A 16 GLU H 1.0 1.8 6.0 579 429 A 16 GLU H A 15 PHE HBx 1.0 1.8 6.0 580 429 A 15 PHE HBy A 16 GLU H 1.0 1.8 6.0 581 430 A 16 GLU H A 15 PHE HD1 1.0 1.8 6.0 582 430 A 16 GLU H A 15 PHE HDy 1.0 1.8 6.0 583 431 A 15 PHE H A 16 GLU H 1.0 1.8 5.0 584 432 A 16 GLU H A 16 GLU HA 1.0 1.8 2.8 585 433 A 16 GLU HBx A 16 GLU H 1.0 1.8 5.0 586 434 A 16 GLU H A 16 GLU HBy 1.0 1.8 5.0 587 435 A 16 GLU H A 16 GLU HGx 1.0 1.8 6.0 588 435 A 16 GLU HGy A 16 GLU H 1.0 1.8 6.0 589 436 A 16 GLU H A 17 LYS H 1.0 1.8 5.0 590 437 A 17 LYS HA A 17 LYS HBx 1.0 1.8 5.0 591 438 A 17 LYS HA A 17 LYS HBy 1.0 1.8 5.0 592 439 A 17 LYS HA A 17 LYS HDx 1.0 1.8 6.0 593 439 A 17 LYS HA A 17 LYS HDy 1.0 1.8 6.0 594 440 A 17 LYS HA A 17 LYS HG3 1.0 1.8 6.0 595 440 A 17 LYS HA A 17 LYS HGx 1.0 1.8 6.0 596 441 A 17 LYS H A 17 LYS HA 1.0 1.8 2.8 597 442 A 17 LYS HA A 18 VAL H 1.0 1.8 3.4 598 443 A 17 LYS HA A 17 LYS HBx 1.0 1.8 2.8 599 444 A 17 LYS HDy A 17 LYS HBx 1.0 1.8 5.0 600 445 A 17 LYS HE2 A 17 LYS HBx 1.0 1.8 5.0 601 446 A 17 LYS HGx A 17 LYS HBx 1.0 1.8 4.4 602 446 A 17 LYS HBx A 17 LYS HG3 1.0 1.8 4.4 603 447 A 17 LYS H A 17 LYS HBx 1.0 1.8 5.0 604 448 A 18 VAL H A 17 LYS HBx 1.0 1.8 5.0 605 449 A 17 LYS HA A 17 LYS HBy 1.0 1.8 5.0 606 450 A 17 LYS HDy A 17 LYS HBy 1.0 1.8 3.4 607 451 A 17 LYS HE2 A 17 LYS HBy 1.0 1.8 3.4 608 452 A 17 LYS H A 17 LYS HBy 1.0 1.8 5.0 609 453 A 18 VAL H A 17 LYS HBy 1.0 1.8 5.0 610 454 A 17 LYS HBy A 18 VAL HG1% 1.0 1.8 7.0 611 454 A 18 VAL HG2% A 17 LYS HBx 1.0 1.8 7.0 612 454 A 17 LYS HBy A 18 VAL HG2% 1.0 1.8 7.0 613 454 A 17 LYS HBx A 18 VAL HG1% 1.0 1.8 7.0 614 455 A 17 LYS HA A 17 LYS HDx 1.0 1.8 5.0 615 456 A 17 LYS HBx A 17 LYS HDx 1.0 1.8 5.0 616 457 A 17 LYS HBy A 17 LYS HDx 1.0 1.8 5.0 617 458 A 17 LYS HEy A 17 LYS HDx 1.0 1.8 3.4 618 459 A 17 LYS HGx A 17 LYS HDx 1.0 1.8 4.4 619 459 A 17 LYS HDx A 17 LYS HG3 1.0 1.8 4.4 620 460 A 17 LYS H A 17 LYS HDx 1.0 1.8 5.0 621 461 A 17 LYS HDy A 17 LYS HG3 1.0 1.8 3.4 622 462 A 17 LYS HDy A 17 LYS HGx 1.0 1.8 3.4 623 463 A 17 LYS HA A 17 LYS HG3 1.0 1.8 6.0 624 463 A 17 LYS HA A 17 LYS HGx 1.0 1.8 6.0 625 464 A 17 LYS HGx A 17 LYS HBx 1.0 1.8 3.8 626 464 A 17 LYS HBx A 17 LYS HG3 1.0 1.8 3.8 627 465 A 17 LYS HGx A 17 LYS HBy 1.0 1.8 3.8 628 465 A 17 LYS HBy A 17 LYS HG3 1.0 1.8 3.8 629 466 A 17 LYS H A 17 LYS HG3 1.0 1.8 6.0 630 466 A 17 LYS H A 17 LYS HGx 1.0 1.8 6.0 631 467 A 16 GLU HA A 17 LYS H 1.0 1.8 5.0 632 468 A 17 LYS H A 16 GLU HGx 1.0 1.8 6.0 633 468 A 16 GLU HGy A 17 LYS H 1.0 1.8 6.0 634 469 A 16 GLU H A 17 LYS H 1.0 1.8 5.0 635 470 A 17 LYS H A 17 LYS HA 1.0 1.8 2.8 636 471 A 15 PHE HA A 17 LYS H 1.0 1.8 6.0 637 472 A 17 LYS H A 17 LYS HBx 1.0 1.8 5.0 638 473 A 17 LYS H A 17 LYS HBy 1.0 1.8 5.0 639 474 A 17 LYS H A 17 LYS HG3 1.0 1.8 5.0 640 475 A 17 LYS H A 17 LYS HGx 1.0 1.8 5.0 641 476 A 17 LYS H A 18 VAL H 1.0 1.8 5.0 642 477 A 18 VAL HB A 17 LYS HBx 1.0 1.8 6.0 643 477 A 17 LYS HBy A 18 VAL HB 1.0 1.8 6.0 644 478 A 18 VAL HB A 18 VAL HA 1.0 1.8 2.8 645 479 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 5.0 646 480 A 18 VAL HG2% A 18 VAL HB 1.0 1.8 5.0 647 481 A 18 VAL H A 18 VAL HB 1.0 1.8 5.0 648 482 A 18 VAL HB A 19 ASP H 1.0 1.8 5.0 649 483 A 18 VAL HA A 18 VAL HG1% 1.0 1.8 5.0 650 484 A 18 VAL HB A 18 VAL HG1% 1.0 1.8 2.8 651 485 A 18 VAL HG2% A 18 VAL HG1% 1.0 1.8 5.0 652 486 A 18 VAL H A 18 VAL HG1% 1.0 1.8 5.0 653 487 A 19 ASP H A 18 VAL HG1% 1.0 1.8 5.0 654 488 A 33 LEU HD1% A 18 VAL HG1% 1.0 1.8 7.0 655 489 A 18 VAL HG2% A 18 VAL HA 1.0 1.8 5.0 656 490 A 18 VAL HG2% A 18 VAL HB 1.0 1.8 2.8 657 491 A 18 VAL HG2% A 18 VAL HG1% 1.0 1.8 5.0 658 492 A 18 VAL H A 18 VAL HG2% 1.0 1.8 5.0 659 493 A 18 VAL HG2% A 19 ASP H 1.0 1.8 5.0 660 494 A 17 LYS HBy A 18 VAL HG1% 1.0 1.8 7.0 661 494 A 18 VAL HG2% A 17 LYS HBx 1.0 1.8 7.0 662 494 A 17 LYS HBy A 18 VAL HG2% 1.0 1.8 7.0 663 494 A 17 LYS HBx A 18 VAL HG1% 1.0 1.8 7.0 664 495 A 18 VAL H A 15 PHE HBx 1.0 1.8 6.0 665 495 A 15 PHE HBy A 18 VAL H 1.0 1.8 6.0 666 496 A 17 LYS HA A 18 VAL H 1.0 1.8 5.0 667 497 A 18 VAL H A 17 LYS HBx 1.0 1.8 5.0 668 498 A 18 VAL H A 17 LYS HBy 1.0 1.8 5.0 669 499 A 18 VAL H A 17 LYS HDx 1.0 1.8 6.0 670 499 A 17 LYS HDy A 18 VAL H 1.0 1.8 6.0 671 500 A 17 LYS H A 18 VAL H 1.0 1.8 5.0 672 501 A 18 VAL H A 18 VAL HA 1.0 1.8 2.8 673 502 A 18 VAL H A 18 VAL HB 1.0 1.8 5.0 674 503 A 18 VAL H A 18 VAL HG1% 1.0 1.8 5.0 675 504 A 18 VAL H A 18 VAL HG2% 1.0 1.8 5.0 676 505 A 18 VAL H A 19 ASP H 1.0 1.8 5.0 677 506 A 19 ASP HA A 19 ASP HBx 1.0 1.8 5.0 678 507 A 19 ASP HA A 19 ASP HBy 1.0 1.8 5.0 679 508 A 19 ASP H A 19 ASP HA 1.0 1.8 2.8 680 509 A 19 ASP HA A 20 ALA H 1.0 1.8 3.4 681 510 A 19 ASP HA A 21 SER H 1.0 1.8 5.0 682 511 A 19 ASP HA A 22 LYS H 1.0 1.8 5.0 683 512 A 19 ASP HA A 19 ASP HBx 1.0 1.8 5.0 684 513 A 19 ASP H A 19 ASP HBx 1.0 1.8 5.0 685 514 A 20 ALA H A 19 ASP HBx 1.0 1.8 5.0 686 515 A 19 ASP HA A 19 ASP HBy 1.0 1.8 5.0 687 516 A 19 ASP H A 19 ASP HBy 1.0 1.8 5.0 688 517 A 20 ALA H A 19 ASP HBy 1.0 1.8 5.0 689 518 A 21 SER H A 19 ASP HBy 1.0 1.8 6.0 690 518 A 21 SER H A 19 ASP HBx 1.0 1.8 6.0 691 519 A 19 ASP HBy A 22 LYS HGx 1.0 1.8 7.0 692 519 A 19 ASP HBx A 22 LYS HGx 1.0 1.8 7.0 693 519 A 22 LYS HGy A 19 ASP HBy 1.0 1.8 7.0 694 519 A 19 ASP HBx A 22 LYS HGy 1.0 1.8 7.0 695 520 A 18 VAL HA A 19 ASP H 1.0 1.8 5.0 696 521 A 18 VAL HB A 19 ASP H 1.0 1.8 5.0 697 522 A 19 ASP H A 18 VAL HG1% 1.0 1.8 5.0 698 523 A 18 VAL HG2% A 19 ASP H 1.0 1.8 5.0 699 524 A 18 VAL H A 19 ASP H 1.0 1.8 5.0 700 525 A 19 ASP H A 19 ASP HA 1.0 1.8 2.8 701 526 A 19 ASP H A 19 ASP HBx 1.0 1.8 5.0 702 527 A 19 ASP H A 19 ASP HBy 1.0 1.8 5.0 703 528 A 19 ASP H A 20 ALA H 1.0 1.8 5.0 704 529 A 19 ASP H A 22 LYS HBy 1.0 1.8 6.0 705 529 A 19 ASP H A 22 LYS HB2 1.0 1.8 6.0 706 530 A 19 ASP H A 22 LYS HD2 1.0 1.8 5.0 707 531 A 20 ALA HB% A 20 ALA HA 1.0 1.8 5.0 708 532 A 20 ALA H A 20 ALA HA 1.0 1.8 2.8 709 533 A 21 SER H A 20 ALA HA 1.0 1.8 3.4 710 534 A 22 LYS HD2 A 20 ALA HA 1.0 1.8 5.0 711 535 A 20 ALA HA A 23 VAL H 1.0 1.8 5.0 712 536 A 20 ALA HB% A 13 LYS HEx 1.0 1.8 7.0 713 536 A 20 ALA HB% A 13 LYS HEy 1.0 1.8 7.0 714 537 A 20 ALA HB% A 20 ALA HA 1.0 1.8 5.0 715 538 A 20 ALA HB% A 20 ALA H 1.0 1.8 5.0 716 539 A 20 ALA HB% A 21 SER H 1.0 1.8 5.0 717 540 A 20 ALA HB% A 22 LYS H 1.0 1.8 5.0 718 541 A 19 ASP HA A 20 ALA H 1.0 1.8 5.0 719 542 A 20 ALA H A 19 ASP HBx 1.0 1.8 5.0 720 543 A 20 ALA H A 19 ASP HBy 1.0 1.8 5.0 721 544 A 19 ASP H A 20 ALA H 1.0 1.8 5.0 722 545 A 20 ALA H A 20 ALA HA 1.0 1.8 2.8 723 546 A 20 ALA HB% A 20 ALA H 1.0 1.8 5.0 724 547 A 20 ALA H A 21 SER H 1.0 1.8 5.0 725 548 A 20 ALA H A 22 LYS H 1.0 1.8 5.0 726 549 A 21 SER HA A 21 SER HBy 1.0 1.8 5.0 727 550 A 21 SER H A 21 SER HA 1.0 1.2 2.8 728 551 A 22 LYS H A 21 SER HA 1.0 1.8 3.4 729 552 A 21 SER HA A 23 VAL HG1% 1.0 1.8 6.0 730 552 A 23 VAL HG2% A 21 SER HA 1.0 1.8 6.0 731 553 A 23 VAL H A 21 SER HA 1.0 1.8 5.0 732 554 A 21 SER HA A 21 SER HBy 1.0 1.8 5.0 733 555 A 21 SER H A 21 SER HBy 1.0 1.8 6.0 734 555 A 21 SER H A 21 SER HB2 1.0 1.8 6.0 735 556 A 19 ASP HA A 21 SER H 1.0 1.8 5.0 736 557 A 21 SER H A 19 ASP HBx 1.0 1.8 5.0 737 558 A 21 SER H A 19 ASP HBy 1.0 1.8 5.0 738 559 A 20 ALA HB% A 21 SER H 1.0 1.8 5.0 739 560 A 20 ALA H A 21 SER H 1.0 1.8 3.4 740 561 A 21 SER H A 21 SER HA 1.0 1.8 2.8 741 562 A 21 SER H A 21 SER HBy 1.0 1.8 6.0 742 562 A 21 SER H A 21 SER HB2 1.0 1.8 6.0 743 563 A 21 SER H A 22 LYS HBy 1.0 1.8 6.0 744 563 A 21 SER H A 22 LYS HB2 1.0 1.8 6.0 745 564 A 21 SER H A 22 LYS H 1.0 1.8 3.4 746 565 A 21 SER H A 23 VAL H 1.0 1.8 5.0 747 566 A 22 LYS HA A 22 LYS HBy 1.0 1.8 5.0 748 567 A 22 LYS HA A 22 LYS HE2 1.0 1.8 5.0 749 568 A 22 LYS HA A 22 LYS HGx 1.0 1.8 5.0 750 569 A 22 LYS HGy A 22 LYS HA 1.0 1.8 5.0 751 570 A 23 VAL H A 22 LYS HA 1.0 1.8 3.4 752 571 A 22 LYS HGy A 22 LYS HBy 1.0 1.8 4.4 753 571 A 22 LYS HBy A 22 LYS HGx 1.0 1.8 4.4 754 572 A 23 VAL H A 22 LYS HBy 1.0 1.8 5.0 755 573 A 22 LYS HB2 A 23 VAL H 1.0 1.8 5.0 756 574 A 22 LYS HBy A 22 LYS HE2 1.0 1.8 4.4 757 574 A 22 LYS HB2 A 22 LYS HE2 1.0 1.8 4.4 758 575 A 22 LYS HB2 A 23 VAL HG1% 1.0 1.8 7.0 759 575 A 22 LYS HBy A 23 VAL HG1% 1.0 1.8 7.0 760 575 A 23 VAL HG2% A 22 LYS HBy 1.0 1.8 7.0 761 575 A 23 VAL HG2% A 22 LYS HB2 1.0 1.8 7.0 762 576 A 22 LYS HB2 A 33 LEU HBy 1.0 1.8 7.0 763 576 A 22 LYS HBy A 33 LEU HBy 1.0 1.8 7.0 764 576 A 33 LEU HBx A 22 LYS HBy 1.0 1.8 7.0 765 576 A 22 LYS HB2 A 33 LEU HBx 1.0 1.8 7.0 766 577 A 22 LYS HE2 A 22 LYS HGx 1.0 1.8 5.0 767 578 A 22 LYS HGy A 22 LYS HE2 1.0 1.8 5.0 768 579 A 33 LEU HBx A 22 LYS HE2 1.0 1.8 6.0 769 579 A 22 LYS HE2 A 33 LEU HBy 1.0 1.8 6.0 770 580 A 33 LEU HBx A 22 LYS HE2 1.0 1.8 6.0 771 580 A 22 LYS HE2 A 33 LEU HBy 1.0 1.8 6.0 772 581 A 22 LYS HGy A 22 LYS HGx 1.0 1.2 2.8 773 582 A 22 LYS HGy A 22 LYS HGx 1.0 1.2 2.8 774 583 A 19 ASP HBx A 22 LYS HGy 1.0 1.8 6.0 775 583 A 19 ASP HBx A 22 LYS HGx 1.0 1.8 6.0 776 584 A 22 LYS HGy A 19 ASP HBy 1.0 1.8 6.0 777 584 A 19 ASP HBy A 22 LYS HGx 1.0 1.8 6.0 778 585 A 22 LYS HGy A 22 LYS HBy 1.0 1.8 3.8 779 585 A 22 LYS HBy A 22 LYS HGx 1.0 1.8 3.8 780 586 A 22 LYS HGy A 22 LYS HB2 1.0 1.8 3.8 781 586 A 22 LYS HB2 A 22 LYS HGx 1.0 1.8 3.8 782 587 A 22 LYS HGy A 22 LYS HE2 1.0 1.8 3.8 783 587 A 22 LYS HE2 A 22 LYS HGx 1.0 1.8 3.8 784 588 A 23 VAL H A 22 LYS HGx 1.0 1.8 6.0 785 588 A 22 LYS HGy A 23 VAL H 1.0 1.8 6.0 786 589 A 20 ALA H A 22 LYS H 1.0 1.8 5.0 787 590 A 22 LYS H A 21 SER HBy 1.0 1.8 6.0 788 590 A 22 LYS H A 21 SER HB2 1.0 1.8 6.0 789 591 A 21 SER H A 22 LYS H 1.0 1.8 5.0 790 592 A 22 LYS H A 22 LYS HA 1.0 1.8 2.8 791 593 A 22 LYS H A 22 LYS HBy 1.0 1.8 6.0 792 593 A 22 LYS H A 22 LYS HB2 1.0 1.8 6.0 793 594 A 22 LYS H A 22 LYS HDy 1.0 1.8 5.0 794 595 A 22 LYS H A 22 LYS HD2 1.0 1.8 5.0 795 596 A 22 LYS H A 22 LYS HGx 1.0 1.8 5.0 796 597 A 22 LYS H A 22 LYS HGy 1.0 1.8 5.0 797 598 A 23 VAL HA A 22 LYS HBy 1.0 1.8 6.0 798 598 A 22 LYS HB2 A 23 VAL HA 1.0 1.8 6.0 799 599 A 23 VAL HA A 23 VAL HB 1.0 1.8 5.0 800 600 A 23 VAL HA A 23 VAL HG1% 1.0 1.8 6.0 801 600 A 23 VAL HG2% A 23 VAL HA 1.0 1.8 6.0 802 601 A 23 VAL H A 23 VAL HA 1.0 1.8 2.8 803 602 A 23 VAL HA A 24 THR HA 1.0 1.8 5.0 804 603 A 23 VAL HA A 24 THR HB 1.0 1.8 5.0 805 604 A 23 VAL HA A 24 THR H 1.0 1.8 3.4 806 605 A 23 VAL HB A 23 VAL HG1% 1.0 1.8 3.4 807 606 A 23 VAL H A 23 VAL HB 1.0 1.8 5.0 808 607 A 23 VAL H A 23 VAL HG1% 1.0 1.8 5.0 809 608 A 9 LEU HD1% A 23 VAL HG1% 1.0 1.8 7.0 810 608 A 9 LEU HD1% A 23 VAL HG2% 1.0 1.8 7.0 811 609 A 21 SER H A 23 VAL H 1.0 1.8 5.0 812 610 A 20 ALA H A 23 VAL H 1.0 2.8 6.0 813 611 A 23 VAL H A 22 LYS HA 1.0 1.8 3.4 814 612 A 23 VAL H A 22 LYS HE2 1.0 1.8 6.0 815 612 A 23 VAL H A 22 LYS HEy 1.0 1.8 6.0 816 613 A 22 LYS H A 23 VAL H 1.0 1.8 3.4 817 614 A 23 VAL H A 23 VAL HB 1.0 1.8 5.0 818 615 A 23 VAL H A 23 VAL HG1% 1.0 1.8 5.0 819 616 A 23 VAL HG2% A 23 VAL H 1.0 1.8 5.0 820 617 A 23 VAL H A 24 THR H 1.0 1.8 5.0 821 618 A 23 VAL HA A 24 THR HA 1.0 1.8 5.0 822 619 A 24 THR HA A 24 THR HB 1.0 1.8 5.0 823 620 A 24 THR HA A 24 THR HG1 1.0 1.8 3.4 824 621 A 24 THR HA A 24 THR H 1.0 1.8 2.8 825 622 A 23 VAL HA A 24 THR HB 1.0 1.8 5.0 826 623 A 24 THR HA A 24 THR HB 1.0 1.8 2.8 827 624 A 24 THR HB A 24 THR HG1 1.0 1.8 2.8 828 625 A 24 THR HB A 24 THR H 1.0 1.8 5.0 829 626 A 24 THR HB A 26 GLU H 1.0 1.8 5.0 830 627 A 24 THR H A 23 VAL HG1% 1.0 1.8 6.0 831 627 A 23 VAL HG2% A 24 THR H 1.0 1.8 6.0 832 628 A 23 VAL H A 24 THR H 1.0 1.8 5.0 833 629 A 24 THR HA A 24 THR H 1.0 1.8 2.8 834 630 A 24 THR HB A 24 THR H 1.0 1.8 5.0 835 631 A 24 THR H A 24 THR HG2% 1.0 1.8 6.0 836 632 A 24 THR H A 26 GLU H 1.0 1.8 5.0 837 633 A 24 THR H A 27 SER H 1.0 1.8 5.0 838 634 A 24 THR HA A 25 PRO HA 1.0 1.8 5.0 839 635 A 25 PRO HA A 26 GLU HBy 1.0 1.8 6.0 840 635 A 25 PRO HA A 26 GLU HBx 1.0 1.8 6.0 841 636 A 26 GLU H A 25 PRO HA 1.0 1.8 5.0 842 637 A 27 SER H A 25 PRO HBy 1.0 1.8 5.0 843 638 A 26 GLU HA A 25 PRO HBx 1.0 1.8 6.0 844 638 A 25 PRO HBy A 26 GLU HA 1.0 1.8 6.0 845 639 A 25 PRO HBy A 26 GLU HA 1.0 1.8 5.0 846 640 A 26 GLU HA A 26 GLU HBy 1.0 1.8 5.0 847 641 A 26 GLU HBx A 26 GLU HA 1.0 1.8 5.0 848 642 A 26 GLU H A 26 GLU HA 1.0 1.2 2.8 849 643 A 25 PRO HBy A 26 GLU HG2 1.0 1.8 7.0 850 643 A 25 PRO HBx A 26 GLU HG2 1.0 1.8 7.0 851 643 A 26 GLU HGy A 25 PRO HBx 1.0 1.8 7.0 852 643 A 25 PRO HBy A 26 GLU HGy 1.0 1.8 7.0 853 644 A 26 GLU HA A 26 GLU HG2 1.0 1.8 6.0 854 644 A 26 GLU HA A 26 GLU HGy 1.0 1.8 6.0 855 645 A 26 GLU HGy A 26 GLU HBy 1.0 1.8 4.4 856 645 A 26 GLU HBy A 26 GLU HG2 1.0 1.8 4.4 857 646 A 26 GLU HBx A 26 GLU HGy 1.0 1.8 4.4 858 646 A 26 GLU HBx A 26 GLU HG2 1.0 1.8 4.4 859 647 A 26 GLU H A 26 GLU HG2 1.0 1.8 6.0 860 647 A 26 GLU H A 26 GLU HGy 1.0 1.8 6.0 861 648 A 24 THR HB A 26 GLU H 1.0 1.8 5.0 862 649 A 24 THR HG1 A 26 GLU H 1.0 1.8 5.0 863 650 A 24 THR H A 26 GLU H 1.0 1.8 5.0 864 651 A 26 GLU H A 25 PRO HA 1.0 1.8 5.0 865 652 A 26 GLU H A 25 PRO HBx 1.0 1.8 5.0 866 653 A 26 GLU H A 25 PRO HBy 1.0 1.8 5.0 867 654 A 26 GLU H A 26 GLU HG2 1.0 1.8 6.0 868 654 A 26 GLU H A 26 GLU HGy 1.0 1.8 6.0 869 655 A 26 GLU H A 27 SER HBx 1.0 1.8 6.0 870 655 A 26 GLU H A 27 SER HBy 1.0 1.8 6.0 871 656 A 26 GLU H A 27 SER H 1.0 1.8 5.0 872 657 A 27 SER H A 27 SER HA 1.0 1.2 2.8 873 658 A 27 SER HA A 28 HIS HBy 1.0 1.8 5.0 874 659 A 27 SER HA A 28 HIS H 1.0 1.8 3.4 875 660 A 27 SER HA A 66 ILE HG1y 1.0 1.8 5.0 876 661 A 24 THR H A 27 SER HBx 1.0 1.8 6.0 877 661 A 24 THR H A 27 SER HBy 1.0 1.8 6.0 878 662 A 24 THR HA A 27 SER H 1.0 1.8 5.0 879 663 A 24 THR H A 27 SER H 1.0 1.8 5.0 880 664 A 27 SER H A 26 GLU HBy 1.0 1.8 5.0 881 665 A 27 SER H A 26 GLU HBx 1.0 1.8 5.0 882 666 A 27 SER H A 26 GLU HG2 1.0 1.8 6.0 883 666 A 27 SER H A 26 GLU HGy 1.0 1.8 6.0 884 667 A 26 GLU H A 27 SER H 1.0 1.8 5.0 885 668 A 27 SER H A 27 SER HA 1.0 1.8 2.8 886 669 A 27 SER H A 28 HIS H 1.0 4.0 5.0 887 670 A 27 SER H A 66 ILE HG1x 1.0 1.8 5.0 888 671 A 27 SER H A 66 ILE HG1y 1.0 1.8 6.0 889 672 A 28 HIS HA A 28 HIS HBx 1.0 1.8 5.0 890 673 A 28 HIS HA A 28 HIS HBy 1.0 1.8 5.0 891 674 A 28 HIS H A 28 HIS HA 1.0 1.8 2.8 892 675 A 28 HIS HA A 29 PHE H 1.0 1.8 3.4 893 676 A 28 HIS HA A 66 ILE HA 1.0 1.8 7.0 894 677 A 28 HIS HA A 28 HIS HBx 1.0 1.8 2.8 895 678 A 28 HIS H A 28 HIS HBx 1.0 1.8 5.0 896 679 A 28 HIS HA A 28 HIS HBy 1.0 1.8 5.0 897 680 A 28 HIS H A 28 HIS HBy 1.0 1.8 5.0 898 681 A 27 SER HA A 28 HIS HBx 1.0 1.8 6.0 899 681 A 27 SER HA A 28 HIS HBy 1.0 1.8 6.0 900 682 A 29 PHE H A 28 HIS HBx 1.0 1.8 6.0 901 682 A 29 PHE H A 28 HIS HBy 1.0 1.8 6.0 902 683 A 27 SER HA A 28 HIS H 1.0 1.8 5.0 903 684 A 28 HIS H A 27 SER HBx 1.0 1.8 5.0 904 685 A 27 SER HBy A 28 HIS H 1.0 1.8 5.0 905 686 A 28 HIS H A 66 ILE HG1x 1.0 1.8 5.0 906 687 A 28 HIS H A 66 ILE HD1% 1.0 1.8 6.0 907 688 A 28 HIS H A 28 HIS HA 1.0 1.8 2.8 908 689 A 28 HIS H A 28 HIS HBx 1.0 1.8 5.0 909 690 A 28 HIS H A 28 HIS HBy 1.0 1.8 5.0 910 691 A 28 HIS H A 29 PHE H 1.0 1.8 5.0 911 692 A 29 PHE HA A 29 PHE HBx 1.0 1.8 5.0 912 693 A 29 PHE HA A 29 PHE HD% 1.0 1.8 6.0 913 694 A 29 PHE H A 29 PHE HA 1.0 1.8 2.8 914 695 A 29 PHE HA A 30 VAL HG1% 1.0 1.8 6.0 915 695 A 29 PHE HA A 30 VAL HG2% 1.0 1.8 6.0 916 696 A 29 PHE HA A 30 VAL H 1.0 1.8 3.4 917 697 A 29 PHE HA A 29 PHE HBx 1.0 1.8 5.0 918 698 A 30 VAL H A 29 PHE HBy 1.0 1.8 5.0 919 699 A 29 PHE HD% A 29 PHE HBx 1.0 1.8 7.0 920 699 A 29 PHE HD% A 29 PHE HBy 1.0 1.8 7.0 921 700 A 29 PHE HE% A 29 PHE HBx 1.0 1.8 7.0 922 700 A 29 PHE HBy A 29 PHE HE% 1.0 1.8 7.0 923 701 A 29 PHE H A 29 PHE HBx 1.0 1.8 6.0 924 701 A 29 PHE H A 29 PHE HBy 1.0 1.8 6.0 925 702 A 29 PHE HBx A 30 VAL HG1% 1.0 1.8 7.0 926 702 A 29 PHE HBy A 30 VAL HG1% 1.0 1.8 7.0 927 702 A 30 VAL HG2% A 29 PHE HBx 1.0 1.8 7.0 928 702 A 30 VAL HG2% A 29 PHE HBy 1.0 1.8 7.0 929 703 A 35 LEU HD2% A 29 PHE HD% 1.0 1.8 6.0 930 704 A 29 PHE HA A 29 PHE HD% 1.0 1.8 6.0 931 705 A 29 PHE HD% A 29 PHE HBx 1.0 1.8 7.0 932 705 A 29 PHE HD% A 29 PHE HBy 1.0 1.8 7.0 933 706 A 29 PHE H A 29 PHE HD% 1.0 1.8 6.0 934 707 A 29 PHE HD% A 30 VAL HB 1.0 1.8 6.0 935 708 A 29 PHE HD% A 30 VAL H 1.0 1.8 6.0 936 709 A 29 PHE HD% A 35 LEU HBy 1.0 1.8 7.0 937 709 A 29 PHE HD% A 35 LEU HBx 1.0 1.8 7.0 938 710 A 35 LEU HD2% A 29 PHE HD% 1.0 1.8 6.0 939 711 A 29 PHE HD% A 63 ILE HG1x 1.0 1.8 7.0 940 711 A 29 PHE HD% A 63 ILE HG2% 1.0 1.8 7.0 941 711 A 29 PHE HD% A 63 ILE HG1y 1.0 1.8 7.0 942 712 A 29 PHE HE% A 35 LEU HBy 1.0 1.8 7.0 943 712 A 29 PHE HE% A 35 LEU HBx 1.0 1.8 7.0 944 713 A 29 PHE HE% A 43 VAL HG1% 1.0 1.8 7.0 945 713 A 43 VAL HG2% A 29 PHE HE% 1.0 1.8 7.0 946 714 A 28 HIS HA A 29 PHE H 1.0 1.8 5.0 947 715 A 29 PHE H A 28 HIS HD1 1.0 1.8 5.0 948 716 A 28 HIS H A 29 PHE H 1.0 1.8 5.0 949 717 A 29 PHE H A 29 PHE HA 1.0 1.8 2.8 950 718 A 29 PHE H A 29 PHE HBx 1.0 1.8 6.0 951 718 A 29 PHE H A 29 PHE HBy 1.0 1.8 6.0 952 719 A 29 PHE H A 29 PHE HD% 1.0 1.8 6.0 953 720 A 29 PHE H A 30 VAL H 1.0 1.8 5.0 954 721 A 29 PHE H A 64 GLN HA 1.0 1.8 5.0 955 722 A 29 PHE H A 31 LYS HDx 1.0 1.8 6.0 956 722 A 29 PHE H A 31 LYS HDy 1.0 1.8 6.0 957 723 A 29 PHE H A 31 LYS HGx 1.0 1.8 6.0 958 723 A 29 PHE H A 31 LYS HGy 1.0 1.8 6.0 959 724 A 29 PHE H A 31 LYS H 1.0 1.8 5.0 960 725 A 30 VAL HB A 30 VAL HA 1.0 1.8 5.0 961 726 A 30 VAL HA A 30 VAL HG1% 1.0 1.8 6.0 962 726 A 30 VAL HG2% A 30 VAL HA 1.0 1.8 6.0 963 727 A 30 VAL H A 30 VAL HA 1.0 1.2 2.8 964 728 A 30 VAL HA A 31 LYS HA 1.0 1.8 5.0 965 729 A 31 LYS H A 30 VAL HA 1.0 1.8 3.4 966 730 A 30 VAL HB A 30 VAL HA 1.0 1.8 5.0 967 731 A 30 VAL HB A 30 VAL HG1% 1.0 1.8 2.8 968 732 A 30 VAL H A 30 VAL HB 1.0 1.8 5.0 969 733 A 30 VAL HB A 31 LYS HA 1.0 1.8 5.0 970 734 A 30 VAL HB A 31 LYS H 1.0 1.8 5.0 971 735 A 31 LYS H A 30 VAL HG1% 1.0 1.8 6.0 972 735 A 30 VAL HG2% A 31 LYS H 1.0 1.8 6.0 973 736 A 30 VAL H A 29 PHE HBx 1.0 1.8 6.0 974 736 A 30 VAL H A 29 PHE HBy 1.0 1.8 6.0 975 737 A 29 PHE HD% A 30 VAL H 1.0 1.8 6.0 976 738 A 30 VAL H A 30 VAL HA 1.0 1.8 2.8 977 739 A 30 VAL H A 30 VAL HG1% 1.0 1.8 5.0 978 740 A 30 VAL HG2% A 30 VAL H 1.0 1.8 5.0 979 741 A 30 VAL H A 31 LYS HBx 1.0 1.8 6.0 980 741 A 30 VAL H A 31 LYS HBy 1.0 1.8 6.0 981 742 A 30 VAL H A 31 LYS HDx 1.0 1.8 6.0 982 742 A 30 VAL H A 31 LYS HDy 1.0 1.8 6.0 983 743 A 30 VAL H A 31 LYS H 1.0 1.8 5.0 984 744 A 30 VAL H A 32 ASP H 1.0 1.8 5.0 985 745 A 30 VAL HB A 31 LYS HA 1.0 1.8 5.0 986 746 A 31 LYS HA A 31 LYS HDx 1.0 1.8 5.0 987 747 A 31 LYS HA A 31 LYS HEy 1.0 1.8 5.0 988 748 A 31 LYS HA A 31 LYS HGx 1.0 1.8 6.0 989 748 A 31 LYS HGy A 31 LYS HA 1.0 1.8 6.0 990 749 A 31 LYS H A 31 LYS HA 1.0 1.8 2.8 991 750 A 31 LYS HA A 32 ASP H 1.0 1.8 5.0 992 751 A 31 LYS HGy A 31 LYS HDx 1.0 1.8 2.8 993 751 A 31 LYS HDx A 31 LYS HGx 1.0 1.8 2.8 994 752 A 31 LYS HA A 31 LYS HDx 1.0 1.8 6.0 995 752 A 31 LYS HDy A 31 LYS HA 1.0 1.8 6.0 996 753 A 31 LYS HBy A 31 LYS HDx 1.0 1.8 7.0 997 753 A 31 LYS HDy A 31 LYS HBx 1.0 1.8 7.0 998 753 A 31 LYS HDy A 31 LYS HBy 1.0 1.8 7.0 999 753 A 31 LYS HBx A 31 LYS HDx 1.0 1.8 7.0 1000 754 A 31 LYS HA A 31 LYS HEy 1.0 1.8 5.0 1001 755 A 31 LYS HEy A 31 LYS HDx 1.0 1.8 6.0 1002 755 A 31 LYS HDy A 31 LYS HEy 1.0 1.8 6.0 1003 756 A 31 LYS HEy A 31 LYS HGx 1.0 1.8 5.0 1004 756 A 31 LYS HGy A 31 LYS HEy 1.0 1.8 5.0 1005 757 A 31 LYS HBx A 31 LYS HGx 1.0 1.8 5.0 1006 758 A 30 VAL H A 31 LYS HGx 1.0 1.8 6.0 1007 758 A 30 VAL H A 31 LYS HGy 1.0 1.8 6.0 1008 759 A 31 LYS HA A 31 LYS HGx 1.0 1.8 5.0 1009 759 A 31 LYS HGy A 31 LYS HA 1.0 1.8 5.0 1010 760 A 31 LYS H A 31 LYS HGx 1.0 1.8 6.0 1011 760 A 31 LYS HGy A 31 LYS H 1.0 1.8 6.0 1012 761 A 32 ASP H A 31 LYS HGx 1.0 1.8 6.0 1013 761 A 31 LYS HGy A 32 ASP H 1.0 1.8 6.0 1014 762 A 64 GLN HA A 31 LYS HGx 1.0 1.8 6.0 1015 762 A 64 GLN HA A 31 LYS HGy 1.0 1.8 6.0 1016 763 A 31 LYS H A 30 VAL HA 1.0 1.8 3.4 1017 764 A 30 VAL H A 31 LYS H 1.0 1.8 5.0 1018 765 A 31 LYS H A 31 LYS HA 1.0 1.8 2.8 1019 766 A 31 LYS H A 31 LYS HBx 1.0 1.8 6.0 1020 766 A 31 LYS H A 31 LYS HBy 1.0 1.8 6.0 1021 767 A 31 LYS H A 31 LYS HDx 1.0 1.8 6.0 1022 767 A 31 LYS HDy A 31 LYS H 1.0 1.8 6.0 1023 768 A 31 LYS H A 31 LYS HGx 1.0 1.8 5.0 1024 769 A 31 LYS HGy A 31 LYS H 1.0 1.8 5.0 1025 770 A 31 LYS H A 32 ASP HBy 1.0 1.8 5.0 1026 771 A 31 LYS H A 32 ASP H 1.0 1.8 5.0 1027 772 A 32 ASP HA A 32 ASP HBx 1.0 1.8 5.0 1028 773 A 32 ASP HA A 32 ASP HBy 1.0 1.8 5.0 1029 774 A 32 ASP H A 32 ASP HA 1.0 1.8 2.8 1030 775 A 32 ASP HA A 33 LEU HBy 1.0 1.8 6.0 1031 775 A 33 LEU HBx A 32 ASP HA 1.0 1.8 6.0 1032 776 A 32 ASP HA A 33 LEU H 1.0 1.8 3.4 1033 777 A 32 ASP HA A 32 ASP HBx 1.0 1.8 5.0 1034 778 A 33 LEU HBx A 32 ASP HBx 1.0 1.8 6.0 1035 778 A 32 ASP HBx A 33 LEU HBy 1.0 1.8 6.0 1036 779 A 29 PHE HA A 32 ASP HBy 1.0 1.8 6.0 1037 779 A 29 PHE HA A 32 ASP HBx 1.0 1.8 6.0 1038 780 A 31 LYS H A 32 ASP HBy 1.0 1.8 6.0 1039 780 A 31 LYS H A 32 ASP HBx 1.0 1.8 6.0 1040 781 A 32 ASP H A 32 ASP HBy 1.0 1.8 5.0 1041 781 A 32 ASP H A 32 ASP HBx 1.0 1.8 5.0 1042 782 A 33 LEU H A 32 ASP HBy 1.0 1.8 6.0 1043 782 A 33 LEU H A 32 ASP HBx 1.0 1.8 6.0 1044 783 A 29 PHE HA A 32 ASP H 1.0 1.8 5.0 1045 784 A 30 VAL H A 32 ASP H 1.0 1.8 5.0 1046 785 A 31 LYS HA A 32 ASP H 1.0 1.8 5.0 1047 786 A 32 ASP H A 31 LYS HBx 1.0 1.8 6.0 1048 786 A 31 LYS HBy A 32 ASP H 1.0 1.8 6.0 1049 787 A 32 ASP H A 31 LYS HDx 1.0 1.8 6.0 1050 787 A 31 LYS HDy A 32 ASP H 1.0 1.8 6.0 1051 788 A 32 ASP H A 31 LYS HGx 1.0 1.8 5.0 1052 789 A 31 LYS HGy A 32 ASP H 1.0 1.8 5.0 1053 790 A 31 LYS H A 32 ASP H 1.0 1.8 5.0 1054 791 A 31 LYS H A 32 ASP H 1.0 1.8 5.0 1055 792 A 32 ASP H A 32 ASP HA 1.0 1.8 2.8 1056 793 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.4 1057 794 A 32 ASP H A 32 ASP HBy 1.0 1.8 3.4 1058 795 A 32 ASP H A 33 LEU HA 1.0 1.8 5.0 1059 796 A 32 ASP H A 33 LEU HA 1.0 1.8 5.0 1060 797 A 32 ASP H A 34 GLY H 1.0 1.8 5.0 1061 798 A 33 LEU HBx A 33 LEU HA 1.0 1.8 5.0 1062 799 A 33 LEU HA A 33 LEU HBy 1.0 1.8 5.0 1063 800 A 33 LEU H A 33 LEU HA 1.0 1.8 2.8 1064 801 A 33 LEU HA A 34 GLY H 1.0 1.8 3.4 1065 802 A 33 LEU HBx A 33 LEU HA 1.0 1.8 2.8 1066 803 A 33 LEU HA A 33 LEU HBy 1.0 1.8 5.0 1067 804 A 22 LYS HBy A 33 LEU HBy 1.0 1.8 7.0 1068 804 A 22 LYS HB2 A 33 LEU HBy 1.0 1.8 7.0 1069 804 A 33 LEU HBx A 22 LYS HBy 1.0 1.8 7.0 1070 804 A 22 LYS HB2 A 33 LEU HBx 1.0 1.8 7.0 1071 805 A 22 LYS HGx A 33 LEU HBy 1.0 1.8 7.0 1072 805 A 22 LYS HGy A 33 LEU HBy 1.0 1.8 7.0 1073 805 A 33 LEU HBx A 22 LYS HGx 1.0 1.8 7.0 1074 805 A 22 LYS HGy A 33 LEU HBx 1.0 1.8 7.0 1075 806 A 34 GLY HA3 A 33 LEU HBy 1.0 1.8 6.0 1076 806 A 33 LEU HBx A 34 GLY HA3 1.0 1.8 6.0 1077 807 A 29 PHE HD% A 33 LEU H 1.0 1.8 6.0 1078 808 A 31 LYS H A 33 LEU H 1.0 1.8 5.0 1079 809 A 32 ASP HA A 33 LEU H 1.0 1.8 5.0 1080 810 A 33 LEU H A 32 ASP HBy 1.0 1.8 6.0 1081 810 A 33 LEU H A 32 ASP HBx 1.0 1.8 6.0 1082 811 A 32 ASP H A 33 LEU H 1.0 1.2 2.8 1083 812 A 33 LEU HBx A 33 LEU H 1.0 1.8 5.0 1084 813 A 33 LEU H A 33 LEU HBy 1.0 1.8 5.0 1085 814 A 33 LEU H A 34 GLY H 1.0 1.8 5.0 1086 815 A 34 GLY HA3 A 33 LEU HBy 1.0 1.8 6.0 1087 815 A 33 LEU HBx A 34 GLY HA3 1.0 1.8 6.0 1088 816 A 34 GLY H A 34 GLY HA3 1.0 1.8 2.8 1089 817 A 34 GLY HA3 A 35 LEU H 1.0 1.8 3.4 1090 818 A 32 ASP H A 34 GLY H 1.0 1.8 5.0 1091 819 A 33 LEU HA A 34 GLY H 1.0 1.8 5.0 1092 820 A 33 LEU HBx A 34 GLY H 1.0 1.8 5.0 1093 821 A 34 GLY H A 33 LEU HBy 1.0 1.8 5.0 1094 822 A 33 LEU H A 34 GLY H 1.0 1.8 5.0 1095 823 A 34 GLY H A 34 GLY HA3 1.0 1.8 2.8 1096 824 A 34 GLY H A 35 LEU H 1.0 1.8 5.0 1097 825 A 35 LEU HBx A 35 LEU HA 1.0 1.8 2.8 1098 826 A 35 LEU HD2% A 35 LEU HA 1.0 1.8 5.0 1099 827 A 35 LEU HA A 36 ASN HA 1.0 1.8 5.0 1100 828 A 35 LEU HA A 36 ASN H 1.0 1.8 3.4 1101 829 A 35 LEU HBx A 35 LEU HA 1.0 1.8 5.0 1102 830 A 29 PHE HD% A 35 LEU HBy 1.0 1.8 7.0 1103 830 A 29 PHE HD% A 35 LEU HBx 1.0 1.8 7.0 1104 831 A 35 LEU HD2% A 35 LEU HBy 1.0 1.8 4.4 1105 831 A 35 LEU HD2% A 35 LEU HBx 1.0 1.8 4.4 1106 832 A 36 ASN H A 35 LEU HBy 1.0 1.8 6.0 1107 832 A 35 LEU HBx A 36 ASN H 1.0 1.8 6.0 1108 833 A 35 LEU HBy A 39 ASP HBy 1.0 1.8 7.0 1109 833 A 35 LEU HBx A 39 ASP HBy 1.0 1.8 7.0 1110 833 A 39 ASP HBx A 35 LEU HBy 1.0 1.8 7.0 1111 833 A 35 LEU HBx A 39 ASP HBx 1.0 1.8 7.0 1112 834 A 35 LEU HD2% A 29 PHE HD% 1.0 1.8 6.0 1113 835 A 34 GLY H A 35 LEU HG 1.0 1.8 6.0 1114 836 A 35 LEU HD2% A 35 LEU HA 1.0 1.8 5.0 1115 837 A 35 LEU HD2% A 35 LEU HBy 1.0 1.8 4.4 1116 837 A 35 LEU HD2% A 35 LEU HBx 1.0 1.8 4.4 1117 838 A 34 GLY HA3 A 35 LEU H 1.0 1.8 5.0 1118 839 A 35 LEU H A 35 LEU HA 1.0 1.8 2.8 1119 840 A 35 LEU H A 35 LEU HBy 1.0 1.8 5.0 1120 840 A 35 LEU HBx A 35 LEU H 1.0 1.8 5.0 1121 841 A 35 LEU HD2% A 35 LEU H 1.0 1.8 5.0 1122 842 A 35 LEU H A 36 ASN H 1.0 1.8 5.0 1123 843 A 35 LEU HA A 36 ASN HA 1.0 1.8 5.0 1124 844 A 36 ASN HA A 35 LEU HBy 1.0 1.8 6.0 1125 844 A 35 LEU HBx A 36 ASN HA 1.0 1.8 6.0 1126 845 A 36 ASN HA A 36 ASN HBx 1.0 1.8 5.0 1127 846 A 36 ASN HA A 36 ASN HBy 1.0 1.8 5.0 1128 847 A 36 ASN HA A 36 ASN HD21 1.0 1.8 5.0 1129 848 A 36 ASN HA A 36 ASN HD22 1.0 1.8 5.0 1130 849 A 36 ASN HA A 36 ASN H 1.0 1.8 2.8 1131 850 A 36 ASN HA A 37 SER HB3 1.0 1.8 6.0 1132 850 A 36 ASN HA A 37 SER HB2 1.0 1.8 6.0 1133 851 A 36 ASN HA A 37 SER H 1.0 1.8 5.0 1134 852 A 36 ASN HA A 36 ASN HBx 1.0 1.8 5.0 1135 853 A 36 ASN HD22 A 36 ASN HBx 1.0 1.8 5.0 1136 854 A 36 ASN H A 36 ASN HBx 1.0 1.8 5.0 1137 855 A 37 SER H A 36 ASN HBx 1.0 1.8 5.0 1138 856 A 36 ASN HD21 A 36 ASN HBy 1.0 1.8 3.4 1139 857 A 36 ASN HD22 A 36 ASN HBy 1.0 1.8 5.0 1140 858 A 36 ASN H A 36 ASN HBy 1.0 1.8 5.0 1141 859 A 37 SER H A 36 ASN HBy 1.0 1.8 5.0 1142 860 A 37 SER HA A 36 ASN HBx 1.0 1.8 6.0 1143 860 A 36 ASN HBy A 37 SER HA 1.0 1.8 6.0 1144 861 A 36 ASN HBx A 37 SER HB3 1.0 1.8 7.0 1145 861 A 36 ASN HBy A 37 SER HB3 1.0 1.8 7.0 1146 861 A 37 SER HB2 A 36 ASN HBx 1.0 1.8 7.0 1147 861 A 37 SER HB2 A 36 ASN HBy 1.0 1.8 7.0 1148 862 A 38 LEU H A 36 ASN HBx 1.0 1.8 6.0 1149 862 A 36 ASN HBy A 38 LEU H 1.0 1.8 6.0 1150 863 A 36 ASN HBy A 39 ASP HBy 1.0 1.8 7.0 1151 863 A 36 ASN HBx A 39 ASP HBy 1.0 1.8 7.0 1152 863 A 39 ASP HBx A 36 ASN HBx 1.0 1.8 7.0 1153 863 A 39 ASP HBx A 36 ASN HBy 1.0 1.8 7.0 1154 864 A 39 ASP H A 36 ASN HBx 1.0 1.8 6.0 1155 864 A 36 ASN HBy A 39 ASP H 1.0 1.8 6.0 1156 865 A 36 ASN HA A 36 ASN HD21 1.0 1.8 5.0 1157 866 A 36 ASN HD21 A 36 ASN HBx 1.0 1.8 3.4 1158 867 A 36 ASN HD21 A 36 ASN HBy 1.0 1.8 3.4 1159 868 A 36 ASN H A 36 ASN HD21 1.0 1.8 5.0 1160 869 A 36 ASN HD21 A 37 SER H 1.0 1.8 5.0 1161 870 A 36 ASN HD22 A 36 ASN HBx 1.0 1.8 5.0 1162 871 A 36 ASN HD22 A 36 ASN HBy 1.0 1.8 5.0 1163 872 A 35 LEU HBx A 36 ASN H 1.0 1.8 5.0 1164 873 A 36 ASN H A 35 LEU HBy 1.0 1.8 5.0 1165 874 A 35 LEU H A 36 ASN H 1.0 1.8 5.0 1166 875 A 36 ASN HA A 36 ASN H 1.0 1.8 2.8 1167 876 A 36 ASN H A 36 ASN HBx 1.0 1.8 5.0 1168 876 A 36 ASN H A 36 ASN HBy 1.0 1.8 5.0 1169 877 A 36 ASN H A 37 SER H 1.0 1.8 5.0 1170 878 A 37 SER HA A 36 ASN HBx 1.0 1.8 6.0 1171 878 A 36 ASN HBy A 37 SER HA 1.0 1.8 6.0 1172 879 A 36 ASN HD21 A 37 SER HA 1.0 1.8 5.0 1173 880 A 37 SER HA A 37 SER HB3 1.0 1.8 4.4 1174 880 A 37 SER HB2 A 37 SER HA 1.0 1.8 4.4 1175 881 A 38 LEU H A 37 SER HB3 1.0 1.8 6.0 1176 881 A 37 SER HB2 A 38 LEU H 1.0 1.8 6.0 1177 882 A 37 SER H A 36 ASN HBx 1.0 1.8 5.0 1178 883 A 37 SER H A 36 ASN HBy 1.0 1.8 5.0 1179 884 A 36 ASN HD21 A 37 SER H 1.0 1.8 5.0 1180 885 A 36 ASN H A 37 SER H 1.0 1.8 5.0 1181 886 A 37 SER H A 37 SER HB3 1.0 1.8 5.0 1182 887 A 37 SER HB2 A 37 SER H 1.0 1.8 5.0 1183 888 A 37 SER H A 38 LEU HBx 1.0 1.8 5.0 1184 889 A 37 SER H A 38 LEU HD1% 1.0 1.8 5.0 1185 890 A 37 SER H A 38 LEU H 1.0 1.8 5.0 1186 891 A 38 LEU HA A 38 LEU HBx 1.0 1.8 5.0 1187 892 A 39 ASP H A 38 LEU HA 1.0 1.8 3.4 1188 893 A 37 SER H A 38 LEU HBx 1.0 1.8 5.0 1189 894 A 38 LEU HA A 38 LEU HBx 1.0 1.8 5.0 1190 895 A 38 LEU HD1% A 38 LEU HBx 1.0 1.8 5.0 1191 896 A 38 LEU HG A 38 LEU HBx 1.0 1.8 2.8 1192 897 A 38 LEU H A 38 LEU HBx 1.0 1.8 5.0 1193 898 A 39 ASP H A 38 LEU HBx 1.0 1.8 5.0 1194 899 A 38 LEU HA A 38 LEU HBy 1.0 1.8 5.0 1195 900 A 38 LEU HD1% A 38 LEU HBy 1.0 1.8 5.0 1196 901 A 38 LEU HG A 38 LEU HBy 1.0 1.8 2.8 1197 902 A 38 LEU H A 38 LEU HBy 1.0 1.8 5.0 1198 903 A 39 ASP HA A 38 LEU HBy 1.0 1.8 5.0 1199 904 A 39 ASP H A 38 LEU HBy 1.0 1.8 5.0 1200 905 A 36 ASN HD22 A 38 LEU HBy 1.0 1.8 6.0 1201 905 A 36 ASN HD22 A 38 LEU HBx 1.0 1.8 6.0 1202 906 A 39 ASP H A 38 LEU HBy 1.0 1.8 4.4 1203 906 A 39 ASP H A 38 LEU HBx 1.0 1.8 4.4 1204 907 A 38 LEU HD1% A 38 LEU HA 1.0 1.8 5.0 1205 908 A 38 LEU HD1% A 38 LEU HBy 1.0 1.8 4.4 1206 908 A 38 LEU HD1% A 38 LEU HBx 1.0 1.8 4.4 1207 909 A 38 LEU HD1% A 38 LEU HG 1.0 1.8 3.4 1208 910 A 38 LEU H A 38 LEU HD1% 1.0 1.8 5.0 1209 911 A 39 ASP H A 38 LEU HD1% 1.0 1.8 5.0 1210 912 A 38 LEU HA A 38 LEU HG 1.0 1.8 5.0 1211 913 A 38 LEU HG A 38 LEU HBx 1.0 1.8 2.8 1212 914 A 38 LEU HG A 38 LEU HBy 1.0 1.8 2.8 1213 915 A 38 LEU HD1% A 38 LEU HG 1.0 1.8 5.0 1214 916 A 38 LEU H A 38 LEU HG 1.0 1.8 5.0 1215 917 A 38 LEU HG A 39 ASP HA 1.0 1.8 5.0 1216 918 A 39 ASP H A 38 LEU HG 1.0 1.8 5.0 1217 919 A 38 LEU HA A 41 VAL HG1% 1.0 1.8 6.0 1218 919 A 38 LEU HA A 41 VAL HG2% 1.0 1.8 6.0 1219 920 A 38 LEU H A 36 ASN HBx 1.0 1.8 6.0 1220 920 A 36 ASN HBy A 38 LEU H 1.0 1.8 6.0 1221 921 A 37 SER HA A 38 LEU H 1.0 1.8 3.4 1222 922 A 37 SER H A 38 LEU H 1.0 1.8 3.4 1223 923 A 38 LEU H A 38 LEU HBx 1.0 1.8 5.0 1224 924 A 38 LEU H A 38 LEU HBy 1.0 1.8 5.0 1225 925 A 38 LEU H A 38 LEU HD1% 1.0 1.8 5.0 1226 926 A 38 LEU H A 38 LEU HD21 1.0 1.8 5.0 1227 927 A 38 LEU H A 38 LEU HG 1.0 1.8 5.0 1228 928 A 38 LEU H A 39 ASP H 1.0 1.8 5.0 1229 929 A 39 ASP HA A 38 LEU HBy 1.0 1.8 6.0 1230 929 A 39 ASP HA A 38 LEU HBx 1.0 1.8 6.0 1231 930 A 39 ASP HA A 38 LEU HD21 1.0 1.8 5.0 1232 931 A 38 LEU HG A 39 ASP HA 1.0 1.8 5.0 1233 932 A 39 ASP HBx A 39 ASP HA 1.0 1.8 5.0 1234 933 A 39 ASP HA A 39 ASP HBy 1.0 1.8 5.0 1235 934 A 39 ASP HA A 40 VAL H 1.0 1.8 3.4 1236 935 A 39 ASP HA A 42 GLU H 1.0 1.8 5.0 1237 936 A 36 ASN H A 39 ASP HBx 1.0 1.8 5.0 1238 937 A 39 ASP HBx A 39 ASP HA 1.0 1.8 5.0 1239 938 A 39 ASP HBx A 39 ASP H 1.0 1.8 5.0 1240 939 A 39 ASP HBx A 40 VAL H 1.0 1.8 5.0 1241 940 A 35 LEU HBy A 39 ASP HBy 1.0 1.8 6.0 1242 940 A 35 LEU HBx A 39 ASP HBy 1.0 1.8 6.0 1243 941 A 36 ASN H A 39 ASP HBy 1.0 1.8 5.0 1244 942 A 39 ASP HA A 39 ASP HBy 1.0 1.8 5.0 1245 943 A 39 ASP H A 39 ASP HBy 1.0 1.8 5.0 1246 944 A 40 VAL H A 39 ASP HBy 1.0 1.8 5.0 1247 945 A 35 LEU HD2% A 39 ASP HBy 1.0 1.8 6.0 1248 945 A 35 LEU HD2% A 39 ASP HBx 1.0 1.8 6.0 1249 946 A 36 ASN HD21 A 39 ASP H 1.0 1.8 6.0 1250 946 A 36 ASN HD22 A 39 ASP H 1.0 1.8 6.0 1251 947 A 36 ASN H A 39 ASP H 1.0 1.8 5.0 1252 948 A 39 ASP H A 38 LEU HA 1.0 1.8 5.0 1253 949 A 39 ASP H A 38 LEU HBy 1.0 1.8 6.0 1254 949 A 39 ASP H A 38 LEU HBx 1.0 1.8 6.0 1255 950 A 39 ASP H A 38 LEU HD1% 1.0 1.8 5.0 1256 951 A 39 ASP H A 38 LEU HG 1.0 1.8 5.0 1257 952 A 38 LEU H A 39 ASP H 1.0 1.8 5.0 1258 953 A 39 ASP HBx A 39 ASP H 1.0 1.8 5.0 1259 954 A 39 ASP H A 39 ASP HBy 1.0 1.8 5.0 1260 955 A 39 ASP H A 39 ASP HBy 1.0 1.8 6.0 1261 955 A 39 ASP HBx A 39 ASP H 1.0 1.8 6.0 1262 956 A 39 ASP H A 40 VAL H 1.0 1.8 5.0 1263 957 A 39 ASP H A 42 GLU HBx 1.0 1.8 6.0 1264 957 A 42 GLU HBy A 39 ASP H 1.0 1.8 6.0 1265 958 A 39 ASP H A 42 GLU HGy 1.0 1.8 6.0 1266 958 A 39 ASP H A 42 GLU HGx 1.0 1.8 6.0 1267 959 A 40 VAL HA A 40 VAL HG1% 1.0 1.8 6.0 1268 959 A 40 VAL HA A 40 VAL HG21 1.0 1.8 6.0 1269 960 A 40 VAL H A 40 VAL HA 1.0 1.8 2.8 1270 961 A 40 VAL HA A 43 VAL HB 1.0 1.8 5.0 1271 962 A 40 VAL HA A 43 VAL HG1% 1.0 1.8 5.0 1272 963 A 43 VAL HG2% A 40 VAL HA 1.0 1.8 5.0 1273 964 A 40 VAL HA A 40 VAL HB 1.0 1.8 2.8 1274 965 A 40 VAL HB A 40 VAL HG1% 1.0 1.8 3.4 1275 966 A 40 VAL H A 40 VAL HB 1.0 1.8 5.0 1276 967 A 40 VAL HA A 40 VAL HG1% 1.0 1.8 5.0 1277 968 A 40 VAL HB A 40 VAL HG1% 1.0 1.8 2.8 1278 969 A 40 VAL H A 40 VAL HG1% 1.0 1.8 5.0 1279 970 A 41 VAL HB A 40 VAL HG1% 1.0 1.8 5.0 1280 971 A 41 VAL H A 40 VAL HG1% 1.0 1.8 5.0 1281 972 A 43 VAL HG2% A 40 VAL HG1% 1.0 1.8 6.0 1282 972 A 40 VAL HG1% A 43 VAL HG1% 1.0 1.8 6.0 1283 973 A 44 VAL H A 40 VAL HG1% 1.0 1.8 5.0 1284 974 A 40 VAL HG21 A 41 VAL H 1.0 1.8 5.0 1285 975 A 43 VAL HG2% A 40 VAL HG21 1.0 1.8 6.0 1286 975 A 40 VAL HG21 A 43 VAL HG1% 1.0 1.8 6.0 1287 976 A 36 ASN HD22 A 40 VAL H 1.0 1.8 6.0 1288 976 A 36 ASN HD21 A 40 VAL H 1.0 1.8 6.0 1289 977 A 36 ASN H A 40 VAL H 1.0 1.8 5.0 1290 978 A 39 ASP HA A 40 VAL H 1.0 1.8 5.0 1291 979 A 40 VAL H A 39 ASP HBy 1.0 1.8 6.0 1292 979 A 39 ASP HBx A 40 VAL H 1.0 1.8 6.0 1293 980 A 40 VAL H A 40 VAL HB 1.0 1.8 5.0 1294 981 A 40 VAL H A 40 VAL HG1% 1.0 1.8 5.0 1295 982 A 40 VAL H A 41 VAL H 1.0 1.8 5.0 1296 983 A 41 VAL HA A 40 VAL HG1% 1.0 1.8 6.0 1297 983 A 40 VAL HG21 A 41 VAL HA 1.0 1.8 6.0 1298 984 A 41 VAL HB A 41 VAL HA 1.0 1.8 5.0 1299 985 A 41 VAL HA A 41 VAL HG1% 1.0 1.8 5.0 1300 986 A 41 VAL HG2% A 41 VAL HA 1.0 1.8 5.0 1301 987 A 41 VAL H A 41 VAL HA 1.0 1.8 2.8 1302 988 A 42 GLU H A 41 VAL HA 1.0 1.8 5.0 1303 989 A 41 VAL HA A 44 VAL HG1% 1.0 1.8 6.0 1304 989 A 41 VAL HA A 44 VAL HG2% 1.0 1.8 6.0 1305 990 A 44 VAL H A 41 VAL HA 1.0 1.8 5.0 1306 991 A 41 VAL HB A 40 VAL HG1% 1.0 1.8 6.0 1307 991 A 40 VAL HG21 A 41 VAL HB 1.0 1.8 6.0 1308 992 A 41 VAL HB A 41 VAL HA 1.0 1.8 5.0 1309 993 A 41 VAL HB A 41 VAL HG1% 1.0 1.8 2.8 1310 994 A 41 VAL HG2% A 41 VAL HB 1.0 1.8 2.8 1311 995 A 41 VAL HB A 41 VAL H 1.0 1.8 5.0 1312 996 A 42 GLU H A 41 VAL HB 1.0 1.8 5.0 1313 997 A 41 VAL HB A 45 PHE HD1 1.0 1.8 5.0 1314 997 A 41 VAL HB A 45 PHE HDy 1.0 1.8 5.0 1315 998 A 37 SER HB2 A 41 VAL HG1% 1.0 1.8 7.0 1316 998 A 41 VAL HG2% A 37 SER HB3 1.0 1.8 7.0 1317 998 A 37 SER HB2 A 41 VAL HG2% 1.0 1.8 7.0 1318 998 A 37 SER HB3 A 41 VAL HG1% 1.0 1.8 7.0 1319 999 A 41 VAL HA A 41 VAL HG1% 1.0 1.8 6.0 1320 999 A 41 VAL HG2% A 41 VAL HA 1.0 1.8 6.0 1321 1000 A 41 VAL H A 41 VAL HG1% 1.0 1.8 6.0 1322 1000 A 41 VAL HG2% A 41 VAL H 1.0 1.8 6.0 1323 1001 A 44 VAL H A 41 VAL HG1% 1.0 1.8 6.0 1324 1001 A 41 VAL HG2% A 44 VAL H 1.0 1.8 6.0 1325 1002 A 40 VAL HA A 41 VAL H 1.0 1.8 5.0 1326 1003 A 40 VAL H A 41 VAL H 1.0 1.8 5.0 1327 1004 A 41 VAL H A 41 VAL HA 1.0 1.8 2.8 1328 1005 A 41 VAL HB A 41 VAL H 1.0 1.8 5.0 1329 1006 A 41 VAL H A 41 VAL HG1% 1.0 1.8 5.0 1330 1007 A 41 VAL HG2% A 41 VAL H 1.0 1.8 5.0 1331 1008 A 42 GLU HA A 42 GLU HBx 1.0 1.8 5.0 1332 1009 A 42 GLU H A 42 GLU HA 1.0 1.8 2.8 1333 1010 A 42 GLU HA A 43 VAL H 1.0 1.8 3.4 1334 1011 A 42 GLU HA A 45 PHE HBy 1.0 1.8 5.0 1335 1012 A 42 GLU HA A 45 PHE HD1 1.0 1.8 6.0 1336 1012 A 42 GLU HA A 45 PHE HDy 1.0 1.8 6.0 1337 1013 A 42 GLU H A 42 GLU HBx 1.0 1.8 5.0 1338 1014 A 39 ASP HA A 42 GLU HBx 1.0 1.8 6.0 1339 1014 A 42 GLU HBy A 39 ASP HA 1.0 1.8 6.0 1340 1015 A 39 ASP HBy A 42 GLU HBx 1.0 1.8 7.0 1341 1015 A 39 ASP HBx A 42 GLU HBx 1.0 1.8 7.0 1342 1015 A 42 GLU HBy A 39 ASP HBy 1.0 1.8 7.0 1343 1015 A 42 GLU HBy A 39 ASP HBx 1.0 1.8 7.0 1344 1016 A 43 VAL HA A 42 GLU HBx 1.0 1.8 6.0 1345 1016 A 42 GLU HBy A 43 VAL HA 1.0 1.8 6.0 1346 1017 A 43 VAL H A 42 GLU HBx 1.0 1.8 6.0 1347 1017 A 42 GLU HBy A 43 VAL H 1.0 1.8 6.0 1348 1018 A 45 PHE H A 42 GLU HGy 1.0 1.8 6.0 1349 1018 A 42 GLU HGx A 45 PHE H 1.0 1.8 6.0 1350 1019 A 39 ASP HA A 42 GLU H 1.0 1.8 5.0 1351 1020 A 42 GLU H A 41 VAL HG1% 1.0 1.8 5.0 1352 1021 A 42 GLU H A 41 VAL H 1.0 1.8 5.0 1353 1022 A 42 GLU H A 42 GLU HA 1.0 1.8 2.8 1354 1023 A 42 GLU HBy A 42 GLU H 1.0 1.8 5.0 1355 1024 A 42 GLU H A 43 VAL H 1.0 1.8 3.4 1356 1025 A 43 VAL HA A 11 VAL HG1% 1.0 1.8 8.0 1357 1025 A 11 VAL HG2% A 43 VAL HA 1.0 1.8 8.0 1358 1026 A 43 VAL HA A 42 GLU HBx 1.0 1.8 6.0 1359 1026 A 42 GLU HBy A 43 VAL HA 1.0 1.8 6.0 1360 1027 A 43 VAL HB A 43 VAL HA 1.0 1.8 5.0 1361 1028 A 43 VAL HA A 43 VAL HG1% 1.0 1.8 5.0 1362 1029 A 43 VAL HG2% A 43 VAL HA 1.0 1.8 5.0 1363 1030 A 43 VAL H A 43 VAL HA 1.0 1.8 2.8 1364 1031 A 43 VAL HA A 44 VAL HA 1.0 1.8 5.0 1365 1032 A 44 VAL H A 43 VAL HA 1.0 1.8 3.4 1366 1033 A 43 VAL HA A 45 PHE H 1.0 1.8 5.0 1367 1034 A 43 VAL HA A 46 ALA HA 1.0 1.8 5.0 1368 1035 A 43 VAL HA A 46 ALA H 1.0 1.8 5.0 1369 1036 A 43 VAL HA A 47 ILE H 1.0 1.8 5.0 1370 1037 A 40 VAL HA A 43 VAL HB 1.0 1.8 5.0 1371 1038 A 43 VAL HB A 43 VAL HA 1.0 1.8 2.8 1372 1039 A 43 VAL HB A 43 VAL HG1% 1.0 1.8 2.8 1373 1040 A 43 VAL HG2% A 43 VAL HB 1.0 1.8 2.8 1374 1041 A 43 VAL HB A 43 VAL H 1.0 1.8 5.0 1375 1042 A 43 VAL HB A 44 VAL H 1.0 1.8 5.0 1376 1043 A 15 PHE HD1 A 43 VAL HG1% 1.0 1.8 6.0 1377 1043 A 15 PHE HDy A 43 VAL HG1% 1.0 1.8 6.0 1378 1044 A 29 PHE HE% A 43 VAL HG1% 1.0 1.8 6.0 1379 1045 A 40 VAL HA A 43 VAL HG1% 1.0 1.8 5.0 1380 1046 A 40 VAL HG1% A 43 VAL HG1% 1.0 1.8 5.0 1381 1046 A 40 VAL HG21 A 43 VAL HG1% 1.0 1.8 5.0 1382 1047 A 42 GLU H A 43 VAL HG1% 1.0 1.8 5.0 1383 1048 A 43 VAL HA A 43 VAL HG1% 1.0 1.8 5.0 1384 1049 A 43 VAL HB A 43 VAL HG1% 1.0 1.8 2.8 1385 1050 A 43 VAL H A 43 VAL HG1% 1.0 1.8 3.4 1386 1051 A 44 VAL H A 43 VAL HG1% 1.0 1.8 5.0 1387 1052 A 43 VAL HG2% A 47 ILE HD1% 1.0 1.8 5.0 1388 1053 A 43 VAL HG2% A 40 VAL HG21 1.0 1.8 5.0 1389 1053 A 43 VAL HG2% A 40 VAL HG1% 1.0 1.8 5.0 1390 1054 A 43 VAL HG2% A 43 VAL H 1.0 1.8 5.0 1391 1055 A 43 VAL HG2% A 44 VAL HA 1.0 1.8 5.0 1392 1056 A 43 VAL HG2% A 44 VAL H 1.0 1.8 5.0 1393 1057 A 43 VAL HG2% A 46 ALA H 1.0 1.8 5.0 1394 1058 A 43 VAL HG2% A 47 ILE HD1% 1.0 1.8 5.0 1395 1059 A 15 PHE HE% A 43 VAL H 1.0 1.8 7.0 1396 1060 A 42 GLU HA A 43 VAL H 1.0 1.8 5.0 1397 1061 A 42 GLU H A 43 VAL H 1.0 1.8 5.0 1398 1062 A 43 VAL H A 43 VAL HA 1.0 1.8 2.8 1399 1063 A 43 VAL HB A 43 VAL H 1.0 1.8 5.0 1400 1064 A 43 VAL H A 43 VAL HG1% 1.0 1.8 5.0 1401 1065 A 43 VAL HG2% A 43 VAL H 1.0 1.8 5.0 1402 1066 A 43 VAL H A 44 VAL HG1% 1.0 1.8 5.0 1403 1066 A 44 VAL HG2% A 43 VAL H 1.0 1.8 5.0 1404 1067 A 44 VAL H A 43 VAL H 1.0 1.8 5.0 1405 1068 A 43 VAL HA A 44 VAL HA 1.0 1.8 5.0 1406 1069 A 43 VAL HG2% A 44 VAL HA 1.0 1.8 5.0 1407 1070 A 44 VAL HA A 44 VAL HB 1.0 1.8 5.0 1408 1071 A 44 VAL H A 44 VAL HA 1.0 1.8 2.8 1409 1072 A 44 VAL HA A 48 GLU H 1.0 1.8 5.0 1410 1073 A 44 VAL HB A 60 ALA HB% 1.0 1.8 7.0 1411 1074 A 60 ALA HB% A 44 VAL HG1% 1.0 1.8 7.0 1412 1075 A 41 VAL HA A 44 VAL HG1% 1.0 1.8 5.0 1413 1076 A 43 VAL H A 44 VAL HG1% 1.0 1.8 5.0 1414 1077 A 44 VAL HA A 44 VAL HG1% 1.0 1.8 5.0 1415 1078 A 44 VAL HB A 44 VAL HG1% 1.0 1.8 2.8 1416 1079 A 44 VAL H A 44 VAL HG1% 1.0 1.8 5.0 1417 1080 A 45 PHE H A 44 VAL HG1% 1.0 1.8 5.0 1418 1081 A 60 ALA HB% A 44 VAL HG1% 1.0 1.8 7.0 1419 1082 A 44 VAL HG2% A 44 VAL HB 1.0 1.8 2.8 1420 1083 A 43 VAL HB A 44 VAL H 1.0 1.8 5.0 1421 1084 A 44 VAL H A 43 VAL HG1% 1.0 1.8 5.0 1422 1085 A 43 VAL HG2% A 44 VAL H 1.0 1.8 5.0 1423 1086 A 44 VAL H A 43 VAL H 1.0 1.8 5.0 1424 1087 A 44 VAL H A 44 VAL HA 1.0 1.8 2.8 1425 1088 A 44 VAL H A 44 VAL HB 1.0 1.8 5.0 1426 1089 A 44 VAL H A 44 VAL HG1% 1.0 1.8 5.0 1427 1090 A 44 VAL H A 44 VAL HG2% 1.0 1.8 5.0 1428 1091 A 44 VAL H A 45 PHE HD1 1.0 1.8 6.0 1429 1091 A 44 VAL H A 45 PHE HDy 1.0 1.8 6.0 1430 1092 A 40 VAL HA A 44 VAL H 1.0 1.8 5.0 1431 1093 A 45 PHE HA A 45 PHE HBy 1.0 1.8 5.0 1432 1094 A 45 PHE HA A 45 PHE HD1 1.0 1.8 6.0 1433 1094 A 45 PHE HA A 45 PHE HDy 1.0 1.8 6.0 1434 1095 A 45 PHE H A 45 PHE HA 1.0 1.8 2.8 1435 1096 A 46 ALA HA A 45 PHE HA 1.0 1.8 5.0 1436 1097 A 46 ALA H A 45 PHE HA 1.0 1.8 3.4 1437 1098 A 45 PHE HA A 48 GLU HGx 1.0 1.8 6.0 1438 1098 A 45 PHE HA A 48 GLU HGy 1.0 1.8 6.0 1439 1099 A 45 PHE HA A 45 PHE HBy 1.0 1.8 5.0 1440 1100 A 45 PHE HBy A 45 PHE HDy 1.0 1.8 7.0 1441 1100 A 45 PHE HB2 A 45 PHE HD1 1.0 1.8 7.0 1442 1100 A 45 PHE HB2 A 45 PHE HDy 1.0 1.8 7.0 1443 1100 A 45 PHE HD1 A 45 PHE HBy 1.0 1.8 7.0 1444 1101 A 45 PHE H A 45 PHE HBy 1.0 1.8 5.0 1445 1101 A 45 PHE H A 45 PHE HB2 1.0 1.8 5.0 1446 1102 A 46 ALA HA A 45 PHE HBy 1.0 1.8 6.0 1447 1102 A 46 ALA HA A 45 PHE HB2 1.0 1.8 6.0 1448 1103 A 46 ALA H A 45 PHE HBy 1.0 1.8 6.0 1449 1103 A 46 ALA H A 45 PHE HB2 1.0 1.8 6.0 1450 1104 A 41 VAL HG2% A 45 PHE HD1 1.0 1.8 7.0 1451 1104 A 41 VAL HG1% A 45 PHE HDy 1.0 1.8 7.0 1452 1104 A 41 VAL HG2% A 45 PHE HDy 1.0 1.8 7.0 1453 1104 A 45 PHE HD1 A 41 VAL HG1% 1.0 1.8 7.0 1454 1105 A 44 VAL HB A 45 PHE HD1 1.0 1.8 6.0 1455 1105 A 44 VAL HB A 45 PHE HDy 1.0 1.8 6.0 1456 1106 A 45 PHE HA A 45 PHE HD1 1.0 1.8 6.0 1457 1106 A 45 PHE HA A 45 PHE HDy 1.0 1.8 6.0 1458 1107 A 45 PHE HBy A 45 PHE HDy 1.0 1.8 5.4 1459 1107 A 45 PHE HB2 A 45 PHE HD1 1.0 1.8 5.4 1460 1107 A 45 PHE HB2 A 45 PHE HDy 1.0 1.8 5.4 1461 1107 A 45 PHE HD1 A 45 PHE HBy 1.0 1.8 5.4 1462 1108 A 45 PHE H A 45 PHE HD1 1.0 1.8 6.0 1463 1108 A 45 PHE H A 45 PHE HDy 1.0 1.8 6.0 1464 1109 A 45 PHE H A 45 PHE HBy 1.0 1.8 6.0 1465 1109 A 45 PHE H A 45 PHE HB2 1.0 1.8 6.0 1466 1110 A 45 PHE H A 46 ALA H 1.0 1.8 5.0 1467 1111 A 41 VAL HA A 45 PHE H 1.0 1.8 5.0 1468 1112 A 46 ALA HB% A 46 ALA HA 1.0 1.8 5.0 1469 1113 A 46 ALA HA A 46 ALA H 1.0 1.8 2.8 1470 1114 A 46 ALA HA A 47 ILE H 1.0 1.8 3.4 1471 1115 A 46 ALA HB% A 11 VAL HG1% 1.0 1.8 6.0 1472 1116 A 46 ALA HB% A 46 ALA HA 1.0 1.8 5.0 1473 1117 A 46 ALA HB% A 46 ALA H 1.0 1.8 5.0 1474 1118 A 46 ALA HB% A 47 ILE HA 1.0 1.8 5.0 1475 1119 A 46 ALA HB% A 47 ILE H 1.0 1.8 5.0 1476 1120 A 42 GLU HA A 46 ALA H 1.0 1.8 5.0 1477 1121 A 46 ALA H A 45 PHE HA 1.0 1.8 5.0 1478 1122 A 46 ALA H A 45 PHE HBy 1.0 1.8 6.0 1479 1122 A 46 ALA H A 45 PHE HB2 1.0 1.8 6.0 1480 1123 A 46 ALA H A 45 PHE HD1 1.0 1.8 5.0 1481 1124 A 45 PHE H A 46 ALA H 1.0 1.8 3.4 1482 1125 A 46 ALA HA A 46 ALA H 1.0 1.8 2.8 1483 1126 A 46 ALA H A 47 ILE H 1.0 1.8 5.0 1484 1127 A 46 ALA H A 48 GLU H 1.0 1.8 5.0 1485 1128 A 47 ILE HD1% A 47 ILE HA 1.0 1.8 5.0 1486 1129 A 47 ILE HA A 47 ILE HG1x 1.0 1.8 5.0 1487 1130 A 47 ILE H A 47 ILE HA 1.0 1.8 2.8 1488 1131 A 47 ILE HA A 51 PHE HD1 1.0 1.8 6.0 1489 1131 A 47 ILE HA A 51 PHE HDy 1.0 1.8 6.0 1490 1132 A 47 ILE HB A 47 ILE HG1x 1.0 1.8 2.8 1491 1133 A 47 ILE H A 47 ILE HB 1.0 1.8 5.0 1492 1134 A 47 ILE HB A 51 PHE HD1 1.0 1.8 6.0 1493 1134 A 47 ILE HB A 51 PHE HDy 1.0 1.8 6.0 1494 1135 A 47 ILE HD1% A 11 VAL HG1% 1.0 1.8 7.0 1495 1135 A 11 VAL HG2% A 47 ILE HD1% 1.0 1.8 7.0 1496 1136 A 44 VAL HA A 47 ILE HD1% 1.0 1.8 5.0 1497 1137 A 47 ILE HD1% A 47 ILE HA 1.0 1.8 5.0 1498 1138 A 47 ILE HD1% A 47 ILE HB 1.0 1.8 5.0 1499 1139 A 47 ILE HD1% A 47 ILE HG1x 1.0 1.8 2.8 1500 1140 A 47 ILE H A 47 ILE HD1% 1.0 1.8 5.0 1501 1141 A 8 VAL HA A 47 ILE HD1% 1.0 1.8 7.0 1502 1142 A 47 ILE HD1% A 47 ILE HG1x 1.0 1.8 2.8 1503 1143 A 47 ILE H A 47 ILE HG1x 1.0 1.8 5.0 1504 1144 A 51 PHE HD1 A 47 ILE HG1x 1.0 1.8 6.0 1505 1144 A 47 ILE HG1x A 51 PHE HDy 1.0 1.8 6.0 1506 1145 A 51 PHE HE% A 47 ILE HG1x 1.0 1.8 6.0 1507 1146 A 43 VAL HA A 47 ILE H 1.0 1.8 5.0 1508 1147 A 46 ALA HA A 47 ILE H 1.0 1.8 5.0 1509 1148 A 46 ALA HB% A 47 ILE H 1.0 1.8 5.0 1510 1149 A 46 ALA H A 47 ILE H 1.0 1.8 5.0 1511 1150 A 47 ILE H A 47 ILE HA 1.0 1.8 2.8 1512 1151 A 47 ILE H A 47 ILE HB 1.0 1.8 5.0 1513 1152 A 47 ILE H A 47 ILE HD1% 1.0 1.8 5.0 1514 1153 A 47 ILE H A 47 ILE HG1x 1.0 1.8 5.0 1515 1154 A 47 ILE H A 48 GLU H 1.0 1.8 5.0 1516 1155 A 48 GLU HA A 47 ILE HG1x 1.0 1.8 5.0 1517 1156 A 48 GLU HA A 48 GLU HB3 1.0 1.8 5.0 1518 1157 A 48 GLU HA A 48 GLU HGx 1.0 1.8 6.0 1519 1157 A 48 GLU HGy A 48 GLU HA 1.0 1.8 6.0 1520 1158 A 48 GLU HA A 49 GLN H 1.0 1.8 3.4 1521 1159 A 48 GLU HA A 48 GLU HB3 1.0 1.8 5.0 1522 1160 A 45 PHE HA A 48 GLU HB3 1.0 1.8 6.0 1523 1160 A 45 PHE HA A 48 GLU HB2 1.0 1.8 6.0 1524 1161 A 46 ALA HA A 48 GLU HB3 1.0 1.8 6.0 1525 1161 A 46 ALA HA A 48 GLU HB2 1.0 1.8 6.0 1526 1162 A 48 GLU HB2 A 49 GLN HBy 1.0 1.8 7.0 1527 1162 A 48 GLU HB3 A 49 GLN HBy 1.0 1.8 7.0 1528 1162 A 49 GLN HBx A 48 GLU HB3 1.0 1.8 7.0 1529 1162 A 48 GLU HB2 A 49 GLN HBx 1.0 1.8 7.0 1530 1163 A 49 GLN H A 48 GLU HB3 1.0 1.8 6.0 1531 1163 A 49 GLN H A 48 GLU HB2 1.0 1.8 6.0 1532 1164 A 44 VAL HG2% A 48 GLU HGx 1.0 1.8 7.0 1533 1164 A 44 VAL HG1% A 48 GLU HGx 1.0 1.8 7.0 1534 1164 A 48 GLU HGy A 44 VAL HG1% 1.0 1.8 7.0 1535 1164 A 44 VAL HG2% A 48 GLU HGy 1.0 1.8 7.0 1536 1165 A 45 PHE HDy A 48 GLU HGx 1.0 1.8 7.0 1537 1165 A 48 GLU HGy A 45 PHE HD1 1.0 1.8 7.0 1538 1165 A 48 GLU HGy A 45 PHE HDy 1.0 1.8 7.0 1539 1165 A 45 PHE HD1 A 48 GLU HGx 1.0 1.8 7.0 1540 1166 A 48 GLU HA A 48 GLU HGx 1.0 1.8 6.0 1541 1166 A 48 GLU HGy A 48 GLU HA 1.0 1.8 6.0 1542 1167 A 48 GLU HGy A 48 GLU HB3 1.0 1.8 2.8 1543 1167 A 48 GLU HB3 A 48 GLU HGx 1.0 1.8 2.8 1544 1168 A 55 ILE HB A 48 GLU HGx 1.0 1.8 6.0 1545 1168 A 48 GLU HGy A 55 ILE HB 1.0 1.8 6.0 1546 1169 A 44 VAL HA A 48 GLU H 1.0 1.8 5.0 1547 1170 A 46 ALA HA A 48 GLU H 1.0 1.8 5.0 1548 1171 A 48 GLU H A 47 ILE HA 1.0 1.8 5.0 1549 1172 A 48 GLU H A 47 ILE HB 1.0 1.8 5.0 1550 1173 A 48 GLU H A 47 ILE HG1x 1.0 1.8 5.0 1551 1174 A 47 ILE H A 48 GLU H 1.0 1.8 5.0 1552 1175 A 48 GLU H A 48 GLU HA 1.0 1.8 2.8 1553 1176 A 48 GLU H A 48 GLU HB2 1.0 1.8 5.0 1554 1177 A 48 GLU H A 48 GLU HGx 1.0 1.8 6.0 1555 1177 A 48 GLU H A 48 GLU HGy 1.0 1.8 6.0 1556 1178 A 48 GLU H A 49 GLN H 1.0 1.8 5.0 1557 1179 A 48 GLU H A 55 ILE HG1x 1.0 1.8 6.0 1558 1179 A 48 GLU H A 55 ILE HG2% 1.0 1.8 6.0 1559 1179 A 48 GLU H A 55 ILE HG1y 1.0 1.8 6.0 1560 1180 A 49 GLN H A 49 GLN HA 1.0 1.8 2.8 1561 1181 A 49 GLN HE21 A 48 GLU HB3 1.0 1.8 6.0 1562 1181 A 48 GLU HB2 A 49 GLN HE21 1.0 1.8 6.0 1563 1182 A 49 GLN HA A 49 GLN HE21 1.0 1.8 5.0 1564 1183 A 49 GLN HE21 A 49 GLN HBy 1.0 1.8 6.0 1565 1183 A 49 GLN HBx A 49 GLN HE21 1.0 1.8 6.0 1566 1184 A 49 GLN H A 49 GLN HE21 1.0 1.8 5.0 1567 1185 A 45 PHE HA A 49 GLN H 1.0 1.8 5.0 1568 1186 A 46 ALA HA A 49 GLN H 1.0 1.8 5.0 1569 1187 A 49 GLN H A 48 GLU HB3 1.0 1.8 6.0 1570 1187 A 49 GLN H A 48 GLU HB2 1.0 1.8 6.0 1571 1188 A 48 GLU H A 49 GLN H 1.0 1.8 5.0 1572 1189 A 49 GLN H A 49 GLN HBy 1.0 1.8 6.0 1573 1189 A 49 GLN H A 49 GLN HBx 1.0 1.8 6.0 1574 1190 A 49 GLN H A 50 GLU H 1.0 1.8 5.0 1575 1191 A 50 GLU HA A 50 GLU HBy 1.0 1.8 5.0 1576 1192 A 50 GLU H A 50 GLU HA 1.0 1.8 2.8 1577 1193 A 50 GLU HA A 51 PHE H 1.0 1.8 3.4 1578 1194 A 50 GLU HA A 50 GLU HBy 1.0 1.8 5.0 1579 1195 A 49 GLN H A 50 GLU HBy 1.0 1.8 6.0 1580 1195 A 49 GLN H A 50 GLU HB2 1.0 1.8 6.0 1581 1196 A 50 GLU H A 50 GLU HBy 1.0 1.8 6.0 1582 1196 A 50 GLU H A 50 GLU HB2 1.0 1.8 6.0 1583 1197 A 51 PHE HE% A 50 GLU HBy 1.0 1.8 7.0 1584 1197 A 51 PHE HE% A 50 GLU HB2 1.0 1.8 7.0 1585 1198 A 51 PHE H A 50 GLU HBy 1.0 1.8 6.0 1586 1198 A 51 PHE H A 50 GLU HB2 1.0 1.8 6.0 1587 1199 A 4 VAL HG1% A 50 GLU HGy 1.0 1.8 7.0 1588 1200 A 50 GLU HGx A 4 VAL HG1% 1.0 1.8 7.0 1589 1200 A 4 VAL HG1% A 50 GLU HGy 1.0 1.8 7.0 1590 1201 A 46 ALA HA A 50 GLU H 1.0 1.8 6.0 1591 1202 A 49 GLN H A 50 GLU H 1.0 1.8 5.0 1592 1203 A 50 GLU H A 50 GLU HA 1.0 1.8 2.8 1593 1204 A 50 GLU H A 50 GLU HBy 1.0 1.8 6.0 1594 1204 A 50 GLU H A 50 GLU HB2 1.0 1.8 6.0 1595 1205 A 50 GLU H A 51 PHE H 1.0 1.8 5.0 1596 1206 A 51 PHE HA A 51 PHE HBx 1.0 1.8 5.0 1597 1207 A 51 PHE HA A 51 PHE HBy 1.0 1.8 5.0 1598 1208 A 51 PHE HA A 51 PHE HD1 1.0 1.8 6.0 1599 1208 A 51 PHE HA A 51 PHE HDy 1.0 1.8 6.0 1600 1209 A 51 PHE H A 51 PHE HA 1.0 1.8 2.8 1601 1210 A 51 PHE HA A 51 PHE HBx 1.0 1.8 5.0 1602 1211 A 51 PHE HD1 A 51 PHE HBx 1.0 1.8 5.0 1603 1211 A 51 PHE HBx A 51 PHE HDy 1.0 1.8 5.0 1604 1212 A 51 PHE H A 51 PHE HBx 1.0 1.8 5.0 1605 1213 A 51 PHE HA A 51 PHE HBy 1.0 1.8 5.0 1606 1214 A 51 PHE HBy A 51 PHE HD1 1.0 1.8 5.0 1607 1214 A 51 PHE HBy A 51 PHE HDy 1.0 1.8 5.0 1608 1215 A 51 PHE H A 51 PHE HBy 1.0 1.8 5.0 1609 1216 A 52 ILE HD1% A 51 PHE HBx 1.0 1.8 6.0 1610 1216 A 51 PHE HBy A 52 ILE HD1% 1.0 1.8 6.0 1611 1217 A 51 PHE HBy A 73 ILE HG1y 1.0 1.8 7.0 1612 1217 A 51 PHE HBx A 73 ILE HG1y 1.0 1.8 7.0 1613 1218 A 47 ILE HA A 51 PHE HD1 1.0 1.8 6.0 1614 1218 A 47 ILE HA A 51 PHE HDy 1.0 1.8 6.0 1615 1219 A 50 GLU HA A 51 PHE HD1 1.0 1.8 6.0 1616 1219 A 50 GLU HA A 51 PHE HDy 1.0 1.8 6.0 1617 1220 A 51 PHE HA A 51 PHE HD1 1.0 1.8 6.0 1618 1220 A 51 PHE HA A 51 PHE HDy 1.0 1.8 6.0 1619 1221 A 51 PHE HD1 A 51 PHE HBx 1.0 1.8 6.0 1620 1221 A 51 PHE HBx A 51 PHE HDy 1.0 1.8 6.0 1621 1222 A 51 PHE HBy A 51 PHE HD1 1.0 1.8 6.0 1622 1222 A 51 PHE HBy A 51 PHE HDy 1.0 1.8 6.0 1623 1223 A 51 PHE HE% A 51 PHE HD1 1.0 1.8 7.0 1624 1223 A 51 PHE HE% A 51 PHE HDy 1.0 1.8 7.0 1625 1224 A 51 PHE H A 51 PHE HD1 1.0 1.8 6.0 1626 1224 A 51 PHE H A 51 PHE HDy 1.0 1.8 6.0 1627 1225 A 73 ILE HD1% A 51 PHE HD1 1.0 1.8 7.0 1628 1225 A 73 ILE HD1% A 51 PHE HDy 1.0 1.8 7.0 1629 1226 A 51 PHE HD1 A 73 ILE HG2% 1.0 1.8 7.0 1630 1226 A 73 ILE HG2% A 51 PHE HDy 1.0 1.8 7.0 1631 1227 A 51 PHE HD1 A 77 PRO HBx 1.0 1.8 8.0 1632 1227 A 51 PHE HD1 A 77 PRO HBy 1.0 1.8 8.0 1633 1228 A 7 ARG HD2 A 51 PHE HDy 1.0 1.8 7.0 1634 1228 A 7 ARG HDy A 51 PHE HDy 1.0 1.8 7.0 1635 1228 A 7 ARG HDy A 51 PHE HD1 1.0 1.8 7.0 1636 1228 A 51 PHE HD1 A 7 ARG HD2 1.0 1.8 7.0 1637 1229 A 51 PHE HD1 A 80 LYS HD2 1.0 1.8 7.0 1638 1229 A 80 LYS HD2 A 51 PHE HDy 1.0 1.8 7.0 1639 1230 A 51 PHE HD1 A 80 LYS HGy 1.0 1.8 8.0 1640 1230 A 51 PHE HD1 A 80 LYS HG2 1.0 1.8 8.0 1641 1230 A 80 LYS HGy A 51 PHE HDy 1.0 1.8 8.0 1642 1230 A 51 PHE HDy A 80 LYS HG2 1.0 1.8 8.0 1643 1231 A 50 GLU HA A 51 PHE H 1.0 1.8 5.0 1644 1232 A 51 PHE H A 50 GLU HBy 1.0 1.8 6.0 1645 1232 A 51 PHE H A 50 GLU HB2 1.0 1.8 6.0 1646 1233 A 51 PHE H A 51 PHE HA 1.0 1.8 2.8 1647 1234 A 51 PHE H A 51 PHE HBx 1.0 1.8 5.0 1648 1235 A 51 PHE H A 51 PHE HBy 1.0 1.8 5.0 1649 1236 A 51 PHE H A 52 ILE H 1.0 1.8 5.0 1650 1237 A 47 ILE HA A 51 PHE H 1.0 2.2 5.4 1651 1238 A 52 ILE HA A 52 ILE HB 1.0 1.8 5.0 1652 1239 A 52 ILE HD1% A 52 ILE HA 1.0 1.8 5.0 1653 1240 A 52 ILE HA A 52 ILE HG1x 1.0 1.8 5.0 1654 1241 A 52 ILE HA A 52 ILE HG2% 1.0 1.8 5.0 1655 1242 A 52 ILE H A 52 ILE HA 1.0 1.8 2.8 1656 1243 A 52 ILE HA A 53 LEU H 1.0 1.8 3.4 1657 1244 A 52 ILE HA A 52 ILE HB 1.0 1.8 5.0 1658 1245 A 52 ILE HD1% A 52 ILE HB 1.0 1.8 5.0 1659 1246 A 52 ILE HB A 52 ILE HG1x 1.0 1.8 2.8 1660 1247 A 52 ILE HB A 52 ILE HG2% 1.0 1.8 2.8 1661 1248 A 52 ILE H A 52 ILE HB 1.0 1.8 5.0 1662 1249 A 52 ILE HD1% A 52 ILE HA 1.0 1.8 5.0 1663 1250 A 52 ILE HD1% A 52 ILE HG1x 1.0 1.8 3.4 1664 1251 A 52 ILE HD1% A 53 LEU HBy 1.0 1.8 6.0 1665 1251 A 52 ILE HD1% A 53 LEU HBx 1.0 1.8 6.0 1666 1252 A 52 ILE HA A 52 ILE HG1x 1.0 1.8 5.0 1667 1253 A 52 ILE HB A 52 ILE HG1x 1.0 1.8 5.0 1668 1254 A 52 ILE HD1% A 52 ILE HG1x 1.0 1.8 3.4 1669 1255 A 52 ILE H A 52 ILE HG1x 1.0 1.8 5.0 1670 1256 A 52 ILE HG1x A 53 LEU H 1.0 1.8 5.0 1671 1257 A 51 PHE H A 52 ILE H 1.0 1.8 5.0 1672 1258 A 52 ILE H A 52 ILE HA 1.0 1.8 2.8 1673 1259 A 52 ILE H A 52 ILE HB 1.0 1.8 5.0 1674 1260 A 52 ILE H A 52 ILE HG1x 1.0 1.8 5.0 1675 1261 A 52 ILE H A 53 LEU HBy 1.0 1.8 6.0 1676 1261 A 52 ILE H A 53 LEU HBx 1.0 1.8 6.0 1677 1262 A 52 ILE H A 53 LEU H 1.0 1.8 3.4 1678 1263 A 53 LEU HBx A 53 LEU HA 1.0 1.8 5.0 1679 1264 A 53 LEU H A 53 LEU HA 1.0 1.8 2.8 1680 1265 A 53 LEU HA A 54 ASP H 1.0 1.8 3.4 1681 1266 A 53 LEU HBx A 53 LEU HA 1.0 1.8 5.0 1682 1267 A 53 LEU H A 53 LEU HBx 1.0 1.8 5.0 1683 1268 A 53 LEU HBx A 54 ASP H 1.0 1.8 5.0 1684 1269 A 53 LEU HA A 53 LEU HBy 1.0 1.8 5.0 1685 1270 A 53 LEU H A 53 LEU HBy 1.0 1.8 5.0 1686 1271 A 54 ASP H A 53 LEU HBy 1.0 1.8 5.0 1687 1272 A 54 ASP H A 53 LEU HBy 1.0 1.8 5.0 1688 1273 A 52 ILE HD1% A 53 LEU HBy 1.0 1.8 6.0 1689 1273 A 52 ILE HD1% A 53 LEU HBx 1.0 1.8 6.0 1690 1274 A 54 ASP H A 53 LEU HD1% 1.0 1.8 5.0 1691 1275 A 51 PHE H A 53 LEU H 1.0 1.8 5.0 1692 1276 A 52 ILE HA A 53 LEU H 1.0 1.8 5.0 1693 1277 A 52 ILE HB A 53 LEU H 1.0 1.8 5.0 1694 1278 A 52 ILE H A 53 LEU H 1.0 1.8 3.4 1695 1279 A 53 LEU H A 53 LEU HA 1.0 1.8 2.8 1696 1280 A 53 LEU H A 53 LEU HBx 1.0 1.8 5.0 1697 1281 A 53 LEU H A 53 LEU HBy 1.0 1.8 5.0 1698 1282 A 54 ASP HA A 54 ASP HBx 1.0 1.8 5.0 1699 1283 A 54 ASP HA A 54 ASP HBy 1.0 1.8 5.0 1700 1284 A 54 ASP H A 54 ASP HA 1.0 1.8 2.8 1701 1285 A 55 ILE HB A 54 ASP HA 1.0 1.8 5.0 1702 1286 A 54 ASP HA A 55 ILE H 1.0 1.8 2.8 1703 1287 A 54 ASP HA A 54 ASP HBx 1.0 1.8 5.0 1704 1288 A 54 ASP H A 54 ASP HBx 1.0 1.8 5.0 1705 1289 A 54 ASP HA A 54 ASP HBy 1.0 1.8 5.0 1706 1290 A 54 ASP H A 54 ASP HBy 1.0 1.8 5.0 1707 1291 A 53 LEU HBy A 54 ASP HBy 1.0 1.8 7.0 1708 1291 A 53 LEU HBx A 54 ASP HBy 1.0 1.8 7.0 1709 1291 A 54 ASP HBx A 53 LEU HBy 1.0 1.8 7.0 1710 1291 A 53 LEU HBx A 54 ASP HBx 1.0 1.8 7.0 1711 1292 A 55 ILE H A 54 ASP HBy 1.0 1.8 4.4 1712 1292 A 55 ILE H A 54 ASP HBx 1.0 1.8 4.4 1713 1293 A 53 LEU HA A 54 ASP H 1.0 1.8 5.0 1714 1294 A 54 ASP H A 53 LEU HBy 1.0 1.8 6.0 1715 1294 A 53 LEU HBx A 54 ASP H 1.0 1.8 6.0 1716 1295 A 54 ASP H A 54 ASP HA 1.0 1.8 2.8 1717 1296 A 54 ASP H A 54 ASP HBx 1.0 1.8 5.0 1718 1297 A 54 ASP H A 54 ASP HBy 1.0 1.8 5.0 1719 1298 A 54 ASP H A 55 ILE H 1.0 1.8 5.0 1720 1299 A 55 ILE HA A 54 ASP HBy 1.0 1.8 6.0 1721 1299 A 54 ASP HBx A 55 ILE HA 1.0 1.8 6.0 1722 1300 A 55 ILE HB A 55 ILE HA 1.0 1.8 5.0 1723 1301 A 55 ILE H A 55 ILE HA 1.0 1.6 3.2 1724 1302 A 55 ILE HB A 54 ASP HA 1.0 1.8 5.0 1725 1303 A 55 ILE HB A 55 ILE HA 1.0 1.8 5.0 1726 1304 A 55 ILE HB A 55 ILE H 1.0 1.8 5.0 1727 1305 A 55 ILE HD1% A 72 TYR HE% 1.0 1.8 6.0 1728 1306 A 55 ILE H A 48 GLU HGx 1.0 1.8 5.0 1729 1307 A 48 GLU HGy A 55 ILE H 1.0 1.8 5.0 1730 1308 A 55 ILE H A 54 ASP HBx 1.0 1.8 5.0 1731 1309 A 55 ILE H A 54 ASP HBy 1.0 1.8 5.0 1732 1310 A 54 ASP H A 55 ILE H 1.0 1.8 5.0 1733 1311 A 55 ILE H A 55 ILE HA 1.0 1.8 2.8 1734 1312 A 55 ILE HB A 55 ILE H 1.0 1.8 5.0 1735 1313 A 55 ILE H A 55 ILE HG1x 1.0 1.8 5.0 1736 1314 A 56 PRO HBx A 57 ASP H 1.0 1.8 5.0 1737 1315 A 57 ASP H A 56 PRO HBy 1.0 1.8 5.0 1738 1316 A 57 ASP HA A 57 ASP HBx 1.0 1.8 5.0 1739 1317 A 57 ASP H A 57 ASP HA 1.0 1.8 2.8 1740 1318 A 57 ASP HA A 58 HIS HD2 1.0 1.8 5.0 1741 1319 A 57 ASP H A 57 ASP HBy 1.0 1.8 6.0 1742 1319 A 57 ASP H A 57 ASP HBx 1.0 1.8 6.0 1743 1320 A 57 ASP H A 56 PRO HA 1.0 1.8 5.0 1744 1321 A 56 PRO HBx A 57 ASP H 1.0 1.8 5.0 1745 1322 A 57 ASP H A 56 PRO HBy 1.0 1.8 5.0 1746 1323 A 57 ASP H A 56 PRO HG2 1.0 1.8 6.0 1747 1323 A 57 ASP H A 56 PRO HGy 1.0 1.8 6.0 1748 1324 A 57 ASP H A 57 ASP HBx 1.0 1.8 5.0 1749 1325 A 57 ASP H A 57 ASP HBy 1.0 1.8 5.0 1750 1326 A 58 HIS HA A 58 HIS HBx 1.0 1.8 5.0 1751 1327 A 58 HIS HA A 58 HIS H 1.0 1.8 2.8 1752 1328 A 58 HIS HA A 58 HIS HBx 1.0 1.8 2.8 1753 1329 A 58 HIS H A 58 HIS HBx 1.0 1.8 6.0 1754 1329 A 58 HIS H A 58 HIS HBy 1.0 1.8 6.0 1755 1330 A 59 ASP H A 58 HIS HBx 1.0 1.8 6.0 1756 1330 A 58 HIS HBy A 59 ASP H 1.0 1.8 6.0 1757 1331 A 57 ASP H A 58 HIS H 1.0 1.8 5.0 1758 1332 A 58 HIS HA A 58 HIS H 1.0 1.8 2.8 1759 1333 A 58 HIS H A 59 ASP H 1.0 1.8 5.0 1760 1334 A 58 HIS H A 61 GLU H 1.0 1.8 5.0 1761 1335 A 59 ASP HA A 59 ASP HBx 1.0 1.8 5.0 1762 1336 A 59 ASP HA A 59 ASP HBy 1.0 1.8 5.0 1763 1337 A 59 ASP H A 59 ASP HA 1.0 1.8 2.8 1764 1338 A 59 ASP HA A 59 ASP HBx 1.0 1.8 5.0 1765 1339 A 59 ASP H A 59 ASP HBx 1.0 1.8 5.0 1766 1340 A 60 ALA H A 59 ASP HBx 1.0 1.8 5.0 1767 1341 A 59 ASP H A 59 ASP HBy 1.0 1.8 5.0 1768 1342 A 60 ALA H A 59 ASP HBy 1.0 1.8 5.0 1769 1343 A 72 TYR HE% A 59 ASP HBy 1.0 1.8 9.0 1770 1343 A 72 TYR HE% A 59 ASP HBx 1.0 1.8 9.0 1771 1344 A 59 ASP H A 58 HIS HBx 1.0 1.8 6.0 1772 1344 A 58 HIS HBy A 59 ASP H 1.0 1.8 6.0 1773 1345 A 58 HIS H A 59 ASP H 1.0 1.8 5.0 1774 1346 A 59 ASP H A 59 ASP HA 1.0 1.8 2.8 1775 1347 A 59 ASP H A 59 ASP HBx 1.0 1.8 5.0 1776 1348 A 59 ASP H A 59 ASP HBy 1.0 1.8 5.0 1777 1349 A 60 ALA HB% A 59 ASP H 1.0 1.8 5.0 1778 1350 A 59 ASP H A 60 ALA H 1.0 1.8 5.0 1779 1351 A 59 ASP H A 61 GLU HB3 1.0 1.8 7.0 1780 1351 A 59 ASP H A 61 GLU HB2 1.0 1.8 7.0 1781 1352 A 60 ALA HB% A 60 ALA HA 1.0 1.8 5.0 1782 1353 A 61 GLU H A 60 ALA HA 1.0 1.8 3.4 1783 1354 A 60 ALA HB% A 40 VAL HG1% 1.0 1.8 9.0 1784 1354 A 40 VAL HG21 A 60 ALA HB% 1.0 1.8 9.0 1785 1355 A 60 ALA HB% A 44 VAL HG1% 1.0 1.8 7.0 1786 1355 A 44 VAL HG2% A 60 ALA HB% 1.0 1.8 7.0 1787 1356 A 60 ALA HB% A 59 ASP H 1.0 1.8 5.0 1788 1357 A 60 ALA HB% A 60 ALA HA 1.0 1.8 5.0 1789 1358 A 60 ALA HB% A 61 GLU HA 1.0 1.8 5.0 1790 1359 A 60 ALA HB% A 61 GLU HG2 1.0 1.8 6.0 1791 1359 A 60 ALA HB% A 61 GLU HG3 1.0 1.8 6.0 1792 1360 A 60 ALA HB% A 61 GLU H 1.0 1.8 5.0 1793 1361 A 60 ALA H A 55 ILE HG2% 1.0 1.8 6.0 1794 1362 A 59 ASP HA A 60 ALA H 1.0 1.8 5.0 1795 1363 A 60 ALA H A 59 ASP HBx 1.0 1.8 5.0 1796 1364 A 60 ALA H A 59 ASP HBy 1.0 1.8 5.0 1797 1365 A 59 ASP H A 60 ALA H 1.0 1.8 5.0 1798 1366 A 60 ALA H A 60 ALA HA 1.0 1.8 2.8 1799 1367 A 60 ALA H A 61 GLU HB3 1.0 1.8 6.0 1800 1367 A 60 ALA H A 61 GLU HB2 1.0 1.8 6.0 1801 1368 A 61 GLU H A 60 ALA H 1.0 1.8 5.0 1802 1369 A 60 ALA HA A 61 GLU HA 1.0 1.8 5.0 1803 1370 A 60 ALA HB% A 61 GLU HA 1.0 1.8 5.0 1804 1371 A 61 GLU HA A 61 GLU HB3 1.0 1.8 5.0 1805 1372 A 61 GLU HA A 61 GLU HG2 1.0 1.8 6.0 1806 1372 A 61 GLU HA A 61 GLU HG3 1.0 1.8 6.0 1807 1373 A 61 GLU H A 61 GLU HA 1.0 1.8 2.8 1808 1374 A 61 GLU HA A 62 LYS H 1.0 1.8 5.0 1809 1375 A 61 GLU HA A 61 GLU HB3 1.0 1.8 2.8 1810 1376 A 61 GLU HG3 A 61 GLU HB3 1.0 1.8 3.8 1811 1376 A 61 GLU HB3 A 61 GLU HG2 1.0 1.8 3.8 1812 1377 A 61 GLU H A 61 GLU HB3 1.0 1.8 6.0 1813 1377 A 61 GLU H A 61 GLU HB2 1.0 1.8 6.0 1814 1378 A 61 GLU HB2 A 62 LYS HG2 1.0 1.8 7.0 1815 1378 A 61 GLU HB3 A 62 LYS HG2 1.0 1.8 7.0 1816 1378 A 62 LYS HG3 A 61 GLU HB3 1.0 1.8 7.0 1817 1378 A 61 GLU HB2 A 62 LYS HG3 1.0 1.8 7.0 1818 1379 A 61 GLU HA A 61 GLU HG2 1.0 1.8 6.0 1819 1379 A 61 GLU HA A 61 GLU HG3 1.0 1.8 6.0 1820 1380 A 61 GLU HG3 A 61 GLU HB3 1.0 1.8 3.8 1821 1380 A 61 GLU HB3 A 61 GLU HG2 1.0 1.8 3.8 1822 1381 A 61 GLU H A 61 GLU HG2 1.0 1.8 6.0 1823 1381 A 61 GLU H A 61 GLU HG3 1.0 1.8 6.0 1824 1382 A 61 GLU HG3 A 62 LYS HG2 1.0 1.8 7.0 1825 1382 A 61 GLU HG2 A 62 LYS HG2 1.0 1.8 7.0 1826 1382 A 62 LYS HG3 A 61 GLU HG2 1.0 1.8 7.0 1827 1382 A 61 GLU HG3 A 62 LYS HG3 1.0 1.8 7.0 1828 1383 A 62 LYS H A 61 GLU HG2 1.0 1.8 6.0 1829 1383 A 61 GLU HG3 A 62 LYS H 1.0 1.8 6.0 1830 1384 A 61 GLU H A 55 ILE HG2% 1.0 1.8 6.0 1831 1385 A 57 ASP HA A 61 GLU H 1.0 1.8 6.0 1832 1386 A 61 GLU H A 60 ALA HA 1.0 1.8 5.0 1833 1387 A 60 ALA HB% A 61 GLU H 1.0 1.8 5.0 1834 1388 A 61 GLU H A 60 ALA H 1.0 1.8 5.0 1835 1389 A 61 GLU H A 61 GLU HB3 1.0 1.8 6.0 1836 1389 A 61 GLU H A 61 GLU HB2 1.0 1.8 6.0 1837 1390 A 61 GLU H A 61 GLU HG2 1.0 1.8 6.0 1838 1390 A 61 GLU H A 61 GLU HG3 1.0 1.8 6.0 1839 1391 A 61 GLU H A 62 LYS H 1.0 1.8 5.0 1840 1392 A 62 LYS H A 62 LYS HA 1.0 1.8 2.8 1841 1393 A 62 LYS HA A 63 ILE H 1.0 1.8 3.4 1842 1394 A 62 LYS HG3 A 62 LYS HBy 1.0 1.8 3.8 1843 1394 A 62 LYS HBy A 62 LYS HG2 1.0 1.8 3.8 1844 1395 A 62 LYS H A 62 LYS HBy 1.0 1.8 3.8 1845 1395 A 62 LYS H A 62 LYS HB2 1.0 1.8 3.8 1846 1396 A 61 GLU HB2 A 62 LYS HG2 1.0 1.8 7.0 1847 1396 A 61 GLU HB3 A 62 LYS HG2 1.0 1.8 7.0 1848 1396 A 62 LYS HG3 A 61 GLU HB3 1.0 1.8 7.0 1849 1396 A 61 GLU HB2 A 62 LYS HG3 1.0 1.8 7.0 1850 1397 A 62 LYS HA A 62 LYS HG2 1.0 1.8 6.0 1851 1397 A 62 LYS HG3 A 62 LYS HA 1.0 1.8 6.0 1852 1398 A 62 LYS H A 62 LYS HG2 1.0 1.8 6.0 1853 1398 A 62 LYS H A 62 LYS HG3 1.0 1.8 6.0 1854 1399 A 60 ALA HA A 62 LYS H 1.0 1.8 5.0 1855 1400 A 59 ASP HA A 62 LYS H 1.0 1.8 5.0 1856 1401 A 61 GLU HA A 62 LYS H 1.0 1.8 5.0 1857 1402 A 62 LYS H A 61 GLU HG2 1.0 1.8 6.0 1858 1402 A 61 GLU HG3 A 62 LYS H 1.0 1.8 6.0 1859 1403 A 61 GLU H A 62 LYS H 1.0 1.8 5.0 1860 1404 A 62 LYS H A 62 LYS HBy 1.0 1.8 6.0 1861 1404 A 62 LYS H A 62 LYS HB2 1.0 1.8 6.0 1862 1405 A 62 LYS H A 62 LYS HG2 1.0 1.8 6.0 1863 1405 A 62 LYS H A 62 LYS HG3 1.0 1.8 6.0 1864 1406 A 62 LYS H A 63 ILE H 1.0 1.8 5.0 1865 1407 A 63 ILE HA A 63 ILE HB 1.0 1.8 5.0 1866 1408 A 63 ILE HA A 63 ILE HG1x 1.0 1.8 5.0 1867 1409 A 63 ILE H A 63 ILE HA 1.0 1.8 2.8 1868 1410 A 63 ILE HA A 64 GLN H 1.0 1.8 3.4 1869 1411 A 63 ILE HB A 63 ILE HG1x 1.0 1.8 5.0 1870 1412 A 63 ILE H A 63 ILE HB 1.0 1.8 5.0 1871 1413 A 63 ILE HB A 63 ILE HG1x 1.0 1.8 2.8 1872 1414 A 63 ILE H A 63 ILE HG1x 1.0 1.8 5.0 1873 1415 A 64 GLN HE22 A 63 ILE HG1x 1.0 1.8 5.0 1874 1416 A 60 ALA HA A 63 ILE H 1.0 1.8 5.0 1875 1417 A 62 LYS H A 63 ILE H 1.0 1.8 5.0 1876 1418 A 63 ILE H A 64 GLN HG2 1.0 1.8 6.0 1877 1418 A 63 ILE H A 64 GLN HG3 1.0 1.8 6.0 1878 1419 A 64 GLN HA A 64 GLN HBx 1.0 1.8 5.0 1879 1420 A 64 GLN HA A 64 GLN HG2 1.0 1.8 6.0 1880 1420 A 64 GLN HA A 64 GLN HG3 1.0 1.8 6.0 1881 1421 A 64 GLN HA A 64 GLN H 1.0 1.8 2.8 1882 1422 A 64 GLN HA A 64 GLN HBx 1.0 1.8 5.0 1883 1423 A 64 GLN HE22 A 64 GLN HBx 1.0 1.8 5.0 1884 1424 A 64 GLN H A 64 GLN HBx 1.0 1.8 5.0 1885 1425 A 64 GLN HA A 64 GLN HBy 1.0 1.8 5.0 1886 1426 A 64 GLN HE22 A 64 GLN HBy 1.0 1.8 5.0 1887 1427 A 64 GLN H A 64 GLN HBy 1.0 1.8 5.0 1888 1428 A 63 ILE H A 64 GLN HG2 1.0 1.8 6.0 1889 1428 A 63 ILE H A 64 GLN HG3 1.0 1.8 6.0 1890 1429 A 64 GLN HA A 64 GLN HG2 1.0 1.8 6.0 1891 1429 A 64 GLN HA A 64 GLN HG3 1.0 1.8 6.0 1892 1430 A 64 GLN HG3 A 64 GLN HBx 1.0 1.8 2.8 1893 1430 A 64 GLN HBx A 64 GLN HG2 1.0 1.8 2.8 1894 1431 A 64 GLN HE21 A 64 GLN HG2 1.0 1.8 3.8 1895 1431 A 64 GLN HG3 A 64 GLN HE21 1.0 1.8 3.8 1896 1432 A 64 GLN HE22 A 64 GLN HG2 1.0 1.8 3.8 1897 1432 A 64 GLN HE22 A 64 GLN HG3 1.0 1.8 3.8 1898 1433 A 64 GLN H A 64 GLN HG2 1.0 1.8 6.0 1899 1433 A 64 GLN H A 64 GLN HG3 1.0 1.8 6.0 1900 1434 A 63 ILE HA A 64 GLN H 1.0 1.8 5.0 1901 1435 A 64 GLN H A 63 ILE HG1x 1.0 1.8 5.0 1902 1436 A 64 GLN H A 63 ILE HG2% 1.0 1.8 5.0 1903 1437 A 64 GLN HA A 64 GLN H 1.0 1.8 2.8 1904 1438 A 64 GLN H A 64 GLN HBy 1.0 1.8 6.0 1905 1438 A 64 GLN H A 64 GLN HBx 1.0 1.8 6.0 1906 1439 A 64 GLN H A 64 GLN HE21 1.0 1.8 5.0 1907 1440 A 64 GLN H A 64 GLN HG2 1.0 1.8 6.0 1908 1440 A 64 GLN H A 64 GLN HG3 1.0 1.8 6.0 1909 1441 A 64 GLN H A 65 SER H 1.0 1.8 5.0 1910 1442 A 64 GLN H A 68 ASP HBx 1.0 1.8 5.0 1911 1443 A 64 GLN H A 68 ASP HBy 1.0 1.8 5.0 1912 1444 A 66 ILE HA A 65 SER HA 1.0 1.8 5.0 1913 1445 A 66 ILE HG1x A 65 SER HA 1.0 1.8 5.0 1914 1446 A 65 SER HA A 66 ILE H 1.0 1.8 3.4 1915 1447 A 28 HIS HA A 65 SER HA 1.0 1.8 6.0 1916 1448 A 64 GLN HBx A 65 SER H 1.0 1.8 5.0 1917 1449 A 65 SER H A 64 GLN HBy 1.0 1.8 5.0 1918 1450 A 64 GLN HE21 A 65 SER H 1.0 1.8 5.0 1919 1451 A 64 GLN H A 65 SER H 1.0 1.8 5.0 1920 1452 A 65 SER H A 66 ILE H 1.0 1.8 5.0 1921 1453 A 66 ILE HA A 65 SER HA 1.0 1.8 5.0 1922 1454 A 66 ILE HG1x A 66 ILE HA 1.0 1.8 5.0 1923 1455 A 66 ILE HG2% A 66 ILE HA 1.0 1.8 5.0 1924 1456 A 66 ILE HA A 66 ILE H 1.0 1.8 2.8 1925 1457 A 66 ILE HG1x A 66 ILE HB 1.0 1.8 2.8 1926 1458 A 27 SER HA A 66 ILE H 1.0 1.8 6.0 1927 1459 A 65 SER HA A 66 ILE H 1.0 1.8 5.0 1928 1460 A 65 SER H A 66 ILE H 1.0 1.8 5.0 1929 1461 A 66 ILE HA A 66 ILE H 1.0 1.8 2.8 1930 1462 A 66 ILE H A 66 ILE HB 1.0 1.8 5.0 1931 1463 A 66 ILE HG1x A 66 ILE H 1.0 1.8 5.0 1932 1464 A 66 ILE HG2% A 66 ILE H 1.0 1.8 5.0 1933 1465 A 67 PRO HA A 68 ASP H 1.0 1.8 5.0 1934 1466 A 67 PRO HA A 71 GLU H 1.0 1.8 5.0 1935 1467 A 68 ASP HA A 68 ASP HBx 1.0 1.8 5.0 1936 1468 A 68 ASP HA A 68 ASP HBy 1.0 1.8 5.0 1937 1469 A 68 ASP H A 68 ASP HA 1.0 1.8 2.8 1938 1470 A 68 ASP HA A 69 ALA H 1.0 1.8 3.4 1939 1471 A 68 ASP HA A 72 TYR H 1.0 1.8 5.0 1940 1472 A 68 ASP HA A 68 ASP HBx 1.0 1.8 5.0 1941 1473 A 68 ASP H A 68 ASP HBx 1.0 1.8 5.0 1942 1474 A 68 ASP HA A 68 ASP HBy 1.0 1.8 5.0 1943 1475 A 68 ASP H A 68 ASP HBy 1.0 1.8 5.0 1944 1476 A 67 PRO HBx A 68 ASP HBy 1.0 1.8 6.0 1945 1476 A 67 PRO HBy A 68 ASP HBy 1.0 1.8 6.0 1946 1476 A 68 ASP HBx A 67 PRO HBy 1.0 1.8 6.0 1947 1476 A 68 ASP HBx A 67 PRO HBx 1.0 1.8 6.0 1948 1477 A 69 ALA H A 68 ASP HBy 1.0 1.8 4.4 1949 1477 A 69 ALA H A 68 ASP HBx 1.0 1.8 4.4 1950 1478 A 67 PRO HA A 68 ASP H 1.0 1.8 5.0 1951 1479 A 68 ASP H A 67 PRO HBy 1.0 1.8 5.0 1952 1480 A 68 ASP H A 67 PRO HBx 1.0 1.8 5.0 1953 1481 A 68 ASP H A 68 ASP HA 1.0 1.8 2.8 1954 1482 A 68 ASP H A 68 ASP HBx 1.0 1.8 5.0 1955 1483 A 68 ASP H A 68 ASP HBy 1.0 1.8 5.0 1956 1484 A 68 ASP H A 69 ALA H 1.0 1.8 5.0 1957 1485 A 69 ALA H A 69 ALA HA 1.0 1.8 2.8 1958 1486 A 69 ALA HA A 70 VAL H 1.0 1.8 3.4 1959 1487 A 69 ALA HA A 69 ALA HB% 1.0 1.8 5.0 1960 1488 A 70 VAL H A 69 ALA HB% 1.0 1.8 5.0 1961 1489 A 69 ALA H A 63 ILE HG1x 1.0 2.8 6.0 1962 1490 A 65 SER HA A 69 ALA H 1.0 1.8 6.0 1963 1491 A 65 SER H A 69 ALA H 1.0 1.8 5.0 1964 1492 A 68 ASP HA A 69 ALA H 1.0 1.8 5.0 1965 1493 A 69 ALA H A 68 ASP HBx 1.0 1.8 5.0 1966 1494 A 69 ALA H A 68 ASP HBy 1.0 1.8 5.0 1967 1495 A 68 ASP H A 69 ALA H 1.0 1.8 5.0 1968 1496 A 69 ALA H A 69 ALA HA 1.0 1.8 2.8 1969 1497 A 69 ALA H A 69 ALA HB% 1.0 1.8 5.0 1970 1498 A 69 ALA H A 70 VAL H 1.0 1.8 5.0 1971 1499 A 70 VAL HA A 70 VAL HG1% 1.0 1.8 5.0 1972 1500 A 70 VAL HG2% A 70 VAL HA 1.0 1.8 5.0 1973 1501 A 70 VAL H A 70 VAL HA 1.0 1.8 2.8 1974 1502 A 71 GLU H A 70 VAL HA 1.0 1.8 3.4 1975 1503 A 74 ALA H A 70 VAL HA 1.0 1.8 5.0 1976 1504 A 70 VAL HA A 70 VAL HB 1.0 1.8 5.0 1977 1505 A 70 VAL HB A 70 VAL HG1% 1.0 1.8 2.8 1978 1506 A 70 VAL HG2% A 70 VAL HB 1.0 1.8 2.8 1979 1507 A 70 VAL H A 70 VAL HB 1.0 1.8 5.0 1980 1508 A 66 ILE HA A 70 VAL H 1.0 1.8 5.0 1981 1509 A 70 VAL H A 69 ALA HB% 1.0 1.8 5.0 1982 1510 A 69 ALA H A 70 VAL H 1.0 1.8 5.0 1983 1511 A 70 VAL H A 70 VAL HA 1.0 1.8 2.8 1984 1512 A 70 VAL H A 70 VAL HB 1.0 1.8 5.0 1985 1513 A 70 VAL H A 70 VAL HG1% 1.0 1.8 5.0 1986 1514 A 70 VAL HG2% A 70 VAL H 1.0 1.8 5.0 1987 1515 A 71 GLU H A 70 VAL H 1.0 1.8 5.0 1988 1516 A 72 TYR H A 70 VAL H 1.0 1.8 5.0 1989 1517 A 74 ALA H A 70 VAL H 1.0 1.8 6.0 1990 1518 A 71 GLU H A 71 GLU HA 1.0 1.8 2.8 1991 1519 A 71 GLU H A 71 GLU HB2 1.0 1.8 6.0 1992 1519 A 71 GLU H A 71 GLU HB3 1.0 1.8 6.0 1993 1520 A 72 TYR H A 71 GLU HB2 1.0 1.8 6.0 1994 1520 A 72 TYR H A 71 GLU HB3 1.0 1.8 6.0 1995 1521 A 70 VAL H A 71 GLU HGy 1.0 1.8 6.0 1996 1521 A 70 VAL H A 71 GLU HG2 1.0 1.8 6.0 1997 1522 A 71 GLU H A 71 GLU HGy 1.0 1.8 6.0 1998 1522 A 71 GLU H A 71 GLU HG2 1.0 1.8 6.0 1999 1523 A 67 PRO HA A 71 GLU H 1.0 1.8 5.0 2000 1524 A 71 GLU H A 70 VAL HA 1.0 1.8 5.0 2001 1525 A 71 GLU H A 70 VAL HG1% 1.0 1.8 6.0 2002 1525 A 70 VAL HG2% A 71 GLU H 1.0 1.8 6.0 2003 1526 A 71 GLU H A 71 GLU HA 1.0 1.8 2.8 2004 1527 A 71 GLU H A 71 GLU HB2 1.0 1.8 5.0 2005 1527 A 71 GLU H A 71 GLU HB3 1.0 1.8 5.0 2006 1528 A 71 GLU H A 71 GLU HGy 1.0 1.8 5.0 2007 1529 A 71 GLU H A 71 GLU HG2 1.0 1.8 5.0 2008 1530 A 74 ALA HB% A 71 GLU H 1.0 1.8 5.0 2009 1531 A 72 TYR HA A 72 TYR HBx 1.0 1.8 5.0 2010 1532 A 72 TYR HA A 72 TYR HBy 1.0 1.8 5.0 2011 1533 A 72 TYR H A 72 TYR HA 1.0 1.8 2.8 2012 1534 A 72 TYR HA A 76 ASN HD21 1.0 1.8 5.0 2013 1535 A 72 TYR HA A 76 ASN HD22 1.0 1.8 5.0 2014 1536 A 72 TYR HA A 76 ASN H 1.0 1.8 5.0 2015 1537 A 72 TYR HA A 72 TYR HBx 1.0 1.8 5.0 2016 1538 A 72 TYR H A 72 TYR HBx 1.0 1.8 5.0 2017 1539 A 73 ILE H A 72 TYR HBx 1.0 1.8 5.0 2018 1540 A 72 TYR HA A 72 TYR HBy 1.0 1.8 5.0 2019 1541 A 72 TYR H A 72 TYR HBy 1.0 1.8 5.0 2020 1542 A 73 ILE H A 72 TYR HBy 1.0 1.8 5.0 2021 1543 A 71 GLU H A 72 TYR HBx 1.0 1.8 6.0 2022 1543 A 71 GLU H A 72 TYR HBy 1.0 1.8 6.0 2023 1544 A 72 TYR HD1 A 55 ILE HG2% 1.0 1.8 7.0 2024 1545 A 72 TYR HD1 A 55 ILE HG1x 1.0 1.8 7.0 2025 1545 A 55 ILE HG1x A 72 TYR HDy 1.0 1.8 7.0 2026 1546 A 72 TYR HD1 A 63 ILE HD1% 1.0 1.8 7.0 2027 1546 A 63 ILE HD1% A 72 TYR HDy 1.0 1.8 7.0 2028 1547 A 72 TYR HA A 72 TYR HD1 1.0 1.8 6.0 2029 1547 A 72 TYR HA A 72 TYR HDy 1.0 1.8 6.0 2030 1548 A 72 TYR HBy A 72 TYR HDy 1.0 1.8 5.4 2031 1548 A 72 TYR HBx A 72 TYR HDy 1.0 1.8 5.4 2032 1548 A 72 TYR HD1 A 72 TYR HBx 1.0 1.8 5.4 2033 1548 A 72 TYR HBy A 72 TYR HD1 1.0 1.8 5.4 2034 1549 A 72 TYR H A 72 TYR HD1 1.0 1.8 6.0 2035 1549 A 72 TYR H A 72 TYR HDy 1.0 1.8 6.0 2036 1550 A 72 TYR HD1 A 73 ILE HB 1.0 1.8 7.0 2037 1550 A 73 ILE HB A 72 TYR HDy 1.0 1.8 7.0 2038 1551 A 72 TYR HD1 A 73 ILE HG1y 1.0 1.8 6.0 2039 1551 A 72 TYR HDy A 73 ILE HG1y 1.0 1.8 6.0 2040 1552 A 73 ILE H A 72 TYR HD1 1.0 1.8 6.0 2041 1552 A 73 ILE H A 72 TYR HDy 1.0 1.8 6.0 2042 1553 A 72 TYR HE% A 55 ILE HG1x 1.0 1.8 6.0 2043 1554 A 72 TYR HE% A 63 ILE HD1% 1.0 1.8 7.0 2044 1555 A 72 TYR HE% A 72 TYR HBx 1.0 1.8 7.0 2045 1555 A 72 TYR HE% A 72 TYR HBy 1.0 1.8 7.0 2046 1556 A 72 TYR HE% A 72 TYR H 1.0 1.8 6.0 2047 1557 A 72 TYR HE% A 73 ILE HG1y 1.0 1.8 5.0 2048 1558 A 72 TYR HE% A 73 ILE HG2% 1.0 1.8 5.0 2049 1559 A 72 TYR HE% A 73 ILE H 1.0 1.8 6.0 2050 1560 A 68 ASP HA A 72 TYR H 1.0 1.8 5.0 2051 1561 A 72 TYR H A 70 VAL H 1.0 1.8 5.0 2052 1562 A 72 TYR H A 71 GLU HA 1.0 1.8 5.0 2053 1563 A 72 TYR H A 71 GLU HB2 1.0 1.8 6.0 2054 1563 A 72 TYR H A 71 GLU HB3 1.0 1.8 6.0 2055 1564 A 72 TYR H A 71 GLU HGy 1.0 1.8 6.0 2056 1564 A 72 TYR H A 71 GLU HG2 1.0 1.8 6.0 2057 1565 A 71 GLU H A 72 TYR H 1.0 1.8 5.0 2058 1566 A 72 TYR H A 72 TYR HA 1.0 1.8 2.8 2059 1567 A 72 TYR H A 72 TYR HBx 1.0 1.8 5.0 2060 1568 A 72 TYR H A 72 TYR HBy 1.0 1.8 5.0 2061 1569 A 72 TYR H A 73 ILE HG1y 1.0 1.8 6.0 2062 1569 A 72 TYR H A 73 ILE HG2% 1.0 1.8 6.0 2063 1569 A 73 ILE HG12 A 72 TYR H 1.0 1.8 6.0 2064 1570 A 74 ALA H A 72 TYR H 1.0 1.8 5.0 2065 1571 A 73 ILE HA A 73 ILE HB 1.0 1.8 5.0 2066 1572 A 73 ILE HD1% A 73 ILE HA 1.0 1.8 5.0 2067 1573 A 73 ILE H A 73 ILE HA 1.0 1.8 2.8 2068 1574 A 74 ALA H A 73 ILE HA 1.0 1.8 3.4 2069 1575 A 76 ASN HD21 A 73 ILE HA 1.0 1.8 5.0 2070 1576 A 73 ILE HB A 4 VAL HG1% 1.0 1.8 7.0 2071 1576 A 4 VAL HG2% A 73 ILE HB 1.0 1.8 7.0 2072 1577 A 73 ILE HA A 73 ILE HB 1.0 1.8 2.8 2073 1578 A 73 ILE HB A 73 ILE HG1y 1.0 1.8 2.8 2074 1579 A 73 ILE H A 73 ILE HB 1.0 1.8 5.0 2075 1580 A 74 ALA H A 73 ILE HB 1.0 1.8 5.0 2076 1581 A 73 ILE HD1% A 51 PHE HD1 1.0 1.8 7.0 2077 1581 A 73 ILE HD1% A 51 PHE HDy 1.0 1.8 7.0 2078 1582 A 73 ILE HD1% A 73 ILE H 1.0 1.8 5.0 2079 1583 A 69 ALA HA A 73 ILE H 1.0 2.8 6.0 2080 1584 A 72 TYR HA A 73 ILE H 1.0 1.8 3.4 2081 1585 A 73 ILE H A 72 TYR HBx 1.0 1.8 5.0 2082 1586 A 73 ILE H A 72 TYR HBy 1.0 1.8 5.0 2083 1587 A 72 TYR H A 73 ILE H 1.0 1.8 5.0 2084 1588 A 73 ILE H A 73 ILE HA 1.0 1.8 2.8 2085 1589 A 73 ILE H A 73 ILE HB 1.0 1.8 5.0 2086 1590 A 73 ILE HD1% A 73 ILE H 1.0 1.8 5.0 2087 1591 A 74 ALA HB% A 73 ILE H 1.0 1.8 5.0 2088 1592 A 74 ALA H A 73 ILE H 1.0 1.8 5.0 2089 1593 A 76 ASN HD21 A 73 ILE H 1.0 1.8 5.0 2090 1594 A 76 ASN HD21 A 73 ILE H 1.0 1.8 6.0 2091 1594 A 76 ASN HD22 A 73 ILE H 1.0 1.8 6.0 2092 1595 A 74 ALA HB% A 74 ALA HA 1.0 1.8 5.0 2093 1596 A 74 ALA H A 74 ALA HA 1.0 1.8 2.8 2094 1597 A 74 ALA HA A 75 GLN H 1.0 1.8 3.4 2095 1598 A 74 ALA HB% A 4 VAL HG1% 1.0 1.8 7.0 2096 1598 A 4 VAL HG2% A 74 ALA HB% 1.0 1.8 7.0 2097 1599 A 74 ALA HB% A 74 ALA HA 1.0 1.8 5.0 2098 1600 A 74 ALA H A 74 ALA HB% 1.0 1.8 5.0 2099 1601 A 74 ALA HB% A 75 GLN H 1.0 1.8 5.0 2100 1602 A 74 ALA H A 4 VAL HG1% 1.0 1.8 7.0 2101 1602 A 4 VAL HG2% A 74 ALA H 1.0 1.8 7.0 2102 1603 A 74 ALA H A 70 VAL HA 1.0 1.8 5.0 2103 1604 A 74 ALA H A 71 GLU HA 1.0 1.8 5.0 2104 1605 A 74 ALA H A 71 GLU H 1.0 1.8 5.0 2105 1606 A 74 ALA H A 72 TYR HBx 1.0 1.8 6.0 2106 1606 A 74 ALA H A 72 TYR HBy 1.0 1.8 6.0 2107 1607 A 74 ALA H A 72 TYR H 1.0 1.8 5.0 2108 1608 A 74 ALA H A 73 ILE HA 1.0 1.8 5.0 2109 1609 A 74 ALA H A 73 ILE H 1.0 1.8 5.0 2110 1610 A 74 ALA H A 74 ALA HA 1.0 1.8 2.8 2111 1611 A 74 ALA H A 74 ALA HB% 1.0 1.8 5.0 2112 1612 A 74 ALA H A 75 GLN HB2 1.0 1.8 6.0 2113 1612 A 74 ALA H A 75 GLN HBy 1.0 1.8 6.0 2114 1613 A 74 ALA H A 75 GLN HE21 1.0 1.8 5.0 2115 1614 A 74 ALA H A 75 GLN H 1.0 1.8 5.0 2116 1615 A 74 ALA HA A 75 GLN HA 1.0 1.8 5.0 2117 1616 A 75 GLN HBy A 75 GLN HA 1.0 1.8 5.0 2118 1617 A 75 GLN H A 75 GLN HA 1.0 1.8 2.8 2119 1618 A 76 ASN H A 75 GLN HA 1.0 1.8 3.4 2120 1619 A 75 GLN HA A 78 MET HGx 1.0 1.8 6.0 2121 1619 A 75 GLN HA A 78 MET HGy 1.0 1.8 6.0 2122 1620 A 75 GLN HBy A 75 GLN HG2 1.0 1.8 2.8 2123 1620 A 75 GLN HBy A 75 GLN HGy 1.0 1.8 2.8 2124 1621 A 75 GLN H A 75 GLN HB2 1.0 1.8 6.0 2125 1621 A 75 GLN H A 75 GLN HBy 1.0 1.8 6.0 2126 1622 A 74 ALA HB% A 75 GLN HE21 1.0 1.8 5.0 2127 1623 A 75 GLN HE21 A 75 GLN HB2 1.0 1.8 6.0 2128 1623 A 75 GLN HBy A 75 GLN HE21 1.0 1.8 6.0 2129 1624 A 75 GLN HE21 A 75 GLN HGy 1.0 1.8 3.8 2130 1624 A 75 GLN HE21 A 75 GLN HG2 1.0 1.8 3.8 2131 1625 A 75 GLN HE22 A 75 GLN HB2 1.0 1.8 6.0 2132 1625 A 75 GLN HBy A 75 GLN HE22 1.0 1.8 6.0 2133 1626 A 75 GLN HE22 A 75 GLN HGy 1.0 1.8 3.8 2134 1626 A 75 GLN HG2 A 75 GLN HE22 1.0 1.8 3.8 2135 1627 A 75 GLN HE21 A 75 GLN HGy 1.0 1.8 3.4 2136 1628 A 75 GLN HE21 A 75 GLN HG2 1.0 1.8 3.4 2137 1629 A 75 GLN HA A 75 GLN HGy 1.0 1.8 6.0 2138 1629 A 75 GLN HA A 75 GLN HG2 1.0 1.8 6.0 2139 1630 A 75 GLN H A 75 GLN HGy 1.0 1.8 6.0 2140 1630 A 75 GLN H A 75 GLN HG2 1.0 1.8 6.0 2141 1631 A 71 GLU HA A 75 GLN H 1.0 1.8 5.0 2142 1632 A 72 TYR H A 75 GLN H 1.0 1.8 5.0 2143 1633 A 74 ALA HA A 75 GLN H 1.0 1.8 5.0 2144 1634 A 74 ALA HB% A 75 GLN H 1.0 1.8 5.0 2145 1635 A 74 ALA H A 75 GLN H 1.0 1.8 5.0 2146 1636 A 75 GLN H A 75 GLN HA 1.0 1.8 2.8 2147 1637 A 75 GLN H A 75 GLN HB2 1.0 1.8 3.8 2148 1637 A 75 GLN H A 75 GLN HBy 1.0 1.8 3.8 2149 1638 A 75 GLN H A 75 GLN HGy 1.0 1.8 6.0 2150 1638 A 75 GLN H A 75 GLN HG2 1.0 1.8 6.0 2151 1639 A 76 ASN H A 75 GLN H 1.0 1.8 5.0 2152 1640 A 76 ASN HA A 76 ASN HBx 1.0 1.8 5.0 2153 1641 A 76 ASN HD21 A 76 ASN HBx 1.0 1.8 3.4 2154 1642 A 76 ASN H A 76 ASN HBx 1.0 1.8 5.0 2155 1643 A 76 ASN HA A 76 ASN HBy 1.0 1.8 5.0 2156 1644 A 76 ASN HD21 A 76 ASN HBy 1.0 1.8 3.4 2157 1645 A 76 ASN H A 76 ASN HBy 1.0 1.8 5.0 2158 1646 A 73 ILE HA A 76 ASN HBx 1.0 1.8 6.0 2159 1646 A 73 ILE HA A 76 ASN HBy 1.0 1.8 6.0 2160 1647 A 76 ASN HD22 A 76 ASN HBx 1.0 1.8 5.0 2161 1647 A 76 ASN HD22 A 76 ASN HBy 1.0 1.8 5.0 2162 1648 A 76 ASN HD21 A 76 ASN HA 1.0 1.8 5.0 2163 1649 A 76 ASN HD21 A 76 ASN HBx 1.0 1.8 3.4 2164 1650 A 76 ASN HD21 A 76 ASN HBy 1.0 1.8 3.4 2165 1651 A 76 ASN HD21 A 76 ASN H 1.0 1.8 5.0 2166 1652 A 76 ASN HD22 A 76 ASN HA 1.0 1.8 5.0 2167 1653 A 76 ASN HD22 A 76 ASN HBx 1.0 1.8 5.0 2168 1654 A 76 ASN HD22 A 76 ASN HBy 1.0 1.8 5.0 2169 1655 A 72 TYR HA A 76 ASN H 1.0 1.8 5.0 2170 1656 A 74 ALA H A 4 VAL HG1% 1.0 1.8 7.0 2171 1656 A 4 VAL HG2% A 74 ALA H 1.0 1.8 7.0 2172 1657 A 76 ASN H A 75 GLN HA 1.0 1.8 5.0 2173 1658 A 76 ASN H A 75 GLN H 1.0 1.8 5.0 2174 1659 A 76 ASN H A 76 ASN HA 1.0 1.8 2.8 2175 1660 A 76 ASN H A 76 ASN HBx 1.0 1.8 5.0 2176 1661 A 76 ASN H A 76 ASN HBy 1.0 1.8 5.0 2177 1662 A 76 ASN HD21 A 76 ASN H 1.0 1.8 5.0 2178 1663 A 78 MET HA A 78 MET HGx 1.0 1.8 5.0 2179 1664 A 78 MET HGy A 78 MET HA 1.0 1.8 5.0 2180 1665 A 78 MET HA A 79 ALA H 1.0 1.8 3.4 2181 1666 A 74 ALA HA A 78 MET H 1.0 1.8 5.0 2182 1667 A 78 MET H A 77 PRO HA 1.0 1.8 5.0 2183 1668 A 78 MET H A 77 PRO HBx 1.0 1.8 5.0 2184 1669 A 77 PRO HBy A 78 MET H 1.0 1.8 5.0 2185 1670 A 78 MET HA A 78 MET H 1.0 1.8 2.8 2186 1671 A 78 MET H A 78 MET HBx 1.0 1.8 6.0 2187 1671 A 78 MET H A 78 MET HBy 1.0 1.8 6.0 2188 1672 A 78 MET H A 78 MET HGx 1.0 1.8 6.0 2189 1672 A 78 MET HGy A 78 MET H 1.0 1.8 6.0 2190 1673 A 78 MET H A 79 ALA HB% 1.0 1.8 5.0 2191 1674 A 79 ALA H A 78 MET H 1.0 1.8 5.0 2192 1675 A 79 ALA H A 79 ALA HA 1.0 1.8 2.8 2193 1676 A 79 ALA HA A 80 LYS HG2 1.0 1.8 6.0 2194 1676 A 80 LYS HGy A 79 ALA HA 1.0 1.8 6.0 2195 1677 A 79 ALA HA A 80 LYS H 1.0 1.8 3.4 2196 1678 A 79 ALA H A 78 MET H 1.0 1.8 5.0 2197 1679 A 79 ALA H A 79 ALA HA 1.0 1.8 2.8 2198 1680 A 75 GLN HA A 79 ALA H 1.0 1.8 5.0 2199 1681 A 79 ALA H A 79 ALA HB% 1.0 1.8 5.0 2200 1682 A 79 ALA H A 80 LYS H 1.0 1.8 5.0 2201 1683 A 80 LYS HA A 80 LYS HBy 1.0 1.8 5.0 2202 1684 A 80 LYS HD2 A 80 LYS HA 1.0 1.8 5.0 2203 1685 A 80 LYS H A 80 LYS HA 1.0 1.8 2.8 2204 1686 A 80 LYS HA A 80 LYS HBy 1.0 1.8 2.8 2205 1687 A 80 LYS HGy A 80 LYS HBy 1.0 1.8 2.8 2206 1687 A 80 LYS HBy A 80 LYS HG2 1.0 1.8 2.8 2207 1688 A 80 LYS HD2 A 80 LYS HBy 1.0 1.8 4.4 2208 1688 A 80 LYS HD2 A 80 LYS HB2 1.0 1.8 4.4 2209 1689 A 80 LYS H A 80 LYS HBy 1.0 1.8 6.0 2210 1689 A 80 LYS H A 80 LYS HB2 1.0 1.8 6.0 2211 1690 A 80 LYS H A 80 LYS HA 1.0 1.8 2.8 2212 1691 A 80 LYS H A 80 LYS HBy 1.0 1.8 6.0 2213 1691 A 80 LYS H A 80 LYS HB2 1.0 1.8 6.0 2214 1692 A 80 LYS HD2 A 80 LYS H 1.0 1.8 5.0 2215 1693 A 80 LYS H A 80 LYS HG2 1.0 1.8 5.0 2216 1693 A 80 LYS HGy A 80 LYS H 1.0 1.8 5.0 2217 1694 A 76 ASN HA A 80 LYS H 1.0 1.8 5.0 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 2 ASN C A 2 ASN CA A 2 ASN N A 1 MET C 1.0 -72.00 -60.00 . 2 2 A 2 ASN N A 2 ASN CA A 2 ASN C A 3 ASP N 1.0 -46.00 -32.00 PSI 3 3 A 3 ASP C A 3 ASP CA A 3 ASP N A 2 ASN C 1.0 -86.00 -52.00 . 4 4 A 3 ASP N A 3 ASP CA A 3 ASP C A 4 VAL N 1.0 -52.50 -26.50 PSI 5 5 A 4 VAL C A 4 VAL CA A 4 VAL N A 3 ASP C 1.0 -71.00 -61.00 . 6 6 A 4 VAL N A 4 VAL CA A 4 VAL C A 5 LEU N 1.0 -47.00 -35.00 PSI 7 7 A 5 LEU C A 5 LEU CA A 5 LEU N A 4 VAL C 1.0 -67.00 -55.00 . 8 8 A 5 LEU N A 5 LEU CA A 5 LEU C A 6 THR N 1.0 -45.00 -35.00 PSI 9 9 A 6 THR C A 6 THR CA A 5 LEU N A 5 LEU C 1.0 -73.00 -57.00 . 10 10 A 6 THR N A 6 THR CA A 6 THR C A 7 ARG N 1.0 -57.00 -49.00 PSI 11 11 A 7 ARG C A 7 ARG CA A 7 ARG N A 6 THR C 1.0 -77.00 -65.00 . 12 12 A 7 ARG N A 7 ARG CA A 7 ARG C A 8 VAL N 1.0 -51.00 -39.00 PSI 13 13 A 8 VAL C A 8 VAL CA A 8 VAL N A 7 ARG C 1.0 -66.00 -60.00 . 14 14 A 8 VAL N A 8 VAL CA A 8 VAL C A 9 LEU N 1.0 -50.00 -38.00 PSI 15 15 A 9 LEU C A 9 LEU CA A 9 LEU N A 8 VAL C 1.0 -67.00 -55.00 . 16 16 A 9 LEU N A 9 LEU CA A 9 LEU C A 10 GLU N 1.0 -45.00 -37.00 PSI 17 17 A 10 GLU C A 10 GLU CA A 10 GLU N A 9 LEU C 1.0 -65.00 -59.00 . 18 18 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 VAL N 1.0 -42.00 -34.00 PSI 19 19 A 11 VAL C A 11 VAL CA A 11 VAL N A 10 GLU C 1.0 -67.00 -59.00 . 20 20 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 VAL N 1.0 -55.00 -41.00 PSI 21 21 A 12 VAL C A 12 VAL CA A 12 VAL N A 11 VAL C 1.0 -70.00 -54.00 . 22 22 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 LYS N 1.0 -52.00 -42.00 PSI 23 23 A 13 LYS C A 13 LYS CA A 13 LYS N A 12 VAL C 1.0 -76.00 -54.00 . 24 24 A 13 LYS N A 13 LYS CA A 13 LYS C A 14 ASN N 1.0 -49.00 -19.00 PSI 25 25 A 14 ASN C A 14 ASN CA A 14 ASN N A 13 LYS C 1.0 -100.00 -84.00 . 26 26 A 14 ASN N A 14 ASN CA A 14 ASN C A 15 PHE N 1.0 -2.46 3.54 PSI 27 27 A 15 PHE C A 15 PHE CA A 15 PHE N A 14 ASN C 1.0 -113.00 -61.00 . 28 28 A 15 PHE N A 15 PHE CA A 15 PHE C A 16 GLU N 1.0 98.00 128.00 PSI 29 29 A 17 LYS C A 17 LYS CA A 17 LYS N A 16 GLU C 1.0 -93.00 -57.00 . 30 30 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 VAL N 1.0 -49.00 -33.00 PSI 31 31 A 18 VAL C A 18 VAL CA A 18 VAL N A 17 LYS C 1.0 -184.00 -152.00 . 32 32 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 ASP N 1.0 143.00 185.00 PSI 33 33 A 19 ASP C A 19 ASP CA A 19 ASP N A 18 VAL C 1.0 -96.00 -66.00 . 34 34 A 19 ASP N A 19 ASP CA A 19 ASP C A 20 ALA N 1.0 99.00 147.00 PSI 35 35 A 20 ALA C A 20 ALA CA A 20 ALA N A 19 ASP C 1.0 -66.00 -56.00 . 36 36 A 20 ALA N A 20 ALA CA A 20 ALA C A 21 SER N 1.0 -38.00 -14.00 PSI 37 37 A 21 SER C A 21 SER CA A 21 SER N A 20 ALA C 1.0 -83.00 -67.00 . 38 38 A 21 SER N A 21 SER CA A 21 SER C A 22 LYS N 1.0 -27.00 -5.00 PSI 39 39 A 22 LYS C A 22 LYS CA A 22 LYS N A 21 SER C 1.0 -118.00 -76.00 . 40 40 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 VAL N 1.0 -16.00 18.00 PSI 41 41 A 23 VAL C A 23 VAL CA A 23 VAL N A 22 LYS C 1.0 -92.00 -56.00 . 42 42 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 THR N 1.0 125.00 141.00 PSI 43 43 A 24 THR C A 24 THR CA A 24 THR N A 23 VAL C 1.0 -114.00 -78.00 . 44 44 A 24 THR N A 24 THR CA A 24 THR C A 25 PRO N 1.0 101.00 169.00 PSI 45 45 A 25 PRO C A 25 PRO CA A 25 PRO N A 24 THR C 1.0 -68.00 -56.00 . 46 46 A 25 PRO N A 25 PRO CA A 25 PRO C A 26 GLU N 1.0 -35.00 -17.00 PSI 47 47 A 26 GLU C A 26 GLU CA A 26 GLU N A 25 PRO C 1.0 -104.00 -72.00 . 48 48 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 SER N 1.0 -15.00 19.00 PSI 49 49 A 27 SER C A 27 SER CA A 27 SER N A 26 GLU C 1.0 -142.00 -60.00 . 50 50 A 27 SER N A 27 SER CA A 27 SER C A 28 HIS N 1.0 132.00 148.00 PSI 51 51 A 28 HIS C A 28 HIS CA A 28 HIS N A 27 SER C 1.0 -128.00 -80.00 . 52 52 A 28 HIS N A 28 HIS CA A 28 HIS C A 29 PHE N 1.0 123.00 149.00 PSI 53 53 A 29 PHE C A 29 PHE CA A 29 PHE N A 28 HIS C 1.0 -112.00 -68.00 . 54 54 A 30 VAL N A 30 VAL CA A 30 VAL C A 31 LYS N 1.0 -46.00 -32.00 PSI 55 55 A 31 LYS C A 31 LYS CA A 31 LYS N A 30 VAL C 1.0 -83.00 -41.00 . 56 56 A 31 LYS N A 31 LYS CA A 31 LYS C A 32 ASP N 1.0 -50.00 -20.00 PSI 57 57 A 32 ASP C A 32 ASP CA A 32 ASP N A 31 LYS C 1.0 -111.00 -87.00 . 58 58 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 LEU N 1.0 0.50 10.50 PSI 59 59 A 35 LEU C A 35 LEU CA A 35 LEU N A 34 GLY C 1.0 -90.00 -66.00 . 60 60 A 35 LEU N A 35 LEU CA A 35 LEU C A 36 ASN N 1.0 126.00 156.00 PSI 61 61 A 37 SER C A 37 SER CA A 37 SER N A 36 ASN C 1.0 -64.00 -54.00 . 62 62 A 37 SER N A 37 SER CA A 37 SER C A 38 LEU N 1.0 -62.00 -34.00 PSI 63 63 A 38 LEU C A 38 LEU CA A 38 LEU N A 37 SER C 1.0 -77.00 -49.00 . 64 64 A 38 LEU N A 38 LEU CA A 38 LEU C A 39 ASP N 1.0 -44.00 -6.00 PSI 65 65 A 39 ASP C A 39 ASP CA A 39 ASP N A 38 LEU C 1.0 -108.00 -66.00 . 66 66 A 39 ASP N A 39 ASP CA A 39 ASP C A 40 VAL N 1.0 -118.00 -98.00 PSI 67 67 A 40 VAL C A 40 VAL CA A 40 VAL N A 39 ASP C 1.0 -25.00 -15.00 . 68 68 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 VAL N 1.0 -43.00 -31.00 PSI 69 69 A 43 VAL C A 43 VAL CA A 43 VAL N A 42 GLU C 1.0 -68.00 -58.00 . 70 70 A 43 VAL N A 43 VAL CA A 43 VAL C A 44 VAL N 1.0 -56.00 -38.00 PSI 71 71 A 44 VAL C A 44 VAL CA A 44 VAL N A 43 VAL C 1.0 -66.00 -58.00 . 72 72 A 44 VAL N A 44 VAL CA A 44 VAL C A 42 GLU N 1.0 -45.00 -37.00 . 73 73 A 45 PHE C A 45 PHE CA A 45 PHE N A 44 VAL C 1.0 -98.00 -62.00 . 74 74 A 45 PHE N A 45 PHE CA A 45 PHE C A 46 ALA N 1.0 -38.00 -2.00 PSI 75 75 A 46 ALA C A 46 ALA CA A 46 ALA N A 45 PHE C 1.0 -127.00 -63.00 . 76 76 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 GLU N 1.0 -52.00 -30.00 PSI 77 77 A 48 GLU C A 48 GLU CA A 48 GLU N A 47 ILE C 1.0 -66.00 -56.00 . 78 78 A 48 GLU N A 48 GLU CA A 48 GLU C A 49 GLN N 1.0 -48.00 -36.00 PSI 79 79 A 49 GLN C A 49 GLN CA A 49 GLN N A 48 GLU C 1.0 -86.00 -54.00 . 80 80 A 50 GLU N A 50 GLU CA A 50 GLU C A 51 PHE N 1.0 36.00 54.00 PSI 81 81 A 52 ILE C A 52 ILE CA A 52 ILE N A 51 PHE C 1.0 51.00 65.00 . 82 82 A 52 ILE N A 52 ILE CA A 52 ILE C A 53 LEU N 1.0 26.00 52.00 PSI 83 83 A 53 LEU C A 52 ILE CA A 53 LEU N A 52 ILE C 1.0 -130.00 -82.00 . 84 84 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 ASP N 1.0 135.00 167.00 PSI 85 85 A 54 ASP C A 54 ASP CA A 54 ASP N A 53 LEU C 1.0 -128.00 -80.00 . 86 86 A 54 ASP N A 54 ASP CA A 54 ASP C A 55 ILE N 1.0 143.00 175.00 PSI 87 87 A 59 ASP C A 59 ASP CA A 59 ASP N A 58 HIS C 1.0 -102.00 -60.00 . 88 88 A 59 ASP N A 59 ASP CA A 59 ASP C A 60 ALA N 1.0 -45.00 -11.00 PSI 89 89 A 60 ALA C A 60 ALA CA A 60 ALA N A 59 ASP C 1.0 -88.00 -46.00 . 90 90 A 60 ALA N A 60 ALA CA A 60 ALA C A 61 GLU N 1.0 -49.00 -15.00 PSI 91 91 A 61 GLU C A 61 GLU CA A 61 GLU N A 60 ALA C 1.0 -94.00 -52.00 . 92 92 A 61 GLU N A 61 GLU CA A 61 GLU C A 62 LYS N 1.0 -36.00 -2.00 PSI 93 93 A 62 LYS C A 62 LYS CA A 62 LYS N A 61 GLU C 1.0 -115.00 -73.00 . 94 94 A 62 LYS N A 62 LYS CA A 62 LYS C A 63 ILE N 1.0 -20.00 14.00 PSI 95 95 A 63 ILE C A 63 ILE CA A 63 ILE N A 62 LYS C 1.0 -149.00 -107.00 . 96 96 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 GLN N 1.0 122.00 156.00 PSI 97 97 A 64 GLN C A 64 GLN CA A 64 GLN N A 63 ILE C 1.0 -118.00 -76.00 . 98 98 A 64 GLN N A 64 GLN CA A 64 GLN C A 65 SER N 1.0 -42.00 -8.00 PSI 99 99 A 66 ILE C A 66 ILE CA A 66 ILE N A 65 SER C 1.0 -75.00 -55.00 . 100 100 A 66 ILE N A 66 ILE CA A 66 ILE C A 67 PRO N 1.0 -47.00 -17.00 PSI 101 101 A 70 VAL C A 70 VAL CA A 70 VAL N A 69 ALA C 1.0 -74.00 -66.00 . 102 102 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 GLU N 1.0 -46.00 -16.00 PSI 103 103 A 72 TYR C A 72 TYR CA A 72 TYR N A 71 GLU C 1.0 -69.00 -61.00 . 104 104 A 72 TYR N A 72 TYR CA A 72 TYR C A 73 ILE N 1.0 -49.00 -39.00 PSI 105 105 A 73 ILE C A 73 ILE CA A 73 ILE N A 72 TYR C 1.0 -68.00 -56.00 . 106 106 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 ALA N 1.0 -51.00 -29.00 PSI 107 107 A 74 ALA C A 74 ALA CA A 74 ALA N A 73 ILE C 1.0 -65.00 -55.00 . 108 108 A 74 ALA N A 74 ALA CA A 74 ALA C A 75 GLN N 1.0 -49.00 -39.00 PSI 109 109 A 75 GLN C A 75 GLN CA A 75 GLN N A 74 ALA C 1.0 -162.00 -80.00 . 110 110 A 77 PRO C A 77 PRO CA A 77 PRO N A 76 ASN C 1.0 -107.00 -25.00 . 111 111 A 77 PRO N A 77 PRO CA A 77 PRO C A 78 MET N 1.0 -35.00 3.00 PSI 112 112 A 78 MET C A 78 MET CA A 78 MET N A 77 PRO C 1.0 -131.00 -49.00 . 113 113 A 78 MET N A 78 MET CA A 78 MET C A 79 ALA N 1.0 -19.00 19.00 PSI stop_ save_